G4VAW0_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession G4VAW0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 727 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	32.9	Very low	241 Å²	241	150.5 Å²	150.5	100%	1.187	87%	0.871	S	S	*	*				0	97.1	0	-70.8	168	172.2	0	0	107.4
2	N	31.4	Very low	32.9	Very low	171 Å²	171	151.7 Å²	151.7	91%	0.914	87%	0.872	S	S	*	*			trans	-119.4	123.1	175.7	-73.7	-0.3	0	0	0	107.7
3	A	34.8	Very low	32.8	Very low	107 Å²	107	145.3 Å²	145.3	88%	0.884	86%	0.86	S	S	*	*			trans	-106.1	128.9	173.9	0	0	0	0	0	109.3
4	C	31.5	Very low	32.8	Very low	114 Å²	114	145.6 Å²	145.6	77%	0.77	86%	0.863	S	S	*	*			trans	-98.9	116.8	171.5	-175.4	0	0	0	0	108.6	H6	C4-H6 PolarHBondContact O-N 3.26Å
5	G	33.9	Very low	33	Very low	79 Å²	79	145.3 Å²	145.3	81%	0.814	85%	0.854	S	S	*	*			trans	-72.5	110.2	-178.3	0	0	0	0	0	111.8
6	H	32.8	Very low	33.1	Very low	166 Å²	166	146.3 Å²	146.3	77%	0.769	85%	0.854	S	S	*	*			trans	-76.2	164.5	178.9	-105.6	60.2	0	0	0	114	C4	C4-H6 PolarHBondContact O-N 3.26Å
7	C	35.4	Very low	33	Very low	124 Å²	124	141.9 Å²	141.9	84%	0.838	85%	0.847	S	S	*	*			trans	-34.5	133.6	165.7	-54.9	0	0	0	0	114
8	R	30.2	Very low	33.1	Very low	239 Å²	239	145.4 Å²	145.4	90%	0.902	85%	0.854	S	S	*	*			trans	-99.2	114.7	158.3	-73.7	-177.9	173.5	-172.1	-2.3	109
9	I	35.6	Very low	32.9	Very low	169 Å²	169	143.8 Å²	143.8	87%	0.867	85%	0.851	S	S	*	*			trans	174.9	114.9	139.9	-86.5	148	0	0	0	103.9
10	G	29.6	Very low	32.7	Very low	70 Å²	70	142.4 Å²	142.4	72%	0.722	85%	0.847	S	S	*	*			trans	-103.7	153.6	175.6	0	0	0	0	0	110.7
11	L	33.4	Very low	32.5	Very low	175 Å²	175	140.9 Å²	140.9	92%	0.916	84%	0.84	S	S	*	*			trans	-136.6	133.7	152.7	-89.4	171.2	0	0	0	107.2
12	D	33	Very low	32.3	Very low	165 Å²	165	135 Å²	135	88%	0.882	82%	0.818	S	S	*	*			trans	-77.1	155.2	-167.2	-62.7	-74.9	0	0	0	114.1
13	G	32.3	Very low	32.2	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	81%	0.808	S	S	*	*			trans	98.1	75.4	140.7	0	0	0	0	0	118.6
14	V	32.7	Very low	31.7	Very low	149 Å²	149	134.6 Å²	134.6	90%	0.903	80%	0.803	S	S	*	*			trans	-134.6	130.7	135.6	-175.7	0	0	0	0	108.5
15	I	35.8	Very low	31.7	Very low	142 Å²	142	134.5 Å²	134.5	73%	0.728	80%	0.804	S	S	*	*			trans	-107.9	144.3	-172.8	-63.2	167.9	0	0	0	109.3
16	D	34.8	Very low	31.3	Very low	160 Å²	160	137.4 Å²	137.4	86%	0.856	81%	0.806	S	S	*	*			trans	48.4	111.4	165.4	-68.1	-28.1	0	0	0	120.5
17	G	31.2	Very low	31.2	Very low	72 Å²	72	133.7 Å²	133.7	74%	0.742	80%	0.804	S	S	*	*				89.9	81.5	101.6	0	0	0	0	0	118.3
18	Q	34.2	Very low	31	Very low	205 Å²	205	133 Å²	133	96%	0.958	80%	0.8	S	S	*	*			trans	-150.9	137.9	139.8	-113.4	162.4	33.7	0	0	112.1
19	S	30.4	Very low	30.8	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	80%	0.8	S	S	*	*			trans	-93.8	145.7	-168.3	54	0	0	0	0	113.8
20	C	28.1	Very low	30.7	Very low	115 Å²	115	129.2 Å²	129.2	78%	0.777	80%	0.799	S	S	*	*			trans	-159.7	114.8	143.3	-127.6	0	0	0	0	112.4
21	T	28.7	Very low	30.6	Very low	112 Å²	112	131.3 Å²	131.3	69%	0.687	80%	0.802	S	S	*	*				28.3	136.7	128.6	64.6	0	0	0	0	118.6
22	T	29.2	Very low	30.4	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	80%	0.795	S	S	*	*			cis	-172.1	167.1	8.4	12.9	0	0	0	0	105.9
23	E	28.9	Very low	30.2	Very low	151 Å²	151	128.3 Å²	128.3	71%	0.706	79%	0.794	S	S	*	*			cis	-153.5	-177.7	12.2	-146.1	165.9	-91.5	0	0	111.1
24	C	24.9	Very low	30.1	Very low	118 Å²	118	134.2 Å²	134.2	80%	0.797	80%	0.796	S	S	*	*			trans	-129.3	143	156.5	-75	0	0	0	0	109.2
25	S	29.8	Very low	29.9	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	79%	0.791	S	S	*	*			trans	-145.7	147	165.3	-87	0	0	0	0	110.6
26	V	27.1	Very low	29.7	Very low	141 Å²	141	132.7 Å²	132.7	86%	0.855	79%	0.788	S	S	*	*			trans	-116.5	134.6	-158.6	178	0	0	0	0	111.5
27	A	29.7	Very low	29.4	Very low	88 Å²	88	132.8 Å²	132.8	73%	0.727	79%	0.788	S	S	*	*			trans	-164	105.4	156.1	0	0	0	0	0	107.8
28	S	30.7	Very low	29.3	Very low	110 Å²	110	135 Å²	135	77%	0.769	79%	0.792	S	S	*	*				71	121.1	73.3	74.9	0	0	0	0	114.2
29	E	27.5	Very low	29	Very low	189 Å²	189	128.6 Å²	128.6	88%	0.883	78%	0.781	S	S	*	*			trans	-55.2	143.8	-170.2	-55.6	161.6	145	0	0	115.9
30	T	33.1	Very low	28.9	Very low	139 Å²	139	129.2 Å²	129.2	85%	0.853	78%	0.776	S	S	*	*			trans	-174.2	152.9	130.3	16.9	0	0	0	0	113.5
31	S	27.2	Very low	29	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	76%	0.759	S	S	*	*			trans	60.8	107.6	171.7	61.6	0	0	0	0	119.7
32	P	29.5	Very low	29	Very low	117 Å²	117	128 Å²	128	76%	0.76	76%	0.76	S	S	*	*			trans	-102.7	108.9	158.9	34	-22.2	0	0	0	110.9
33	D	29.4	Very low	29.4	Very low	161 Å²	161	127.9 Å²	127.9	86%	0.861	76%	0.758	S	S	*	*			trans	179	104.8	159	-95.7	-28.9	0	0	0	110.3
34	Y	29.5	Very low	29.6	Very low	192 Å²	192	123.8 Å²	123.8	75%	0.753	75%	0.746	S	S	*	*			trans	159.7	111	142.3	-111.6	-102.7	0	0	0	112	Q36	Y34-Q36 HydrophobicContact CD1-CG 4.38Å; Y34-Q36 HydrophobicContact CE1-CG 4.09Å
35	C	28.6	Very low	30.1	Very low	119 Å²	119	122.3 Å²	122.3	80%	0.804	75%	0.751	S	S	*	*			trans	-154.9	98.3	147.5	-166.3	0	0	0	0	108.4
36	Q	31.3	Very low	30.3	Very low	141 Å²	141	119.9 Å²	119.9	66%	0.659	74%	0.737	S	S	*	*			trans	-89.4	135.9	-179.6	-70.6	-178.2	-44	0	0	111.6	Y34	Y34-Q36 HydrophobicContact CD1-CG 4.38Å; Y34-Q36 HydrophobicContact CE1-CG 4.09Å
37	D	28.3	Very low	30.5	Very low	162 Å²	162	119.9 Å²	119.9	87%	0.866	74%	0.74	S	S	*	*			trans	35.1	95.5	156.7	-68.8	-35.2	0	0	0	120.2
38	S	29.6	Very low	30.8	Very low	118 Å²	118	118.9 Å²	118.9	83%	0.825	74%	0.738	S	S	*	*				-143.2	126	125	55.6	0	0	0	0	108.5
39	G	28	Very low	30.9	Very low	71 Å²	71	117.1 Å²	117.1	73%	0.732	73%	0.725	S	S	*	*			trans	-76.9	142.6	-155.2	0	0	0	0	0	116.8
40	N	28.2	Very low	31.1	Very low	128 Å²	128	113.3 Å²	113.3	68%	0.684	72%	0.72	S	S	*	*	S	Bend	trans	68.4	126.3	157.2	-63.4	-15.2	0	0	0	119.6
41	F	29.8	Very low	31.2	Very low	98 Å²	98	112.4 Å²	112.4	43%	0.43	71%	0.714	S	S	.	*			trans	87.4	97	168.2	-56.5	-68.9	0	0	0	119.1	V43 M60	F41-V43 HydrophobicContact CB-CG2 4.11Å; F41-M60 HydrophobicContact CD1-SD 4.05Å; F41-M60 HydrophobicContact CE1-CB 3.67Å; F41-M60 HydrophobicContact CE1-CG 3.77Å; F41-M60 HydrophobicContact CE1-SD 3.26Å; F41-M60 WeakPolarHBondContact CE1-SD 3.31Å; F41-M60 HydrophobicContact CZ-CB 3.62Å; F41-M60 HydrophobicContact CZ-CG 3.59Å; F41-M60 HydrophobicContact CZ-SD 3.54Å; F41-M60 VanDerWaalsContact CZ-SD 3.54Å
42	C	29.7	Very low	31.5	Very low	104 Å²	104	118.3 Å²	118.3	70%	0.703	72%	0.719	S	S	*	*			trans	-87.3	109.3	152.6	-177.7	0	0	0	0	109.2
43	V	37.2	Very low	31.3	Very low	114 Å²	114	122.4 Å²	122.4	69%	0.691	73%	0.725	S	S	*	*			trans	-114.1	70.5	174.6	-169.3	0	0	0	0	109	F41	F41-V43 HydrophobicContact CB-CG2 4.11Å
44	C	32.5	Very low	31.4	Very low	65 Å²	65	121.5 Å²	121.5	44%	0.439	73%	0.725	S	S	.	*			trans	-107	102.8	167.2	61.1	0	0	0	0	109.7	A46	C44-A46 PolarHBondContact O-N 2.88Å
45	G	35.1	Very low	31.2	Very low	88 Å²	88	118.3 Å²	118.3	91%	0.907	73%	0.725	S	S	*	*			trans	-70.9	36.1	172.9	0	0	0	0	0	113.7
46	A	33.8	Very low	31.2	Very low	59 Å²	59	118.4 Å²	118.4	49%	0.488	72%	0.718	S	S	.	*			trans	-93	123.8	-177.9	0	0	0	0	0	110.3	C44 G48	C44-A46 PolarHBondContact O-N 2.88Å; A46-G48 PolarHBondContact O-N 3.05Å; A46-G48 VanDerWaalsContact O-N 3.17Å
47	P	32.6	Very low	31.2	Very low	141 Å²	141	121.3 Å²	121.3	92%	0.916	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	119.2	170.7	-19.6	31.7	0	0	0	110
48	G	34.8	Very low	31.5	Very low	67 Å²	67	121 Å²	121	69%	0.691	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	118.2	-6	175.9	0	0	0	0	0	116.7	A46 S50	A46-G48 PolarHBondContact O-N 3.05Å; A46-G48 VanDerWaalsContact O-N 3.17Å; G48-S50 PolarHBondContact O-N 3.17Å; G48-S50 PolarHBondContact O-OG 3.33Å
49	C	32.5	Very low	31.9	Very low	73 Å²	73	118.8 Å²	118.8	49%	0.493	70%	0.695	S	S	.	*			trans	-62.7	111.9	176.7	-168.7	0	0	0	0	111.3
50	S	32.8	Very low	32.5	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	68%	0.675	S	S	*	*			trans	-112	33.7	-166.7	-62.1	0	0	0	0	113.6	G48 R52	G48-S50 PolarHBondContact O-N 3.17Å; G48-S50 PolarHBondContact O-OG 3.33Å; S50-R52 PolarHBondContact O-N 2.96Å
51	T	35.5	Very low	33	Very low	119 Å²	119	117.4 Å²	117.4	73%	0.73	67%	0.666	S	S	*	*			trans	-73.7	115.6	172.1	39.2	0	0	0	0	110.3
52	R	31.8	Very low	33.5	Very low	237 Å²	237	114.9 Å²	114.9	89%	0.894	66%	0.661	S	S	*	*			trans	-60.6	138.8	-176.9	-75.3	-179.5	175.5	177.1	-0.3	111.5	S50 V54	S50-R52 PolarHBondContact O-N 2.96Å; R52-V54 PolarHBondContact O-N 2.85Å
53	K	26.4	Very low	34.2	Very low	203 Å²	203	112.2 Å²	112.2	88%	0.883	64%	0.639	S	S	*	*			trans	-29	97.9	166.8	-61.3	172	179.4	176.8	0	113.4
54	V	30.7	Very low	35	Very low	142 Å²	142	107.4 Å²	107.4	86%	0.861	61%	0.609	S	S	*	*			trans	-100.1	116.9	149.3	179.2	0	0	0	0	106.3	R52 N56	R52-V54 PolarHBondContact O-N 2.85Å; V54-N56 PolarHBondContact O-N 3.1Å; V54-N56 VanDerWaalsContact O-N 3.1Å
55	T	26	Very low	35.7	Very low	125 Å²	125	107.7 Å²	107.7	77%	0.767	61%	0.609	S	S	*	*			trans	-77.3	97.3	-172.2	43.5	0	0	0	0	111
56	N	28.4	Very low	36.5	Very low	121 Å²	121	108.8 Å²	108.8	65%	0.647	59%	0.591	S	S	*	*			trans	-136.2	54.4	149.1	-128.9	1.6	0	0	0	111.1	V54 H58	V54-N56 PolarHBondContact O-N 3.1Å; V54-N56 VanDerWaalsContact O-N 3.1Å; N56-H58 PolarHBondContact O-N 2.8Å
57	R	31.8	Very low	37.5	Very low	203 Å²	203	106.3 Å²	106.3	77%	0.766	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-12	169.4	-82.4	-174.9	171.1	174	-7	112.9	N59 E61	R57-N59 VanDerWaalsContact C-N 3.34Å; R57-N59 PolarHBondContact O-N 3.37Å; R57-E61 WeakPolarHBondContact O-CB 3.48Å
58	H	33.5	Very low	38.3	Very low	154 Å²	154	101 Å²	101	71%	0.713	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	19.5	-172.8	-69.7	-45.4	0	0	0	115.8	N56 S62	N56-H58 PolarHBondContact O-N 2.8Å; H58-S62 VanDerWaalsContact O-CB 3.3Å; H58-S62 WeakPolarHBondContact O-CB 3.1Å; H58-S62 PolarHBondContact O-OG 2.85Å
59	N	39.2	Very low	38.9	Very low	72 Å²	72	101.6 Å²	101.6	39%	0.385	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-60.1	172.8	-76.7	59.1	0	0	0	112.5	R57 E61 S62 D63	R57-N59 VanDerWaalsContact C-N 3.34Å; R57-N59 PolarHBondContact O-N 3.37Å; N59-E61 VanDerWaalsContact C-N 3.29Å; N59-E61 PolarHBondContact O-N 3.26Å; N59-S62 VanDerWaalsContact CA-OG 3.3Å; N59-S62 WeakPolarHBondContact CA-OG 3.45Å; N59-S62 PolarHBondContact O-N 3.27Å; N59-S62 PolarHBondContact O-OG 3.33Å; N59-D63 VanDerWaalsContact O-CB 3.32Å; N59-D63 WeakPolarHBondContact O-CB 3.3Å; N59-D63 PolarHBondContact O-N 2.81Å; N59-D63 VanDerWaalsContact O-OD1 3.06Å
60	M	39.4	Very low	39.8	Very low	65 Å²	65	101.8 Å²	101.8	32%	0.32	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-37.3	179.2	-148.9	178.8	76.2	0	0	112.2	F41 I64 T162	F41-M60 HydrophobicContact CD1-SD 4.05Å; F41-M60 HydrophobicContact CE1-CB 3.67Å; F41-M60 HydrophobicContact CE1-CG 3.77Å; F41-M60 HydrophobicContact CE1-SD 3.26Å; F41-M60 WeakPolarHBondContact CE1-SD 3.31Å; F41-M60 HydrophobicContact CZ-CB 3.62Å; F41-M60 HydrophobicContact CZ-CG 3.59Å; F41-M60 HydrophobicContact CZ-SD 3.54Å; F41-M60 VanDerWaalsContact CZ-SD 3.54Å; M60-I64 HydrophobicContact CE-CD1 3.99Å; M60-I64 HydrophobicContact CG-CD1 3.85Å; M60-I64 WeakPolarHBondContact O-CB 3.19Å; M60-I64 WeakPolarHBondContact O-CD1 3.38Å; M60-I64 WeakPolarHBondContact O-CG1 3.15Å; M60-I64 PolarHBondContact O-N 2.8Å; M60-I64 HydrophobicContact SD-CD1 4.4Å; M60-T162 HydrophobicContact CE-CG2 3.51Å
61	E	39.4	Very low	40.7	Very low	105 Å²	105	98 Å²	98	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-77.2	-26.3	-179.7	-148.5	159.9	-152.2	0	0	111.6	R57 N59 T65	R57-E61 WeakPolarHBondContact O-CB 3.48Å; N59-E61 VanDerWaalsContact C-N 3.29Å; N59-E61 PolarHBondContact O-N 3.26Å; E61-T65 WeakPolarHBondContact O-CB 3.43Å; E61-T65 PolarHBondContact O-N 2.88Å; E61-T65 VanDerWaalsContact O-N 3.1Å; E61-T65 PolarHBondContact O-OG1 2.06Å
62	S	40	Very low	41.2	Very low	46 Å²	46	97.9 Å²	97.9	32%	0.322	50%	0.496	S	S	.	.	H	α-helix	trans	-72.2	-51.4	169.2	61	0	0	0	0	111.4	H58 N59 I64 T65 E66	H58-S62 VanDerWaalsContact O-CB 3.3Å; H58-S62 WeakPolarHBondContact O-CB 3.1Å; H58-S62 PolarHBondContact O-OG 2.85Å; N59-S62 VanDerWaalsContact CA-OG 3.3Å; N59-S62 WeakPolarHBondContact CA-OG 3.45Å; N59-S62 PolarHBondContact O-N 3.27Å; N59-S62 PolarHBondContact O-OG 3.33Å; S62-I64 VanDerWaalsContact C-N 3.25Å; S62-I64 PolarHBondContact O-N 3.32Å; S62-T65 CarbonylContact O-C 3.47Å; S62-T65 WeakPolarHBondContact O-CA 3.41Å; S62-T65 PolarHBondContact O-N 3.17Å; S62-E66 WeakPolarHBondContact O-CB 3.41Å; S62-E66 PolarHBondContact O-N 3.26Å
63	D	45.4	Very low	41.3	Very low	47 Å²	47	89.1 Å²	89.1	25%	0.251	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-38.9	-174.4	-60	-3.5	0	0	0	109.8	N59 L67	N59-D63 VanDerWaalsContact O-CB 3.32Å; N59-D63 WeakPolarHBondContact O-CB 3.3Å; N59-D63 PolarHBondContact O-N 2.81Å; N59-D63 VanDerWaalsContact O-OD1 3.06Å; D63-L67 WeakPolarHBondContact O-CB 3.47Å; D63-L67 WeakPolarHBondContact O-CD1 3.4Å; D63-L67 PolarHBondContact O-N 3.23Å
64	I	53.7	Low	41.5	Very low	13 Å²	13	82.8 Å²	82.8	7%	0.067	47%	0.465	C	S	.	.	H	α-helix	trans	-71.7	-34.4	174	-72.3	175.5	0	0	0	112.3	M60 S62 A68 L91 T162 L165	M60-I64 HydrophobicContact CE-CD1 3.99Å; M60-I64 HydrophobicContact CG-CD1 3.85Å; M60-I64 WeakPolarHBondContact O-CB 3.19Å; M60-I64 WeakPolarHBondContact O-CD1 3.38Å; M60-I64 WeakPolarHBondContact O-CG1 3.15Å; M60-I64 PolarHBondContact O-N 2.8Å; M60-I64 HydrophobicContact SD-CD1 4.4Å; S62-I64 VanDerWaalsContact C-N 3.25Å; S62-I64 PolarHBondContact O-N 3.32Å; I64-A68 WeakPolarHBondContact O-CB 3.1Å; I64-A68 PolarHBondContact O-N 3.45Å; I64-L91 HydrophobicContact CD1-CD1 3.82Å; I64-L91 HydrophobicContact CG1-CD1 3.58Å; I64-T162 HydrophobicContact CD1-CG2 3.46Å; I64-T162 VanDerWaalsContact CD1-CG2 3.46Å; I64-L165 HydrophobicContact CG2-CB 4.29Å; I64-L165 HydrophobicContact CG2-CD1 3.59Å; I64-L165 HydrophobicContact CG2-CG 3.75Å
65	T	46.9	Very low	41.6	Very low	71 Å²	71	81.8 Å²	81.8	44%	0.436	46%	0.464	S	S	.	.	H	α-helix	trans	-71.7	-36.9	175.1	-62.3	0	0	0	0	111.8	E61 S62 A68 S69	E61-T65 WeakPolarHBondContact O-CB 3.43Å; E61-T65 PolarHBondContact O-N 2.88Å; E61-T65 VanDerWaalsContact O-N 3.1Å; E61-T65 PolarHBondContact O-OG1 2.06Å; S62-T65 CarbonylContact O-C 3.47Å; S62-T65 WeakPolarHBondContact O-CA 3.41Å; S62-T65 PolarHBondContact O-N 3.17Å; T65-A68 WeakPolarHBondContact O-CB 3.26Å; T65-A68 PolarHBondContact O-N 3.45Å; T65-S69 PolarHBondContact O-N 2.63Å; T65-S69 PolarHBondContact O-OG 3.1Å
66	E	51.2	Low	41.7	Very low	112 Å²	112	82.2 Å²	82.2	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-66.2	-41.6	173.7	-172.4	178.3	-176.1	0	0	111	S62 A68 S69 T70	S62-E66 WeakPolarHBondContact O-CB 3.41Å; S62-E66 PolarHBondContact O-N 3.26Å; E66-A68 VanDerWaalsContact C-N 3.33Å; E66-A68 PolarHBondContact O-N 3.44Å; E66-S69 WeakPolarHBondContact CA-OG 3.29Å; E66-S69 PolarHBondContact O-N 2.75Å; E66-S69 PolarHBondContact O-OG 3.35Å; E66-T70 PolarHBondContact O-N 2.68Å; E66-T70 PolarHBondContact O-OG1 3.3Å
67	L	55.1	Low	42	Very low	7 Å²	7	81.6 Å²	81.6	4%	0.037	47%	0.467	C	S	.	.	H	α-helix	trans	-62.1	-38.4	168.9	-98	98.4	0	0	0	112.6	D63 T70 P89 I96 K109 I124	D63-L67 WeakPolarHBondContact O-CB 3.47Å; D63-L67 WeakPolarHBondContact O-CD1 3.4Å; D63-L67 PolarHBondContact O-N 3.23Å; L67-T70 WeakPolarHBondContact O-CB 3.22Å; L67-T70 PolarHBondContact O-N 3.01Å; L67-P89 HydrophobicContact CD1-CB 4.04Å; L67-I96 HydrophobicContact CD1-CG1 4.32Å; L67-I96 HydrophobicContact CD2-CD1 4.38Å; L67-I96 HydrophobicContact CD2-CG1 4.17Å; L67-K109 HydrophobicContact CD2-CD 3.99Å; L67-I124 HydrophobicContact CD2-CD1 3.37Å
68	A	49.3	Very low	41.7	Very low	28 Å²	28	77.4 Å²	77.4	23%	0.231	47%	0.469	C	S	.	.	H	α-helix	trans	-67.8	-43.3	177.8	0	0	0	0	0	112.1	I64 T65 E66 T70 I71	I64-A68 WeakPolarHBondContact O-CB 3.1Å; I64-A68 PolarHBondContact O-N 3.45Å; T65-A68 WeakPolarHBondContact O-CB 3.26Å; T65-A68 PolarHBondContact O-N 3.45Å; E66-A68 VanDerWaalsContact C-N 3.33Å; E66-A68 PolarHBondContact O-N 3.44Å; A68-T70 PolarHBondContact O-N 3.2Å; A68-T70 VanDerWaalsContact O-N 3.15Å; A68-I71 VanDerWaalsContact O-CB 3.3Å; A68-I71 WeakPolarHBondContact O-CB 3.27Å; A68-I71 PolarHBondContact O-N 2.89Å
69	S	47.8	Very low	41.6	Very low	81 Å²	81	78.5 Å²	78.5	57%	0.566	47%	0.472	S	S	*	.	H	α-helix	trans	-61.3	-23.8	173.6	53.2	0	0	0	0	113.2	T65 E66 I71	T65-S69 PolarHBondContact O-N 2.63Å; T65-S69 PolarHBondContact O-OG 3.1Å; E66-S69 WeakPolarHBondContact CA-OG 3.29Å; E66-S69 PolarHBondContact O-N 2.75Å; E66-S69 PolarHBondContact O-OG 3.35Å; S69-I71 VanDerWaalsContact C-N 3.27Å; S69-I71 PolarHBondContact O-N 2.9Å
70	T	51.4	Low	41.2	Very low	77 Å²	77	80.7 Å²	80.7	47%	0.472	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.5	174.9	-51.2	0	0	0	0	113	E66 L67 A68	E66-T70 PolarHBondContact O-N 2.68Å; E66-T70 PolarHBondContact O-OG1 3.3Å; L67-T70 WeakPolarHBondContact O-CB 3.22Å; L67-T70 PolarHBondContact O-N 3.01Å; A68-T70 PolarHBondContact O-N 3.2Å; A68-T70 VanDerWaalsContact O-N 3.15Å
71	I	52.6	Low	40.7	Very low	30 Å²	30	85.1 Å²	85.1	15%	0.154	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-38.3	178.7	-62.8	177	0	0	0	111.1	A68 S69 I124	A68-I71 VanDerWaalsContact O-CB 3.3Å; A68-I71 WeakPolarHBondContact O-CB 3.27Å; A68-I71 PolarHBondContact O-N 2.89Å; S69-I71 VanDerWaalsContact C-N 3.27Å; S69-I71 PolarHBondContact O-N 2.9Å; I71-I124 HydrophobicContact CD1-CG2 4.45Å
72	D	44.7	Very low	40.4	Very low	117 Å²	117	88 Å²	88	63%	0.626	53%	0.529	S	S	*	.	S	Bend	trans	-98	1	-169.6	-62.6	-35.9	0	0	0	114.9	R129	D72-R129 IonicContact OD1-CZ 2.63Å; D72-R129 IonicContact OD1-NH1 2.66Å; D72-R129 PolarHBondContact OD1-NH1 3.17Å
73	G	35.2	Very low	40.1	Very low	53 Å²	53	95.3 Å²	95.3	55%	0.546	56%	0.557	S	S	.	*			trans	-97.8	111.5	-176.2	0	0	0	0	0	115.2
74	A	29.4	Very low	39.5	Very low	70 Å²	70	100 Å²	100	58%	0.579	58%	0.578	S	S	*	*			trans	-121.9	105	159.7	0	0	0	0	0	109.4
75	S	34.1	Very low	38.8	Very low	120 Å²	120	107.3 Å²	107.3	84%	0.839	62%	0.617	S	S	*	*			trans	-162.5	134.4	165.6	-86.4	0	0	0	0	111.5
76	T	28	Very low	39	Very low	134 Å²	134	109.4 Å²	109.4	82%	0.822	63%	0.629	S	S	*	*			trans	-93.8	113.5	-179.6	-54.6	0	0	0	0	109.6
77	T	33	Very low	40.1	Very low	109 Å²	109	109.1 Å²	109.1	67%	0.669	64%	0.64	S	S	*	*			trans	-136.5	116.2	164.5	53	0	0	0	0	110.8
78	S	26.6	Very low	41.5	Very low	114 Å²	114	113.6 Å²	113.6	80%	0.797	66%	0.659	S	S	*	*			trans	-70.3	128.9	173.4	50.8	0	0	0	0	111.7
79	F	31.5	Very low	43.4	Very low	178 Å²	178	114.9 Å²	114.9	78%	0.781	67%	0.665	S	S	*	*			trans	-129.2	146.9	163.5	-75	-77.4	0	0	0	110.1
80	P	30.9	Very low	45.5	Very low	117 Å²	117	116.2 Å²	116.2	76%	0.76	66%	0.661	S	S	*	*			trans	-81	163.5	-168	33.3	-36.6	0	0	0	113.6	Q82	P80-Q82 PolarHBondContact O-N 3.23Å
81	D	28	Very low	47.3	Very low	158 Å²	158	112.8 Å²	112.8	85%	0.845	64%	0.639	S	S	*	*			trans	-43.3	114.9	-178.8	-81.7	-51	0	0	0	114.5
82	Q	32.7	Very low	49.1	Very low	167 Å²	167	113.1 Å²	113.1	78%	0.78	65%	0.65	S	S	*	*			trans	-134.7	123.8	149	-68.9	-166	1	0	0	108.9	P80 Q84	P80-Q82 PolarHBondContact O-N 3.23Å; Q82-Q84 VanDerWaalsContact C-N 3.32Å; Q82-Q84 PolarHBondContact O-N 3.39Å
83	H	34.5	Very low	51.4	Low	198 Å²	198	109 Å²	109	92%	0.917	63%	0.629	S	S	*	*			trans	-69.2	86	174.5	-84.1	-80.4	0	0	0	110.6
84	Q	32.6	Very low	54.3	Low	146 Å²	146	106.4 Å²	106.4	68%	0.682	60%	0.603	S	S	*	*			trans	-99.3	127.8	155	-72.7	-174.2	-4.1	0	0	108.5	Q82 T86	Q82-Q84 VanDerWaalsContact C-N 3.32Å; Q82-Q84 PolarHBondContact O-N 3.39Å; Q84-T86 HydrophobicContact CB-CG2 4.33Å; Q84-T86 PolarHBondContact O-N 3.31Å
85	D	39.6	Very low	57.5	Low	167 Å²	167	104.4 Å²	104.4	89%	0.893	58%	0.583	S	S	*	*			trans	-74.7	74.2	178.7	-156.2	10.8	0	0	0	109.2	S87	D85-S87 PolarHBondContact O-N 2.81Å
86	T	50.6	Low	60.5	Low	114 Å²	114	99.2 Å²	99.2	70%	0.699	55%	0.546	S	S	*	.			trans	-71.3	95.4	-176.2	41	0	0	0	0	109.1	Q84 K88	Q84-T86 HydrophobicContact CB-CG2 4.33Å; Q84-T86 PolarHBondContact O-N 3.31Å; T86-K88 PolarHBondContact O-N 3.36Å; T86-K88 VanDerWaalsContact O-N 3.11Å
87	S	74.5	Confident	63.7	Low	106 Å²	106	96.1 Å²	96.1	74%	0.741	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-55.8	118.2	178.6	58.7	0	0	0	0	110.1	D85	D85-S87 PolarHBondContact O-N 2.81Å
88	K	83.7	Confident	66.6	Low	101 Å²	101	97.8 Å²	97.8	44%	0.439	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-50.8	137.5	178.1	-65.3	-175.1	-168.2	177.1	0	110.6	T86 V95 E97	T86-K88 PolarHBondContact O-N 3.36Å; T86-K88 VanDerWaalsContact O-N 3.11Å; K88-V95 HydrophobicContact CB-CG1 3.59Å; K88-V95 HydrophobicContact CD-CG1 4.05Å; K88-V95 HydrophobicContact CG-CG1 4.44Å; K88-E97 IonicContact NZ-OE1 2.74Å; K88-E97 PolarHBondContact NZ-OE1 3.28Å; K88-E97 IonicContact NZ-OE2 2.74Å; K88-E97 PolarHBondContact NZ-OE2 2.64Å
89	P	90.2	Very high	69.9	Low	55 Å²	55	94.7 Å²	94.7	36%	0.357	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-59.4	146.7	-176.8	20.1	-28.7	0	0	0	111	L67 I96	L67-P89 HydrophobicContact CD1-CB 4.04Å; P89-I96 HydrophobicContact CG-CB 4.21Å; P89-I96 WeakPolarHBondContact O-CB 3.16Å; P89-I96 WeakPolarHBondContact O-CG1 3.2Å; P89-I96 PolarHBondContact O-N 2.88Å
90	K	90.9	Very high	72.8	Confident	110 Å²	110	89.3 Å²	89.3	48%	0.478	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	153.6	-177.4	-67.3	-177.4	-177.5	171.9	0	110.9	Y94 V95	K90-Y94 CarbonylContact C-O 3.57Å; K90-Y94 VanDerWaalsContact CA-O 3.27Å; K90-Y94 WeakPolarHBondContact CA-O 3.3Å; K90-V95 HydrophobicContact CG-CG2 4.29Å
91	L	90.5	Very high	75.5	Confident	4 Å²	4	85 Å²	85	2%	0.021	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	98	171.7	-179.9	63.2	0	0	0	107	I64 T93 Y94 I96 I122 M160 C167	I64-L91 HydrophobicContact CD1-CD1 3.82Å; I64-L91 HydrophobicContact CG1-CD1 3.58Å; L91-T93 PolarHBondContact O-N 3.46Å; L91-Y94 PolarHBondContact N-O 2.87Å; L91-Y94 WeakPolarHBondContact O-CB 3.48Å; L91-Y94 WeakPolarHBondContact O-CD2 3.5Å; L91-Y94 PolarHBondContact O-N 3.06Å; L91-I96 HydrophobicContact CB-CD1 4.08Å; L91-I96 HydrophobicContact CB-CG1 4.46Å; L91-I122 HydrophobicContact CD2-CD1 4.28Å; L91-I122 HydrophobicContact CD2-CG2 4.15Å; L91-M160 HydrophobicContact CD2-CE 3.61Å; L91-M160 HydrophobicContact CG-CE 3.77Å; L91-M160 HydrophobicContact CG-SD 4.27Å; L91-C167 HydrophobicContact CD2-CB 4.25Å
92	G	89.9	Confident	78.3	Confident	37 Å²	37	84.2 Å²	84.2	38%	0.381	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-122.4	-172.7	0	0	0	0	0	112.1	Y94	G92-Y94 VanDerWaalsContact C-N 3.26Å; G92-Y94 PolarHBondContact O-N 2.91Å
93	T	92.1	Very high	80.5	Confident	30 Å²	30	78.2 Å²	78.2	18%	0.184	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	12.4	176.4	53.7	0	0	0	0	113.8	L91 H113 T114 I115	L91-T93 PolarHBondContact O-N 3.46Å; T93-H113 WeakPolarHBondContact CB-NE2 3.48Å; T93-H113 CarbonylContact O-C 3.48Å; T93-H113 WeakPolarHBondContact O-CA 3.48Å; T93-H113 PolarHBondContact O-CD2 2.94Å; T93-H113 VanDerWaalsContact O-CD2 3.27Å; T93-H113 PolarHBondContact OG1-CD2 3.38Å; T93-H113 PolarHBondContact OG1-NE2 3.16Å; T93-T114 WeakPolarHBondContact O-CG2 3.47Å; T93-T114 PolarHBondContact O-N 3.32Å; T93-T114 PolarHBondContact O-OG1 3.41Å; T93-I115 HydrophobicContact CG2-CD1 4.11Å
94	Y	97	Very high	82.6	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.6	-178.7	-55.8	-79.9	0	0	0	112	K90 L91 G92 K112 H113 V120 I122 Q158 M160 V169 L484	K90-Y94 CarbonylContact C-O 3.57Å; K90-Y94 VanDerWaalsContact CA-O 3.27Å; K90-Y94 WeakPolarHBondContact CA-O 3.3Å; L91-Y94 PolarHBondContact N-O 2.87Å; L91-Y94 WeakPolarHBondContact O-CB 3.48Å; L91-Y94 WeakPolarHBondContact O-CD2 3.5Å; L91-Y94 PolarHBondContact O-N 3.06Å; G92-Y94 VanDerWaalsContact C-N 3.26Å; G92-Y94 PolarHBondContact O-N 2.91Å; Y94-K112 WeakPolarHBondContact CA-O 3.21Å; Y94-H113 HydrophobicContact CD1-CB 3.83Å; Y94-H113 AromaticContact CD1-CD2 3.78Å; Y94-H113 HydrophobicContact CE1-CB 3.67Å; Y94-H113 AromaticContact CE1-CD2 3.35Å; Y94-H113 WeakPolarHBondContact CE1-CD2 3.33Å; Y94-H113 AromaticContact CE1-CG 3.72Å; Y94-H113 AromaticContact CZ-CD2 3.69Å; Y94-V120 HydrophobicContact CD1-CG2 3.58Å; Y94-V120 HydrophobicContact CE1-CG1 4.4Å; Y94-V120 HydrophobicContact CE1-CG2 3.77Å; Y94-I122 HydrophobicContact CD1-CD1 4.44Å; Y94-I122 HydrophobicContact CD2-CD1 4.26Å; Y94-I122 HydrophobicContact CG-CD1 3.92Å; Y94-Q158 PolarHBondContact OH-OE1 2.88Å; Y94-M160 HydrophobicContact CD2-CE 4.21Å; Y94-M160 HydrophobicContact CE2-CE 4.27Å; Y94-V169 HydrophobicContact CD2-CG2 4.35Å; Y94-V169 HydrophobicContact CE1-CG1 3.8Å; Y94-V169 HydrophobicContact CE2-CG1 4.35Å; Y94-V169 HydrophobicContact CE2-CG2 3.85Å; Y94-L484 HydrophobicContact CE1-CD1 4.32Å
95	V	97.1	Very high	85	Confident	27 Å²	27	67.9 Å²	67.9	16%	0.164	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.4	167.1	-175.3	0	0	0	0	108.2	K88 K90 A111 K112 T114	K88-V95 HydrophobicContact CB-CG1 3.59Å; K88-V95 HydrophobicContact CD-CG1 4.05Å; K88-V95 HydrophobicContact CG-CG1 4.44Å; K90-V95 HydrophobicContact CG-CG2 4.29Å; V95-A111 CarbonylContact O-C 3.56Å; V95-A111 WeakPolarHBondContact O-CA 3.46Å; V95-A111 WeakPolarHBondContact O-CB 3.29Å; V95-K112 PolarHBondContact N-O 2.81Å; V95-K112 PolarHBondContact O-N 2.91Å; V95-T114 HydrophobicContact CG2-CG2 3.68Å
96	I	96.3	Very high	87.3	Confident	11 Å²	11	61.2 Å²	61.2	6%	0.056	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.1	-179.8	-54.3	-59.6	0	0	0	109.3	L67 P89 L91 K109 A111 I122	L67-I96 HydrophobicContact CD1-CG1 4.32Å; L67-I96 HydrophobicContact CD2-CD1 4.38Å; L67-I96 HydrophobicContact CD2-CG1 4.17Å; P89-I96 HydrophobicContact CG-CB 4.21Å; P89-I96 WeakPolarHBondContact O-CB 3.16Å; P89-I96 WeakPolarHBondContact O-CG1 3.2Å; P89-I96 PolarHBondContact O-N 2.88Å; L91-I96 HydrophobicContact CB-CD1 4.08Å; L91-I96 HydrophobicContact CB-CG1 4.46Å; I96-K109 HydrophobicContact CG2-CB 4.15Å; I96-K109 HydrophobicContact CG2-CD 3.68Å; I96-K109 HydrophobicContact CG2-CG 4.49Å; I96-A111 HydrophobicContact CD1-CB 3.84Å; I96-I122 HydrophobicContact CD1-CD1 3.95Å
97	E	95.4	Very high	89.4	Confident	69 Å²	69	56 Å²	56	32%	0.322	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-60.1	-174	-74.1	-72.3	154.6	0	0	112.2	K88 L110 F119	K88-E97 IonicContact NZ-OE1 2.74Å; K88-E97 PolarHBondContact NZ-OE1 3.28Å; K88-E97 IonicContact NZ-OE2 2.74Å; K88-E97 PolarHBondContact NZ-OE2 2.64Å; E97-L110 HydrophobicContact CB-CB 4.31Å; E97-L110 HydrophobicContact CB-CD2 4.22Å; E97-L110 HydrophobicContact CB-CG 4.05Å; E97-L110 WeakPolarHBondContact CB-O 3.47Å; E97-L110 PolarHBondContact N-O 3.28Å; E97-F119 HydrophobicContact CG-CE1 4.09Å
98	R	94.9	Very high	90.4	Very high	144 Å²	144	52.6 Å²	52.6	54%	0.543	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	153.6	-179.9	61.7	-178.7	-179.1	119.5	1.5	111	I100 K109 L110	R98-I100 HydrophobicContact CG-CG2 4.12Å; R98-K109 CarbonylContact O-C 3.44Å; R98-K109 WeakPolarHBondContact O-CA 3.17Å; R98-L110 HydrophobicContact CG-CB 4.1Å; R98-L110 HydrophobicContact CG-CD2 4.19Å; R98-L110 PolarHBondContact N-O 3.48Å; R98-L110 PolarHBondContact O-N 2.89Å
99	T	95	Very high	91	Very high	50 Å²	50	48.1 Å²	48.1	31%	0.307	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	131.9	165.7	-53.6	0	0	0	0	109.2	G101 K102 K109	T99-G101 WeakPolarHBondContact CG2-O 3.32Å; T99-K102 HydrophobicContact CG2-CG 3.74Å; T99-K109 PolarHBondContact OG1-NZ 3.09Å; T99-K109 VanDerWaalsContact OG1-NZ 3.15Å
100	I	92.9	Very high	91.3	Very high	65 Å²	65	46.2 Å²	46.2	33%	0.333	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-17.5	176.7	58.4	175.4	0	0	0	112.9	R98 V108 L110 A121 Y172	R98-I100 HydrophobicContact CG-CG2 4.12Å; I100-V108 HydrophobicContact CD1-CG1 3.95Å; I100-V108 HydrophobicContact CG1-CB 4.13Å; I100-V108 HydrophobicContact CG1-CG1 3.79Å; I100-V108 WeakPolarHBondContact CG1-O 3.31Å; I100-V108 PolarHBondContact N-O 2.78Å; I100-L110 HydrophobicContact CD1-CB 4.43Å; I100-L110 HydrophobicContact CG2-CB 3.73Å; I100-A121 HydrophobicContact CD1-CB 4.11Å; I100-Y172 HydrophobicContact CD1-CD2 3.96Å; I100-Y172 HydrophobicContact CD1-CE2 3.95Å
101	G	88	Confident	91.7	Very high	27 Å²	27	41 Å²	41	28%	0.278	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	152.9	170.9	0	0	0	0	0	111.6	T99 V108	T99-G101 WeakPolarHBondContact CG2-O 3.32Å; G101-V108 PolarHBondContact N-O 3.38Å; G101-V108 VanDerWaalsContact N-O 3.08Å; G101-V108 PolarHBondContact O-N 2.98Å
102	K	86.7	Confident	92	Very high	141 Å²	141	44.8 Å²	44.8	61%	0.613	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-136	127.1	173.6	-69.9	-169.5	175.2	-164.6	0	108.9	T99	T99-K102 HydrophobicContact CG2-CG 3.74Å
103	G	78.4	Confident	92.3	Very high	41 Å²	41	43 Å²	43	42%	0.423	23%	0.226	S	C	.	.			trans	-119.1	-177.6	166.6	0	0	0	0	0	110.3	F105 S106	G103-F105 PolarHBondContact O-N 2.62Å; G103-S106 CarbonylContact C-O 3.55Å; G103-S106 PolarHBondContact N-O 3.1Å; G103-S106 VanDerWaalsContact O-O 3.1Å
104	I	77.6	Confident	92.4	Very high	78 Å²	78	45.1 Å²	45.1	40%	0.4	24%	0.239	S	C	.	.	S	Bend	trans	-60.2	-46.2	-171.9	-57.1	177.9	0	0	0	112.5	R129 D583	I104-R129 PolarHBondContact O-NH2 3.19Å; I104-D583 HydrophobicContact CD1-CB 3.72Å; I104-D583 WeakPolarHBondContact CD1-O 3.3Å; I104-D583 HydrophobicContact CG1-CB 4.31Å
105	F	83.1	Confident	92.2	Very high	48 Å²	48	46.9 Å²	46.9	21%	0.211	25%	0.248	C	C	.	.	S	Bend	trans	-115.6	7.6	-174.7	-51.3	-71.7	0	0	0	113.4	G103 D126 R129 L130	G103-F105 PolarHBondContact O-N 2.62Å; F105-D126 PolarHBondContact O-N 2.6Å; F105-D126 VanDerWaalsContact O-N 3.16Å; F105-R129 HydrophobicContact CD1-CB 3.84Å; F105-R129 WeakPolarHBondContact CD1-O 3.27Å; F105-R129 HydrophobicContact CE1-CB 4.37Å; F105-R129 VanDerWaalsContact CE1-O 3.3Å; F105-R129 WeakPolarHBondContact CE1-O 3.44Å; F105-L130 HydrophobicContact CB-CD2 3.75Å; F105-L130 HydrophobicContact CB-CG 4.42Å; F105-L130 HydrophobicContact CD1-CD2 4.15Å; F105-L130 HydrophobicContact CD2-CD2 3.73Å; F105-L130 HydrophobicContact CE2-CD2 4.38Å; F105-L130 HydrophobicContact CG-CD2 3.6Å
106	S	89.6	Confident	92	Very high	27 Å²	27	45.7 Å²	45.7	19%	0.189	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	148.1	-172.2	61.9	0	0	0	0	113	G103 I124	G103-S106 CarbonylContact C-O 3.55Å; G103-S106 PolarHBondContact N-O 3.1Å; G103-S106 VanDerWaalsContact O-O 3.1Å; S106-I124 CarbonylContact C-O 3.6Å; S106-I124 WeakPolarHBondContact CA-O 3.42Å; S106-I124 WeakPolarHBondContact CB-O 3.21Å
107	S	93.3	Very high	91.9	Very high	5 Å²	5	46.5 Å²	46.5	4%	0.035	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	140.6	167.4	67.9	0	0	0	0	110.7	I124	S107-I124 PolarHBondContact N-O 2.64Å; S107-I124 PolarHBondContact O-N 3.33Å
108	V	95.2	Very high	91.8	Very high	35 Å²	35	44.6 Å²	44.6	21%	0.212	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.9	173.6	-169.8	0	0	0	0	107.9	I100 G101 A121 I122 K123	I100-V108 HydrophobicContact CD1-CG1 3.95Å; I100-V108 HydrophobicContact CG1-CB 4.13Å; I100-V108 HydrophobicContact CG1-CG1 3.79Å; I100-V108 WeakPolarHBondContact CG1-O 3.31Å; I100-V108 PolarHBondContact N-O 2.78Å; G101-V108 PolarHBondContact N-O 3.38Å; G101-V108 VanDerWaalsContact N-O 3.08Å; G101-V108 PolarHBondContact O-N 2.98Å; V108-A121 HydrophobicContact CG1-CB 4.12Å; V108-I122 CarbonylContact C-O 3.58Å; V108-I122 VanDerWaalsContact CA-O 3.32Å; V108-I122 WeakPolarHBondContact CA-O 3.21Å; V108-K123 HydrophobicContact CG2-CB 4.3Å; V108-K123 HydrophobicContact CG2-CG 4.36Å
109	K	96.7	Very high	91.9	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.03	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.8	-179.8	-58.1	-173.4	-171.3	-76.7	0	110.8	L67 I96 R98 T99 I122 I124	L67-K109 HydrophobicContact CD2-CD 3.99Å; I96-K109 HydrophobicContact CG2-CB 4.15Å; I96-K109 HydrophobicContact CG2-CD 3.68Å; I96-K109 HydrophobicContact CG2-CG 4.49Å; R98-K109 CarbonylContact O-C 3.44Å; R98-K109 WeakPolarHBondContact O-CA 3.17Å; T99-K109 PolarHBondContact OG1-NZ 3.09Å; T99-K109 VanDerWaalsContact OG1-NZ 3.15Å; K109-I122 PolarHBondContact N-O 2.97Å; K109-I122 PolarHBondContact O-N 3.39Å; K109-I124 HydrophobicContact CD-CD1 3.8Å; K109-I124 HydrophobicContact CG-CD1 4.25Å
110	L	97.4	Very high	92	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	134.1	162.1	178.4	63.8	0	0	0	108	E97 R98 I100 F119 Y172	E97-L110 HydrophobicContact CB-CB 4.31Å; E97-L110 HydrophobicContact CB-CD2 4.22Å; E97-L110 HydrophobicContact CB-CG 4.05Å; E97-L110 WeakPolarHBondContact CB-O 3.47Å; E97-L110 PolarHBondContact N-O 3.28Å; R98-L110 HydrophobicContact CG-CB 4.1Å; R98-L110 HydrophobicContact CG-CD2 4.19Å; R98-L110 PolarHBondContact N-O 3.48Å; R98-L110 PolarHBondContact O-N 2.89Å; I100-L110 HydrophobicContact CD1-CB 4.43Å; I100-L110 HydrophobicContact CG2-CB 3.73Å; L110-F119 HydrophobicContact CD1-CB 3.92Å; L110-F119 HydrophobicContact CD1-CD1 3.84Å; L110-F119 HydrophobicContact CD1-CG 4.21Å; L110-F119 HydrophobicContact CD2-CD1 4.42Å; L110-F119 HydrophobicContact CG-CD1 4.13Å; L110-Y172 HydrophobicContact CD1-CD1 3.93Å; L110-Y172 HydrophobicContact CD1-CD2 3.67Å; L110-Y172 HydrophobicContact CD1-CE1 4.04Å; L110-Y172 HydrophobicContact CD1-CE2 3.79Å; L110-Y172 HydrophobicContact CD1-CG 3.74Å
111	A	97.9	Very high	92.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	161.2	174.4	0	0	0	0	0	110.7	V95 I96 F119 V120 I122	V95-A111 CarbonylContact O-C 3.56Å; V95-A111 WeakPolarHBondContact O-CA 3.46Å; V95-A111 WeakPolarHBondContact O-CB 3.29Å; I96-A111 HydrophobicContact CD1-CB 3.84Å; A111-F119 CarbonylContact O-C 3.47Å; A111-F119 VanDerWaalsContact O-CA 3.28Å; A111-F119 WeakPolarHBondContact O-CA 3.35Å; A111-V120 HydrophobicContact CB-CG2 4.06Å; A111-V120 PolarHBondContact N-O 3.11Å; A111-V120 PolarHBondContact O-N 3.06Å; A111-I122 HydrophobicContact CB-CD1 3.6Å; A111-I122 HydrophobicContact CB-CG1 4.01Å
112	K	97.6	Very high	92.7	Very high	83 Å²	83	35.8 Å²	35.8	36%	0.361	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.8	175.7	-174	178.2	179.8	179.6	0	109.7	Y94 V95 T114 G117 I118 F119	Y94-K112 WeakPolarHBondContact CA-O 3.21Å; V95-K112 PolarHBondContact N-O 2.81Å; V95-K112 PolarHBondContact O-N 2.91Å; K112-T114 PolarHBondContact O-N 2.83Å; K112-G117 WeakPolarHBondContact CE-O 3.48Å; K112-I118 WeakPolarHBondContact CA-O 3.39Å; K112-F119 HydrophobicContact CB-CD1 4.04Å; K112-F119 HydrophobicContact CB-CE1 3.97Å; K112-F119 HydrophobicContact CD-CE1 4.34Å; K112-F119 HydrophobicContact CD-CZ 4.32Å; K112-F119 HydrophobicContact CG-CD1 4.5Å; K112-F119 HydrophobicContact CG-CE1 4.34Å
113	H	96.9	Very high	93.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.7	174	-172.2	-130.8	0	0	0	109.9	T93 Y94 I115 T116 G117 I118 T481 L484	T93-H113 WeakPolarHBondContact CB-NE2 3.48Å; T93-H113 CarbonylContact O-C 3.48Å; T93-H113 WeakPolarHBondContact O-CA 3.48Å; T93-H113 PolarHBondContact O-CD2 2.94Å; T93-H113 VanDerWaalsContact O-CD2 3.27Å; T93-H113 PolarHBondContact OG1-CD2 3.38Å; T93-H113 PolarHBondContact OG1-NE2 3.16Å; Y94-H113 HydrophobicContact CD1-CB 3.83Å; Y94-H113 AromaticContact CD1-CD2 3.78Å; Y94-H113 HydrophobicContact CE1-CB 3.67Å; Y94-H113 AromaticContact CE1-CD2 3.35Å; Y94-H113 WeakPolarHBondContact CE1-CD2 3.33Å; Y94-H113 AromaticContact CE1-CG 3.72Å; Y94-H113 AromaticContact CZ-CD2 3.69Å; H113-I115 PolarHBondContact O-N 2.91Å; H113-T116 PolarHBondContact ND1-OG1 3.29Å; H113-G117 WeakPolarHBondContact O-CA 3.35Å; H113-G117 PolarHBondContact O-N 3.34Å; H113-I118 PolarHBondContact N-O 2.99Å; H113-T481 PolarHBondContact CE1-OG1 2.65Å; H113-T481 VanDerWaalsContact CE1-OG1 3.28Å; H113-L484 HydrophobicContact CB-CD1 3.96Å
114	T	94.3	Very high	93.9	Very high	75 Å²	75	27.9 Å²	27.9	46%	0.46	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-40.4	-170.6	52	0	0	0	0	112.9	T93 V95 K112	T93-T114 WeakPolarHBondContact O-CG2 3.47Å; T93-T114 PolarHBondContact O-N 3.32Å; T93-T114 PolarHBondContact O-OG1 3.41Å; V95-T114 HydrophobicContact CG2-CG2 3.68Å; K112-T114 PolarHBondContact O-N 2.83Å
115	I	92.9	Very high	94.7	Very high	36 Å²	36	24.2 Å²	24.2	19%	0.185	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-51.3	-176.7	-57	171.4	0	0	0	110.3	T93 H113 Y459 M461 T481	T93-I115 HydrophobicContact CG2-CD1 4.11Å; H113-I115 PolarHBondContact O-N 2.91Å; I115-Y459 HydrophobicContact CG2-CD1 3.95Å; I115-Y459 HydrophobicContact CG2-CD2 3.9Å; I115-Y459 HydrophobicContact CG2-CE1 3.99Å; I115-Y459 HydrophobicContact CG2-CE2 3.95Å; I115-Y459 HydrophobicContact CG2-CG 3.91Å; I115-Y459 PolarHBondContact O-OH 3.18Å; I115-M461 HydrophobicContact CD1-CE 4.33Å; I115-M461 HydrophobicContact CG2-CE 4.49Å; I115-T481 HydrophobicContact CB-CG2 4.48Å; I115-T481 HydrophobicContact CD1-CG2 4.17Å; I115-T481 HydrophobicContact CG2-CG2 4.03Å
116	T	91.8	Very high	95.1	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-25.9	-173.5	62	0	0	0	0	113.4	H113 I118 T481 L484 L485 K488	H113-T116 PolarHBondContact ND1-OG1 3.29Å; T116-I118 VanDerWaalsContact C-N 3.27Å; T116-I118 PolarHBondContact OG1-N 3.24Å; T116-T481 HydrophobicContact CG2-CG2 4.49Å; T116-L484 HydrophobicContact CG2-CB 3.85Å; T116-L485 HydrophobicContact CG2-CD2 3.73Å; T116-L485 HydrophobicContact CG2-CG 3.66Å; T116-K488 WeakPolarHBondContact O-CD 3.37Å; T116-K488 WeakPolarHBondContact O-CE 3.31Å; T116-K488 PolarHBondContact O-NZ 3.49Å
117	G	93.8	Very high	95.2	Very high	28 Å²	28	22.9 Å²	22.9	29%	0.289	12%	0.123	S	C	.	.			trans	78.9	2.4	-172.9	0	0	0	0	0	114.8	K112 H113	K112-G117 WeakPolarHBondContact CE-O 3.48Å; H113-G117 WeakPolarHBondContact O-CA 3.35Å; H113-G117 PolarHBondContact O-N 3.34Å
118	I	94.2	Very high	95	Very high	30 Å²	30	26.8 Å²	26.8	15%	0.154	15%	0.151	C	C	.	.			trans	-76.7	144.7	179.9	-73.6	171.9	0	0	0	111.1	K112 H113 T116 L484 E487 K488	K112-I118 WeakPolarHBondContact CA-O 3.39Å; H113-I118 PolarHBondContact N-O 2.99Å; T116-I118 VanDerWaalsContact C-N 3.27Å; T116-I118 PolarHBondContact OG1-N 3.24Å; I118-L484 HydrophobicContact CB-CD2 4.31Å; I118-L484 HydrophobicContact CD1-CB 4.49Å; I118-L484 WeakPolarHBondContact CD1-O 3.44Å; I118-L484 HydrophobicContact CG2-CD2 3.79Å; I118-E487 HydrophobicContact CD1-CB 4.22Å; I118-K488 HydrophobicContact CD1-CB 3.77Å; I118-K488 HydrophobicContact CD1-CG 4.41Å
119	F	96.8	Very high	94.6	Very high	93 Å²	93	29.5 Å²	29.5	41%	0.408	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	139.2	171	-70.9	-76.5	0	0	0	111.9	E97 L110 A111 K112 Y172	E97-F119 HydrophobicContact CG-CE1 4.09Å; L110-F119 HydrophobicContact CD1-CB 3.92Å; L110-F119 HydrophobicContact CD1-CD1 3.84Å; L110-F119 HydrophobicContact CD1-CG 4.21Å; L110-F119 HydrophobicContact CD2-CD1 4.42Å; L110-F119 HydrophobicContact CG-CD1 4.13Å; A111-F119 CarbonylContact O-C 3.47Å; A111-F119 VanDerWaalsContact O-CA 3.28Å; A111-F119 WeakPolarHBondContact O-CA 3.35Å; K112-F119 HydrophobicContact CB-CD1 4.04Å; K112-F119 HydrophobicContact CB-CE1 3.97Å; K112-F119 HydrophobicContact CD-CE1 4.34Å; K112-F119 HydrophobicContact CD-CZ 4.32Å; K112-F119 HydrophobicContact CG-CD1 4.5Å; K112-F119 HydrophobicContact CG-CE1 4.34Å; F119-Y172 HydrophobicContact CB-CD1 4.1Å
120	V	97.5	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.8	-179.4	-63.5	0	0	0	0	110.2	Y94 A111 I122 Y157 V169 M170 L484	Y94-V120 HydrophobicContact CD1-CG2 3.58Å; Y94-V120 HydrophobicContact CE1-CG1 4.4Å; Y94-V120 HydrophobicContact CE1-CG2 3.77Å; A111-V120 HydrophobicContact CB-CG2 4.06Å; A111-V120 PolarHBondContact N-O 3.11Å; A111-V120 PolarHBondContact O-N 3.06Å; V120-I122 HydrophobicContact CG2-CD1 4.42Å; V120-I122 HydrophobicContact CG2-CG1 4.14Å; V120-Y157 HydrophobicContact CG1-CD2 4.13Å; V120-Y157 HydrophobicContact CG1-CE2 4.31Å; V120-V169 HydrophobicContact CB-CG1 3.79Å; V120-V169 HydrophobicContact CG1-CG1 4.1Å; V120-V169 HydrophobicContact CG2-CG1 3.72Å; V120-M170 WeakPolarHBondContact CB-O 3.41Å; V120-L484 HydrophobicContact CG1-CD1 4.26Å; V120-L484 HydrophobicContact CG1-CD2 3.84Å
121	A	97.5	Very high	93.8	Very high	8 Å²	8	31.4 Å²	31.4	7%	0.066	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.4	170.6	0	0	0	0	0	109.1	I100 V108 M170	I100-A121 HydrophobicContact CD1-CB 4.11Å; V108-A121 HydrophobicContact CG1-CB 4.12Å; A121-M170 PolarHBondContact N-O 3.48Å; A121-M170 PolarHBondContact O-N 2.92Å
122	I	97.5	Very high	93.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	109.5	178.7	-49.5	-172.9	0	0	0	108.9	L91 Y94 I96 V108 K109 A111 V120 I124 C167 M168 V169	L91-I122 HydrophobicContact CD2-CD1 4.28Å; L91-I122 HydrophobicContact CD2-CG2 4.15Å; Y94-I122 HydrophobicContact CD1-CD1 4.44Å; Y94-I122 HydrophobicContact CD2-CD1 4.26Å; Y94-I122 HydrophobicContact CG-CD1 3.92Å; I96-I122 HydrophobicContact CD1-CD1 3.95Å; V108-I122 CarbonylContact C-O 3.58Å; V108-I122 VanDerWaalsContact CA-O 3.32Å; V108-I122 WeakPolarHBondContact CA-O 3.21Å; K109-I122 PolarHBondContact N-O 2.97Å; K109-I122 PolarHBondContact O-N 3.39Å; A111-I122 HydrophobicContact CB-CD1 3.6Å; A111-I122 HydrophobicContact CB-CG1 4.01Å; V120-I122 HydrophobicContact CG2-CD1 4.42Å; V120-I122 HydrophobicContact CG2-CG1 4.14Å; I122-I124 HydrophobicContact CB-CG1 4.42Å; I122-I124 HydrophobicContact CG2-CD1 4.29Å; I122-I124 HydrophobicContact CG2-CG1 3.72Å; I122-I124 PolarHBondContact O-N 3.37Å; I122-C167 HydrophobicContact CG2-CB 4.11Å; I122-M168 CarbonylContact C-O 3.41Å; I122-M168 WeakPolarHBondContact CA-O 3.44Å; I122-V169 HydrophobicContact CD1-CG2 4.21Å; I122-V169 HydrophobicContact CG1-CG1 4.35Å; I122-V169 HydrophobicContact CG1-CG2 4.16Å; I122-V169 HydrophobicContact CG2-CG2 4.31Å
123	K	95.6	Very high	92.9	Very high	14 Å²	14	35.4 Å²	35.4	6%	0.061	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	107	171.3	-178.5	167.9	174.7	179	0	107.5	V108 I125 E141 C167 M168 M170 D234	V108-K123 HydrophobicContact CG2-CB 4.3Å; V108-K123 HydrophobicContact CG2-CG 4.36Å; K123-I125 HydrophobicContact CG-CD1 4.2Å; K123-I125 HydrophobicContact CG-CG1 4.28Å; K123-E141 VanDerWaalsContact NZ-CD 3.3Å; K123-E141 IonicContact NZ-OE1 3.6Å; K123-E141 PolarHBondContact NZ-OE1 3.41Å; K123-E141 IonicContact NZ-OE2 3.55Å; K123-E141 PolarHBondContact NZ-OE2 3.15Å; K123-E141 VanDerWaalsContact NZ-OE2 3.12Å; K123-C167 WeakPolarHBondContact O-CA 3.39Å; K123-M168 HydrophobicContact CD-CE 3.98Å; K123-M168 HydrophobicContact CG-CE 4.29Å; K123-M168 PolarHBondContact N-O 2.82Å; K123-M168 PolarHBondContact O-N 2.76Å; K123-M170 HydrophobicContact CB-CE 3.68Å; K123-M170 HydrophobicContact CD-CE 4.4Å; K123-D234 IonicContact NZ-OD1 2.71Å; K123-D234 IonicContact NZ-OD2 3.53Å; K123-D234 PolarHBondContact NZ-OD2 3.19Å
124	I	95.1	Very high	92.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.7	-176.6	-57.7	-179.8	0	0	0	107.9	L67 I71 S106 S107 K109 I122 L165	L67-I124 HydrophobicContact CD2-CD1 3.37Å; I71-I124 HydrophobicContact CD1-CG2 4.45Å; S106-I124 CarbonylContact C-O 3.6Å; S106-I124 WeakPolarHBondContact CA-O 3.42Å; S106-I124 WeakPolarHBondContact CB-O 3.21Å; S107-I124 PolarHBondContact N-O 2.64Å; S107-I124 PolarHBondContact O-N 3.33Å; K109-I124 HydrophobicContact CD-CD1 3.8Å; K109-I124 HydrophobicContact CG-CD1 4.25Å; I122-I124 HydrophobicContact CB-CG1 4.42Å; I122-I124 HydrophobicContact CG2-CD1 4.29Å; I122-I124 HydrophobicContact CG2-CG1 3.72Å; I122-I124 PolarHBondContact O-N 3.37Å; I124-L165 HydrophobicContact CG2-CD1 3.64Å
125	I	93.5	Very high	92.3	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.4	-173.1	-63.1	153	0	0	0	109	K123 L130 I138 L165 L166 M168	K123-I125 HydrophobicContact CG-CD1 4.2Å; K123-I125 HydrophobicContact CG-CG1 4.28Å; I125-L130 HydrophobicContact CG2-CD1 3.66Å; I125-I138 HydrophobicContact CD1-CD1 4.13Å; I125-I138 HydrophobicContact CD1-CG2 3.76Å; I125-I138 HydrophobicContact CG2-CG2 4.48Å; I125-L165 VanDerWaalsContact O-CA 3.3Å; I125-L165 WeakPolarHBondContact O-CA 3.3Å; I125-L166 PolarHBondContact N-O 3.27Å; I125-L166 PolarHBondContact O-N 3.21Å; I125-M168 HydrophobicContact CD1-CE 3.69Å
126	D	91.9	Very high	92.3	Very high	17 Å²	17	38.9 Å²	38.9	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	107.4	174.7	-175.2	-4.5	0	0	0	110.8	F105 S128 R129 L165	F105-D126 PolarHBondContact O-N 2.6Å; F105-D126 VanDerWaalsContact O-N 3.16Å; D126-S128 VanDerWaalsContact CG-OG 3.24Å; D126-S128 PolarHBondContact O-N 2.92Å; D126-S128 VanDerWaalsContact OD1-CB 3.31Å; D126-S128 WeakPolarHBondContact OD1-CB 3.5Å; D126-S128 PolarHBondContact OD1-N 3.42Å; D126-S128 PolarHBondContact OD1-OG 2.94Å; D126-S128 PolarHBondContact OD2-OG 2.66Å; D126-R129 HydrophobicContact CB-CG 4.48Å; D126-R129 PolarHBondContact O-N 3.41Å; D126-R129 VanDerWaalsContact OD2-CD 3.25Å; D126-R129 WeakPolarHBondContact OD2-CD 3.45Å; D126-L165 HydrophobicContact CB-CD2 3.92Å
127	K	92.7	Very high	92.1	Very high	30 Å²	30	41.4 Å²	41.4	13%	0.13	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23.2	179.3	-57.6	-169.7	-73.4	169.9	0	112.7	R129 L130 L135 E161 T162 Q163 R164 L166	K127-R129 PolarHBondContact O-N 2.87Å; K127-L130 PolarHBondContact O-N 2.94Å; K127-L135 HydrophobicContact CB-CD1 4.2Å; K127-L135 HydrophobicContact CD-CD1 3.67Å; K127-L135 HydrophobicContact CG-CD1 3.75Å; K127-E161 IonicContact NZ-OE1 3.47Å; K127-E161 PolarHBondContact NZ-OE1 2.73Å; K127-T162 WeakPolarHBondContact CE-O 3.43Å; K127-T162 PolarHBondContact NZ-O 3.15Å; K127-Q163 WeakPolarHBondContact CE-O 3.33Å; K127-R164 WeakPolarHBondContact CA-O 3.39Å; K127-R164 WeakPolarHBondContact CB-O 3.46Å; K127-R164 WeakPolarHBondContact CG-O 3.46Å; K127-R164 PolarHBondContact N-O 3.48Å; K127-L166 HydrophobicContact CD-CB 4.31Å; K127-L166 HydrophobicContact CG-CB 4.31Å
128	S	88.8	Confident	92.1	Very high	87 Å²	87	40.9 Å²	40.9	61%	0.608	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-70.4	-17.7	-179.8	73.3	0	0	0	0	113.2	D126	D126-S128 VanDerWaalsContact CG-OG 3.24Å; D126-S128 PolarHBondContact O-N 2.92Å; D126-S128 VanDerWaalsContact OD1-CB 3.31Å; D126-S128 WeakPolarHBondContact OD1-CB 3.5Å; D126-S128 PolarHBondContact OD1-N 3.42Å; D126-S128 PolarHBondContact OD1-OG 2.94Å; D126-S128 PolarHBondContact OD2-OG 2.66Å
129	R	86	Confident	92	Very high	91 Å²	91	43 Å²	43	34%	0.343	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-101.7	6.7	-179	-62.5	174.1	54.9	-175.2	-9.2	113.5	D72 I104 F105 D126 K127	D72-R129 IonicContact OD1-CZ 2.63Å; D72-R129 IonicContact OD1-NH1 2.66Å; D72-R129 PolarHBondContact OD1-NH1 3.17Å; I104-R129 PolarHBondContact O-NH2 3.19Å; F105-R129 HydrophobicContact CD1-CB 3.84Å; F105-R129 WeakPolarHBondContact CD1-O 3.27Å; F105-R129 HydrophobicContact CE1-CB 4.37Å; F105-R129 VanDerWaalsContact CE1-O 3.3Å; F105-R129 WeakPolarHBondContact CE1-O 3.44Å; D126-R129 HydrophobicContact CB-CG 4.48Å; D126-R129 PolarHBondContact O-N 3.41Å; D126-R129 VanDerWaalsContact OD2-CD 3.25Å; D126-R129 WeakPolarHBondContact OD2-CD 3.45Å; K127-R129 PolarHBondContact O-N 2.87Å
130	L	86.9	Confident	91.9	Very high	24 Å²	24	43.4 Å²	43.4	13%	0.126	21%	0.214	C	C	.	.	S	Bend	trans	-113.1	142.7	-176.5	-66.8	177.4	0	0	0	111.9	F105 I125 K127 N134 I138	F105-L130 HydrophobicContact CB-CD2 3.75Å; F105-L130 HydrophobicContact CB-CG 4.42Å; F105-L130 HydrophobicContact CD1-CD2 4.15Å; F105-L130 HydrophobicContact CD2-CD2 3.73Å; F105-L130 HydrophobicContact CE2-CD2 4.38Å; F105-L130 HydrophobicContact CG-CD2 3.6Å; I125-L130 HydrophobicContact CG2-CD1 3.66Å; K127-L130 PolarHBondContact O-N 2.94Å; L130-N134 HydrophobicContact CB-CB 4.4Å; L130-N134 HydrophobicContact CD2-CB 4.17Å; L130-I138 HydrophobicContact CD1-CG1 4.13Å
131	S	89.9	Confident	91.8	Very high	39 Å²	39	43.6 Å²	43.6	27%	0.273	22%	0.215	S	C	.	.			trans	-70.3	159.6	166.5	88.6	0	0	0	0	111	E133 N134 L135	S131-E133 VanDerWaalsContact CB-OE2 3.27Å; S131-E133 WeakPolarHBondContact CB-OE2 3.11Å; S131-E133 PolarHBondContact O-N 2.84Å; S131-E133 PolarHBondContact OG-N 3.22Å; S131-E133 PolarHBondContact OG-OE2 2.88Å; S131-N134 PolarHBondContact O-N 2.91Å; S131-N134 PolarHBondContact OG-N 3.26Å; S131-N134 PolarHBondContact OG-ND2 3.38Å; S131-L135 PolarHBondContact O-N 3.11Å
132	P	89.8	Confident	91.6	Very high	84 Å²	84	43.3 Å²	43.3	55%	0.545	21%	0.212	S	C	.	.	H	α-helix	trans	-56	-33.6	177.2	-25.4	35.3	0	0	0	113.9	N134 K136	P132-N134 VanDerWaalsContact C-N 3.33Å; P132-K136 VanDerWaalsContact O-CG 3.29Å; P132-K136 WeakPolarHBondContact O-CG 3.46Å; P132-K136 PolarHBondContact O-N 3.48Å
133	E	88.1	Confident	91.5	Very high	83 Å²	83	46.7 Å²	46.7	39%	0.388	23%	0.23	S	C	.	.	H	α-helix	trans	-67	-37.9	177.9	-59.6	60.9	-123.3	0	0	110.7	S131 K136 K137	S131-E133 VanDerWaalsContact CB-OE2 3.27Å; S131-E133 WeakPolarHBondContact CB-OE2 3.11Å; S131-E133 PolarHBondContact O-N 2.84Å; S131-E133 PolarHBondContact OG-N 3.22Å; S131-E133 PolarHBondContact OG-OE2 2.88Å; E133-K136 WeakPolarHBondContact O-CB 3.44Å; E133-K136 PolarHBondContact O-N 2.97Å; E133-K137 WeakPolarHBondContact O-CG 3.44Å; E133-K137 PolarHBondContact O-N 2.87Å; E133-K137 VanDerWaalsContact O-N 3.14Å
134	N	87.5	Confident	91.4	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-80.5	-35.6	-178.1	-62.6	-26.5	0	0	0	111.3	L130 S131 P132 K136 K137 I138 L586	L130-N134 HydrophobicContact CB-CB 4.4Å; L130-N134 HydrophobicContact CD2-CB 4.17Å; S131-N134 PolarHBondContact O-N 2.91Å; S131-N134 PolarHBondContact OG-N 3.26Å; S131-N134 PolarHBondContact OG-ND2 3.38Å; P132-N134 VanDerWaalsContact C-N 3.33Å; N134-K136 VanDerWaalsContact C-N 3.3Å; N134-K136 PolarHBondContact O-N 3.04Å; N134-K137 WeakPolarHBondContact O-CB 3.46Å; N134-K137 PolarHBondContact O-N 3.38Å; N134-K137 WeakPolarHBondContact OD1-CE 3.33Å; N134-K137 PolarHBondContact OD1-NZ 3.14Å; N134-I138 WeakPolarHBondContact O-CG1 3.28Å; N134-I138 PolarHBondContact O-N 3.07Å; N134-L586 HydrophobicContact CB-CB 4.25Å; N134-L586 HydrophobicContact CB-CD1 4.37Å; N134-L586 VanDerWaalsContact ND2-C 3.31Å; N134-L586 WeakPolarHBondContact ND2-CB 3.22Å; N134-L586 PolarHBondContact ND2-O 2.81Å; N134-L586 WeakPolarHBondContact OD1-CB 3.41Å; N134-L586 PolarHBondContact OD1-O 3.31Å
135	L	90.9	Very high	91.4	Very high	40 Å²	40	46.4 Å²	46.4	21%	0.209	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-39	168.6	-173.4	61.2	0	0	0	111.7	K127 S131 I138 Y139	K127-L135 HydrophobicContact CB-CD1 4.2Å; K127-L135 HydrophobicContact CD-CD1 3.67Å; K127-L135 HydrophobicContact CG-CD1 3.75Å; S131-L135 PolarHBondContact O-N 3.11Å; L135-I138 PolarHBondContact O-N 2.99Å; L135-Y139 HydrophobicContact CD1-CD2 4.31Å; L135-Y139 HydrophobicContact CD1-CE2 3.74Å; L135-Y139 HydrophobicContact CD2-CE2 3.96Å; L135-Y139 HydrophobicContact CG-CD2 4.02Å; L135-Y139 HydrophobicContact CG-CE2 3.5Å; L135-Y139 VanDerWaalsContact CG-CE2 3.5Å; L135-Y139 VanDerWaalsContact O-CD2 3.22Å; L135-Y139 WeakPolarHBondContact O-CD2 3.48Å; L135-Y139 PolarHBondContact O-N 3.32Å
136	K	91.2	Very high	91.3	Very high	136 Å²	136	49.3 Å²	49.3	59%	0.591	24%	0.242	S	C	*	.	H	α-helix	trans	-61.6	-40.6	171.2	-73.6	166.6	-175.4	169.8	0	112.9	P132 E133 N134 R140	P132-K136 VanDerWaalsContact O-CG 3.29Å; P132-K136 WeakPolarHBondContact O-CG 3.46Å; P132-K136 PolarHBondContact O-N 3.48Å; E133-K136 WeakPolarHBondContact O-CB 3.44Å; E133-K136 PolarHBondContact O-N 2.97Å; N134-K136 VanDerWaalsContact C-N 3.3Å; N134-K136 PolarHBondContact O-N 3.04Å; K136-R140 PolarHBondContact O-N 3.36Å
137	K	89.5	Confident	91.3	Very high	55 Å²	55	51.4 Å²	51.4	24%	0.239	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-43.8	174.7	-66.3	167	-167	163.6	0	111.1	E133 N134 R140 E141 L586	E133-K137 WeakPolarHBondContact O-CG 3.44Å; E133-K137 PolarHBondContact O-N 2.87Å; E133-K137 VanDerWaalsContact O-N 3.14Å; N134-K137 WeakPolarHBondContact O-CB 3.46Å; N134-K137 PolarHBondContact O-N 3.38Å; N134-K137 WeakPolarHBondContact OD1-CE 3.33Å; N134-K137 PolarHBondContact OD1-NZ 3.14Å; K137-R140 WeakPolarHBondContact O-CB 3.39Å; K137-R140 PolarHBondContact O-N 2.78Å; K137-E141 PolarHBondContact O-N 3.18Å; K137-L586 HydrophobicContact CD-CD2 4.18Å; K137-L586 PolarHBondContact NZ-O 2.92Å
138	I	91.9	Very high	91.2	Very high	18 Å²	18	50.2 Å²	50.2	9%	0.092	25%	0.246	C	C	.	.	H	α-helix	trans	-65.9	-40.9	178.6	-69.3	-59.6	0	0	0	112.7	I125 L130 N134 L135 R140 E141 S142 L166	I125-I138 HydrophobicContact CD1-CD1 4.13Å; I125-I138 HydrophobicContact CD1-CG2 3.76Å; I125-I138 HydrophobicContact CG2-CG2 4.48Å; L130-I138 HydrophobicContact CD1-CG1 4.13Å; N134-I138 WeakPolarHBondContact O-CG1 3.28Å; N134-I138 PolarHBondContact O-N 3.07Å; L135-I138 PolarHBondContact O-N 2.99Å; I138-R140 VanDerWaalsContact C-N 3.34Å; I138-E141 WeakPolarHBondContact O-CB 3.08Å; I138-E141 PolarHBondContact O-N 3.47Å; I138-S142 PolarHBondContact O-N 3.03Å; I138-L166 HydrophobicContact CG2-CD2 3.44Å; I138-L166 VanDerWaalsContact CG2-CD2 3.44Å
139	Y	94.2	Very high	91.1	Very high	73 Å²	73	48.7 Å²	48.7	29%	0.286	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-39.6	172.6	-71.9	-56.6	0	0	0	111.8	L135 E141 S142 D143 E161 L166	L135-Y139 HydrophobicContact CD1-CD2 4.31Å; L135-Y139 HydrophobicContact CD1-CE2 3.74Å; L135-Y139 HydrophobicContact CD2-CE2 3.96Å; L135-Y139 HydrophobicContact CG-CD2 4.02Å; L135-Y139 HydrophobicContact CG-CE2 3.5Å; L135-Y139 VanDerWaalsContact CG-CE2 3.5Å; L135-Y139 VanDerWaalsContact O-CD2 3.22Å; L135-Y139 WeakPolarHBondContact O-CD2 3.48Å; L135-Y139 PolarHBondContact O-N 3.32Å; Y139-E141 PolarHBondContact O-N 2.81Å; Y139-S142 CarbonylContact O-C 3.53Å; Y139-S142 WeakPolarHBondContact O-CA 3.32Å; Y139-S142 WeakPolarHBondContact O-CB 3.43Å; Y139-S142 PolarHBondContact O-N 2.83Å; Y139-S142 VanDerWaalsContact O-N 3.11Å; Y139-D143 PolarHBondContact O-N 2.92Å; Y139-E161 PolarHBondContact OH-OE1 3.38Å; Y139-L166 HydrophobicContact CD1-CD2 4.46Å; Y139-L166 HydrophobicContact CE1-CD1 4.47Å; Y139-L166 HydrophobicContact CE1-CD2 4.39Å
140	R	94.2	Very high	91.2	Very high	103 Å²	103	45 Å²	45	39%	0.389	22%	0.216	S	C	.	.	H	α-helix	trans	-61.1	-42.4	174	-173.4	-170.6	-60.1	164.7	-0.9	112.5	K136 K137 I138 S142 D143 I144 G238	K136-R140 PolarHBondContact O-N 3.36Å; K137-R140 WeakPolarHBondContact O-CB 3.39Å; K137-R140 PolarHBondContact O-N 2.78Å; I138-R140 VanDerWaalsContact C-N 3.34Å; R140-S142 VanDerWaalsContact C-N 3.29Å; R140-S142 PolarHBondContact O-N 2.96Å; R140-D143 PolarHBondContact O-N 2.95Å; R140-I144 HydrophobicContact CG-CD1 3.92Å; R140-I144 HydrophobicContact CG-CG1 4.41Å; R140-I144 WeakPolarHBondContact O-CB 3.42Å; R140-I144 WeakPolarHBondContact O-CG1 3.38Å; R140-I144 PolarHBondContact O-N 3.2Å; R140-G238 WeakPolarHBondContact CD-O 3.5Å
141	E	94.5	Very high	91.4	Very high	3 Å²	3	46.3 Å²	46.3	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-55.7	-47.6	171.7	-178	-172.6	169.6	0	0	110.2	K123 K137 I138 Y139 D143 I144 L145 M168 F235	K123-E141 VanDerWaalsContact NZ-CD 3.3Å; K123-E141 IonicContact NZ-OE1 3.6Å; K123-E141 PolarHBondContact NZ-OE1 3.41Å; K123-E141 IonicContact NZ-OE2 3.55Å; K123-E141 PolarHBondContact NZ-OE2 3.15Å; K123-E141 VanDerWaalsContact NZ-OE2 3.12Å; K137-E141 PolarHBondContact O-N 3.18Å; I138-E141 WeakPolarHBondContact O-CB 3.08Å; I138-E141 PolarHBondContact O-N 3.47Å; Y139-E141 PolarHBondContact O-N 2.81Å; E141-D143 VanDerWaalsContact C-N 3.33Å; E141-D143 PolarHBondContact O-N 3.37Å; E141-I144 PolarHBondContact O-N 3.49Å; E141-L145 HydrophobicContact CG-CD1 4.01Å; E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 VanDerWaalsContact O-CG 3.29Å; E141-L145 WeakPolarHBondContact O-CG 3.5Å; E141-L145 PolarHBondContact O-N 2.88Å; E141-M168 HydrophobicContact CG-CE 4.46Å; E141-F235 HydrophobicContact CG-CB 4.41Å
142	S	93.8	Very high	91.7	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-35.9	178	-177.5	0	0	0	0	113.4	I138 Y139 R140 K146 V159	I138-S142 PolarHBondContact O-N 3.03Å; Y139-S142 CarbonylContact O-C 3.53Å; Y139-S142 WeakPolarHBondContact O-CA 3.32Å; Y139-S142 WeakPolarHBondContact O-CB 3.43Å; Y139-S142 PolarHBondContact O-N 2.83Å; Y139-S142 VanDerWaalsContact O-N 3.11Å; R140-S142 VanDerWaalsContact C-N 3.29Å; R140-S142 PolarHBondContact O-N 2.96Å; S142-K146 WeakPolarHBondContact O-CE 3.3Å; S142-K146 VanDerWaalsContact O-CG 3.29Å; S142-K146 WeakPolarHBondContact O-CG 3.24Å; S142-K146 PolarHBondContact O-N 3.18Å; S142-V159 WeakPolarHBondContact OG-CG2 3.49Å
143	D	94.3	Very high	92	Very high	72 Å²	72	40.8 Å²	40.8	39%	0.385	19%	0.19	S	C	.	.	H	α-helix	trans	-75.7	-43.9	179.7	-68.2	-31	0	0	0	111.6	Y139 R140 E141 L145 K146 E147	Y139-D143 PolarHBondContact O-N 2.92Å; R140-D143 PolarHBondContact O-N 2.95Å; E141-D143 VanDerWaalsContact C-N 3.33Å; E141-D143 PolarHBondContact O-N 3.37Å; D143-L145 VanDerWaalsContact C-N 3.29Å; D143-L145 PolarHBondContact O-N 3.48Å; D143-K146 WeakPolarHBondContact O-CB 3.46Å; D143-K146 PolarHBondContact O-N 3.16Å; D143-K146 IonicContact OD1-NZ 2.7Å; D143-K146 PolarHBondContact OD1-NZ 3.3Å; D143-E147 PolarHBondContact O-N 2.92Å
144	I	95	Very high	92.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-54.1	-46	170.9	-74.8	171.4	0	0	0	110.8	R140 E141 K146 E147 L148 I212 F235 G238	R140-I144 HydrophobicContact CG-CD1 3.92Å; R140-I144 HydrophobicContact CG-CG1 4.41Å; R140-I144 WeakPolarHBondContact O-CB 3.42Å; R140-I144 WeakPolarHBondContact O-CG1 3.38Å; R140-I144 PolarHBondContact O-N 3.2Å; E141-I144 PolarHBondContact O-N 3.49Å; I144-K146 PolarHBondContact O-N 2.7Å; I144-E147 PolarHBondContact O-N 3.46Å; I144-E147 VanDerWaalsContact O-N 3.09Å; I144-L148 HydrophobicContact CG2-CD1 3.64Å; I144-L148 HydrophobicContact CG2-CG 4.29Å; I144-L148 WeakPolarHBondContact O-CG 3.47Å; I144-L148 PolarHBondContact O-N 3.15Å; I144-L148 VanDerWaalsContact O-N 3.17Å; I144-I212 HydrophobicContact CD1-CG2 4.22Å; I144-I212 HydrophobicContact CG1-CD1 4.44Å; I144-I212 HydrophobicContact CG1-CG2 4.42Å; I144-I212 HydrophobicContact CG2-CD1 4.26Å; I144-I212 HydrophobicContact CG2-CG2 4.01Å; I144-F235 HydrophobicContact CG2-CB 3.87Å; I144-F235 HydrophobicContact CG2-CD1 3.8Å; I144-F235 HydrophobicContact CG2-CG 3.91Å; I144-G238 VanDerWaalsContact CD1-C 3.49Å
145	L	94.3	Very high	92.7	Very high	9 Å²	9	40 Å²	40	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-67.2	-17.2	178.5	-74	174.6	0	0	0	114.3	E141 D143 L156 M168 M170 F235	E141-L145 HydrophobicContact CG-CD1 4.01Å; E141-L145 WeakPolarHBondContact O-CB 3.39Å; E141-L145 VanDerWaalsContact O-CG 3.29Å; E141-L145 WeakPolarHBondContact O-CG 3.5Å; E141-L145 PolarHBondContact O-N 2.88Å; D143-L145 VanDerWaalsContact C-N 3.29Å; D143-L145 PolarHBondContact O-N 3.48Å; L145-L156 HydrophobicContact CB-CB 4.16Å; L145-L156 HydrophobicContact CB-CD2 3.95Å; L145-L156 WeakPolarHBondContact O-CB 3.34Å; L145-M168 HydrophobicContact CD1-SD 4.16Å; L145-M170 HydrophobicContact CD1-SD 4.42Å; L145-F235 HydrophobicContact CD2-CD2 3.77Å; L145-F235 HydrophobicContact CD2-CE2 4.43Å; L145-F235 HydrophobicContact CD2-CG 4.5Å
146	K	92.5	Very high	92.9	Very high	62 Å²	62	38.5 Å²	38.5	27%	0.27	18%	0.178	S	C	.	.	H	α-helix	trans	-80	-33.1	170.3	-65	164.6	-162.1	159	0	111.7	S142 D143 I144 H149 L156 Y475	S142-K146 WeakPolarHBondContact O-CE 3.3Å; S142-K146 VanDerWaalsContact O-CG 3.29Å; S142-K146 WeakPolarHBondContact O-CG 3.24Å; S142-K146 PolarHBondContact O-N 3.18Å; D143-K146 WeakPolarHBondContact O-CB 3.46Å; D143-K146 PolarHBondContact O-N 3.16Å; D143-K146 IonicContact OD1-NZ 2.7Å; D143-K146 PolarHBondContact OD1-NZ 3.3Å; I144-K146 PolarHBondContact O-N 2.7Å; K146-H149 PolarHBondContact O-NE2 3.28Å; K146-L156 HydrophobicContact CG-CD2 3.72Å; K146-Y475 HydrophobicContact CB-CD2 4.25Å; K146-Y475 HydrophobicContact CB-CE1 4.49Å; K146-Y475 HydrophobicContact CB-CE2 3.64Å; K146-Y475 HydrophobicContact CD-CD2 4Å; K146-Y475 HydrophobicContact CD-CE2 4.21Å; K146-Y475 HydrophobicContact CG-CD1 4.35Å; K146-Y475 HydrophobicContact CG-CD2 3.62Å; K146-Y475 HydrophobicContact CG-CE1 4.23Å; K146-Y475 HydrophobicContact CG-CE2 3.55Å; K146-Y475 HydrophobicContact CG-CG 4.08Å; K146-Y475 PolarHBondContact O-OH 2.99Å
147	E	90.4	Very high	93.1	Very high	61 Å²	61	32.5 Å²	32.5	29%	0.285	15%	0.152	S	C	.	.	H	α-helix	trans	-76.6	-29.6	-179.2	-66.9	169.9	-125.6	0	0	112.6	D143 I144 H149 Y206 I212 H240	D143-E147 PolarHBondContact O-N 2.92Å; I144-E147 PolarHBondContact O-N 3.46Å; I144-E147 VanDerWaalsContact O-N 3.09Å; E147-H149 PolarHBondContact O-CD2 2.87Å; E147-H149 PolarHBondContact O-N 3.23Å; E147-Y206 PolarHBondContact O-OH 3.12Å; E147-I212 HydrophobicContact CB-CD1 4.43Å; E147-H240 VanDerWaalsContact CD-NE2 3.26Å; E147-H240 IonicContact OE1-CE1 3.34Å; E147-H240 PolarHBondContact OE1-CE1 2.92Å; E147-H240 IonicContact OE1-NE2 2.92Å; E147-H240 PolarHBondContact OE1-NE2 2.87Å; E147-H240 IonicContact OE2-CD2 2.99Å; E147-H240 IonicContact OE2-NE2 2.79Å; E147-H240 PolarHBondContact OE2-NE2 3Å
148	L	90.5	Very high	93.4	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.031	14%	0.144	C	C	.	.			trans	-85.7	113.2	-172.8	-65.1	175.7	0	0	0	113.4	I144 I153 Y206 T207 C210 I212 F235	I144-L148 HydrophobicContact CG2-CD1 3.64Å; I144-L148 HydrophobicContact CG2-CG 4.29Å; I144-L148 WeakPolarHBondContact O-CG 3.47Å; I144-L148 PolarHBondContact O-N 3.15Å; I144-L148 VanDerWaalsContact O-N 3.17Å; L148-I153 HydrophobicContact CB-CD1 4.48Å; L148-I153 HydrophobicContact CB-CG2 4.42Å; L148-I153 HydrophobicContact CD1-CD1 4.48Å; L148-I153 HydrophobicContact CD2-CD1 4.46Å; L148-Y206 HydrophobicContact CB-CE1 4.33Å; L148-Y206 HydrophobicContact CD2-CD1 4.13Å; L148-Y206 HydrophobicContact CD2-CE1 3.67Å; L148-T207 HydrophobicContact CD1-CG2 4Å; L148-T207 HydrophobicContact CD2-CG2 3.77Å; L148-C210 HydrophobicContact CD2-CB 4.48Å; L148-I212 HydrophobicContact CD2-CD1 3.95Å; L148-I212 HydrophobicContact CG-CD1 4.27Å; L148-F235 HydrophobicContact CD1-CD1 3.91Å; L148-F235 HydrophobicContact CD1-CD2 4.2Å; L148-F235 HydrophobicContact CD1-CE1 3.52Å; L148-F235 HydrophobicContact CD1-CE2 3.84Å; L148-F235 HydrophobicContact CD1-CG 4.24Å; L148-F235 HydrophobicContact CD1-CZ 3.49Å; L148-F235 VanDerWaalsContact CD1-CZ 3.49Å
149	H	88.2	Confident	93.5	Very high	54 Å²	54	31.3 Å²	31.3	25%	0.25	15%	0.149	C	C	.	.			trans	-128.4	89.7	174.9	-55.7	-88.2	0	0	0	111.3	K146 E147 Y206 N438 L439 Y475	K146-H149 PolarHBondContact O-NE2 3.28Å; E147-H149 PolarHBondContact O-CD2 2.87Å; E147-H149 PolarHBondContact O-N 3.23Å; H149-Y206 PolarHBondContact N-OH 2.89Å; H149-N438 HydrophobicContact CB-CB 3.58Å; H149-N438 VanDerWaalsContact CD2-CB 3.45Å; H149-N438 WeakPolarHBondContact CD2-CB 3.49Å; H149-N438 PolarHBondContact CD2-N 3.42Å; H149-L439 PolarHBondContact NE2-N 2.84Å; H149-Y475 PolarHBondContact CE1-OH 2.86Å
150	H	88.2	Confident	93.6	Very high	13 Å²	13	29.3 Å²	29.3	6%	0.06	14%	0.143	C	C	.	.			trans	-137.5	150.2	-180	-174.6	-85.9	0	0	0	111.1	N152 I153 S202 A203 Y206 N363	H150-N152 VanDerWaalsContact C-N 3.29Å; H150-N152 WeakPolarHBondContact CE1-CB 3.42Å; H150-N152 PolarHBondContact CE1-OD1 2.83Å; H150-N152 PolarHBondContact ND1-N 2.86Å; H150-N152 PolarHBondContact O-N 3.32Å; H150-I153 HydrophobicContact CB-CB 4.15Å; H150-I153 HydrophobicContact CB-CD1 3.8Å; H150-I153 HydrophobicContact CB-CG1 3.87Å; H150-I153 PolarHBondContact O-N 3.49Å; H150-S202 VanDerWaalsContact CE1-C 3.46Å; H150-S202 WeakPolarHBondContact CE1-CB 3.25Å; H150-S202 PolarHBondContact CE1-OG 2.92Å; H150-S202 VanDerWaalsContact CE1-OG 3.23Å; H150-S202 WeakPolarHBondContact NE2-CB 3.48Å; H150-S202 PolarHBondContact NE2-O 2.98Å; H150-S202 PolarHBondContact NE2-OG 2.68Å; H150-A203 PolarHBondContact CE1-N 2.78Å; H150-A203 VanDerWaalsContact CE1-N 3.29Å; H150-Y206 HydrophobicContact CB-CD1 3.58Å; H150-Y206 HydrophobicContact CB-CE1 3.79Å; H150-Y206 HydrophobicContact CB-CG 4.11Å; H150-Y206 AromaticContact CD2-CG 3.71Å; H150-N363 PolarHBondContact NE2-ND2 3.11Å
151	S	91.2	Very high	93.6	Very high	53 Å²	53	29.2 Å²	29.2	37%	0.371	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-34.4	-177.2	45.6	0	0	0	0	113	K231 N363	S151-K231 WeakPolarHBondContact O-CE 3.32Å; S151-K231 PolarHBondContact O-NZ 3.29Å; S151-N363 PolarHBondContact OG-OD1 2.88Å
152	N	95.3	Very high	93.4	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	21.4	177.8	-59.5	115.2	0	0	0	113.9	H150 D199 A203 I230 K231 L232	H150-N152 VanDerWaalsContact C-N 3.29Å; H150-N152 WeakPolarHBondContact CE1-CB 3.42Å; H150-N152 PolarHBondContact CE1-OD1 2.83Å; H150-N152 PolarHBondContact ND1-N 2.86Å; H150-N152 PolarHBondContact O-N 3.32Å; N152-D199 HydrophobicContact CB-CB 4.43Å; N152-D199 WeakPolarHBondContact ND2-CB 3.46Å; N152-D199 PolarHBondContact ND2-OD2 3.23Å; N152-A203 HydrophobicContact CB-CB 4.16Å; N152-I230 VanDerWaalsContact CA-O 3.31Å; N152-I230 WeakPolarHBondContact CA-O 3.43Å; N152-I230 WeakPolarHBondContact CB-O 3.28Å; N152-I230 PolarHBondContact ND2-O 3.46Å; N152-K231 CarbonylContact O-C 3.39Å; N152-K231 WeakPolarHBondContact O-CA 3.14Å; N152-L232 PolarHBondContact O-N 3.39Å
153	I	96	Very high	93.3	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-118.8	143.8	169.1	-61.6	178.7	0	0	0	108.8	L148 H150 K155 A203 Y206 T207 L232 F235	L148-I153 HydrophobicContact CB-CD1 4.48Å; L148-I153 HydrophobicContact CB-CG2 4.42Å; L148-I153 HydrophobicContact CD1-CD1 4.48Å; L148-I153 HydrophobicContact CD2-CD1 4.46Å; H150-I153 HydrophobicContact CB-CB 4.15Å; H150-I153 HydrophobicContact CB-CD1 3.8Å; H150-I153 HydrophobicContact CB-CG1 3.87Å; H150-I153 PolarHBondContact O-N 3.49Å; I153-K155 PolarHBondContact O-N 3Å; I153-A203 HydrophobicContact CD1-CB 4.35Å; I153-A203 HydrophobicContact CG1-CB 3.83Å; I153-Y206 HydrophobicContact CD1-CD1 3.75Å; I153-Y206 HydrophobicContact CD1-CE1 4.22Å; I153-T207 HydrophobicContact CD1-CG2 3.7Å; I153-L232 HydrophobicContact CG1-CB 4.33Å; I153-F235 HydrophobicContact CD1-CZ 4.48Å; I153-F235 HydrophobicContact CG2-CE2 3.95Å; I153-F235 HydrophobicContact CG2-CZ 4.34Å
154	V	95.9	Very high	93.1	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-62.9	119.4	174.1	169.5	0	0	0	0	110	M170 E171 V173 L223 K231 L232 A233	V154-M170 HydrophobicContact CG1-CB 3.94Å; V154-E171 HydrophobicContact CG1-CB 4.15Å; V154-V173 HydrophobicContact CG2-CG2 3.97Å; V154-L223 HydrophobicContact CG2-CD1 4.24Å; V154-K231 HydrophobicContact CG2-CB 4.06Å; V154-L232 PolarHBondContact N-O 2.93Å; V154-A233 HydrophobicContact CB-CB 4.45Å; V154-A233 HydrophobicContact CG2-CB 3.74Å
155	K	94.3	Very high	93	Very high	65 Å²	65	43.6 Å²	43.6	28%	0.283	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-74	139.9	-179.4	-59	-178.1	-177.9	-172.7	0	112.3	I153 Y157 M170 E171 E487	I153-K155 PolarHBondContact O-N 3Å; K155-Y157 HydrophobicContact CB-CE1 4.08Å; K155-Y157 HydrophobicContact CD-CE1 4.35Å; K155-M170 CarbonylContact O-C 3.54Å; K155-M170 WeakPolarHBondContact O-CA 3.5Å; K155-E171 HydrophobicContact CB-CB 4.25Å; K155-E171 PolarHBondContact N-OE2 3.04Å; K155-E171 PolarHBondContact O-N 3.29Å; K155-E487 IonicContact NZ-OE1 3.12Å; K155-E487 PolarHBondContact NZ-OE1 2.96Å
156	L	95.5	Very high	93	Very high	8 Å²	8	43.2 Å²	43.2	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	132	163.3	-176.4	70.2	0	0	0	110	L145 K146 V159 M168 M170 Y475	L145-L156 HydrophobicContact CB-CB 4.16Å; L145-L156 HydrophobicContact CB-CD2 3.95Å; L145-L156 WeakPolarHBondContact O-CB 3.34Å; K146-L156 HydrophobicContact CG-CD2 3.72Å; L156-V159 HydrophobicContact CD1-CG2 4.33Å; L156-V159 HydrophobicContact CD2-CG2 3.89Å; L156-V159 HydrophobicContact CG-CG2 4.48Å; L156-M168 HydrophobicContact CD1-CB 3.97Å; L156-M168 HydrophobicContact CD1-CG 4.4Å; L156-M170 HydrophobicContact CD1-CG 4.15Å; L156-Y475 HydrophobicContact CB-CD1 4.48Å; L156-Y475 HydrophobicContact CB-CE1 4.27Å; L156-Y475 HydrophobicContact CD2-CD1 3.85Å; L156-Y475 HydrophobicContact CD2-CE1 4.06Å; L156-Y475 HydrophobicContact CD2-CG 4.46Å; L156-Y475 HydrophobicContact CG-CD1 3.92Å; L156-Y475 HydrophobicContact CG-CE1 4.17Å
157	Y	94.8	Very high	93.2	Very high	10 Å²	10	40.5 Å²	40.5	4%	0.039	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-41.7	177.8	-61.9	-54.2	0	0	0	113	V120 K155 V169 E171 A480 L483 L484	V120-Y157 HydrophobicContact CG1-CD2 4.13Å; V120-Y157 HydrophobicContact CG1-CE2 4.31Å; K155-Y157 HydrophobicContact CB-CE1 4.08Å; K155-Y157 HydrophobicContact CD-CE1 4.35Å; Y157-V169 PolarHBondContact N-O 2.69Å; Y157-E171 HydrophobicContact CE2-CB 4.17Å; Y157-A480 WeakPolarHBondContact O-CA 3.33Å; Y157-A480 WeakPolarHBondContact O-CB 3.24Å; Y157-L483 HydrophobicContact CD1-CB 3.77Å; Y157-L483 HydrophobicContact CD1-CD1 4.12Å; Y157-L483 HydrophobicContact CE1-CB 4.15Å; Y157-L484 HydrophobicContact CD1-CD2 4.35Å; Y157-L484 HydrophobicContact CD1-CG 4.41Å; Y157-L484 HydrophobicContact CD2-CD2 3.76Å; Y157-L484 HydrophobicContact CD2-CG 4.34Å; Y157-L484 HydrophobicContact CE1-CD2 4.23Å; Y157-L484 HydrophobicContact CE2-CD2 3.6Å; Y157-L484 HydrophobicContact CG-CD2 4.14Å; Y157-L484 HydrophobicContact CG-CG 4.26Å
158	Q	95.8	Very high	93.5	Very high	15 Å²	15	37.6 Å²	37.6	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	147	-177.5	-152.2	178.9	-31.2	0	0	111.9	Y94 M160 V169 Y475 A480	Y94-Q158 PolarHBondContact OH-OE1 2.88Å; Q158-M160 HydrophobicContact CG-CG 4.27Å; Q158-M160 VanDerWaalsContact NE2-CG 3.26Å; Q158-V169 HydrophobicContact CB-CB 3.84Å; Q158-V169 HydrophobicContact CB-CG2 3.87Å; Q158-V169 PolarHBondContact N-O 2.87Å; Q158-V169 PolarHBondContact O-N 2.79Å; Q158-Y475 CarbonylContact C-O 3.54Å; Q158-Y475 WeakPolarHBondContact CA-O 3.37Å; Q158-Y475 WeakPolarHBondContact CG-O 3.45Å; Q158-A480 HydrophobicContact CB-CB 3.79Å; Q158-A480 HydrophobicContact CG-CB 4.08Å
159	V	95.6	Very high	93.8	Very high	33 Å²	33	37.3 Å²	37.3	20%	0.2	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.5	162.4	-173.9	0	0	0	0	108.1	S142 L156 L166 Y475	S142-V159 WeakPolarHBondContact OG-CG2 3.49Å; L156-V159 HydrophobicContact CD1-CG2 4.33Å; L156-V159 HydrophobicContact CD2-CG2 3.89Å; L156-V159 HydrophobicContact CG-CG2 4.48Å; V159-L166 HydrophobicContact CG1-CD1 3.73Å; V159-Y475 PolarHBondContact N-O 3.02Å
160	M	95.7	Very high	94.2	Very high	31 Å²	31	35.9 Å²	35.9	15%	0.153	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.9	174	-65.1	176.1	-70.8	0	0	108.9	L91 Y94 Q158 C167 V169	L91-M160 HydrophobicContact CD2-CE 3.61Å; L91-M160 HydrophobicContact CG-CE 3.77Å; L91-M160 HydrophobicContact CG-SD 4.27Å; Y94-M160 HydrophobicContact CD2-CE 4.21Å; Y94-M160 HydrophobicContact CE2-CE 4.27Å; Q158-M160 HydrophobicContact CG-CG 4.27Å; Q158-M160 VanDerWaalsContact NE2-CG 3.26Å; M160-C167 HydrophobicContact CB-CB 4.21Å; M160-C167 HydrophobicContact CE-CB 4.1Å; M160-C167 PolarHBondContact N-O 2.82Å; M160-C167 PolarHBondContact O-N 2.9Å; M160-V169 HydrophobicContact CE-CG2 3.57Å
161	E	93.4	Very high	94.6	Very high	101 Å²	101	36.5 Å²	36.5	47%	0.472	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	140.2	-178.1	-171	177.5	169.5	0	0	111.6	K127 Y139 L166	K127-E161 IonicContact NZ-OE1 3.47Å; K127-E161 PolarHBondContact NZ-OE1 2.73Å; Y139-E161 PolarHBondContact OH-OE1 3.38Å; E161-L166 HydrophobicContact CB-CD1 3.97Å; E161-L166 HydrophobicContact CG-CD1 4.09Å
162	T	91.3	Very high	94.8	Very high	34 Å²	34	37 Å²	37	21%	0.209	17%	0.169	C	C	.	.			trans	-126.7	-177.6	168	59.8	0	0	0	0	109.8	M60 I64 K127 R164 L165	M60-T162 HydrophobicContact CE-CG2 3.51Å; I64-T162 HydrophobicContact CD1-CG2 3.46Å; I64-T162 VanDerWaalsContact CD1-CG2 3.46Å; K127-T162 WeakPolarHBondContact CE-O 3.43Å; K127-T162 PolarHBondContact NZ-O 3.15Å; T162-R164 PolarHBondContact O-N 3.23Å; T162-R164 PolarHBondContact OG1-N 3.27Å; T162-L165 PolarHBondContact N-O 3.1Å; T162-L165 PolarHBondContact OG1-N 3.03Å; T162-L165 PolarHBondContact OG1-O 3.2Å; T162-L165 VanDerWaalsContact OG1-O 3.1Å
163	Q	90.5	Very high	94.9	Very high	174 Å²	174	37.6 Å²	37.6	81%	0.813	17%	0.172	S	C	*	.	S	Bend	trans	-61	-34.8	172.9	-65.7	-174.3	-3	0	0	112.4	K127	K127-Q163 WeakPolarHBondContact CE-O 3.33Å
164	R	91.1	Very high	94.7	Very high	167 Å²	167	39.7 Å²	39.7	63%	0.63	19%	0.187	S	C	*	.	S	Bend	trans	-100.6	-47.4	-175.2	-62.3	-172.8	-177.2	-161.4	0.6	114.1	K127 T162	K127-R164 WeakPolarHBondContact CA-O 3.39Å; K127-R164 WeakPolarHBondContact CB-O 3.46Å; K127-R164 WeakPolarHBondContact CG-O 3.46Å; K127-R164 PolarHBondContact N-O 3.48Å; T162-R164 PolarHBondContact O-N 3.23Å; T162-R164 PolarHBondContact OG1-N 3.27Å
165	L	92.8	Very high	94.6	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	147.2	-175.7	-54.1	-164.6	0	0	0	112.7	I64 I124 I125 D126 T162	I64-L165 HydrophobicContact CG2-CB 4.29Å; I64-L165 HydrophobicContact CG2-CD1 3.59Å; I64-L165 HydrophobicContact CG2-CG 3.75Å; I124-L165 HydrophobicContact CG2-CD1 3.64Å; I125-L165 VanDerWaalsContact O-CA 3.3Å; I125-L165 WeakPolarHBondContact O-CA 3.3Å; D126-L165 HydrophobicContact CB-CD2 3.92Å; T162-L165 PolarHBondContact N-O 3.1Å; T162-L165 PolarHBondContact OG1-N 3.03Å; T162-L165 PolarHBondContact OG1-O 3.2Å; T162-L165 VanDerWaalsContact OG1-O 3.1Å
166	L	94.6	Very high	94.5	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.8	159.2	-178.2	71.8	0	0	0	108.3	I125 K127 I138 Y139 V159 E161	I125-L166 PolarHBondContact N-O 3.27Å; I125-L166 PolarHBondContact O-N 3.21Å; K127-L166 HydrophobicContact CD-CB 4.31Å; K127-L166 HydrophobicContact CG-CB 4.31Å; I138-L166 HydrophobicContact CG2-CD2 3.44Å; I138-L166 VanDerWaalsContact CG2-CD2 3.44Å; Y139-L166 HydrophobicContact CD1-CD2 4.46Å; Y139-L166 HydrophobicContact CE1-CD1 4.47Å; Y139-L166 HydrophobicContact CE1-CD2 4.39Å; V159-L166 HydrophobicContact CG1-CD1 3.73Å; E161-L166 HydrophobicContact CB-CD1 3.97Å; E161-L166 HydrophobicContact CG-CD1 4.09Å
167	C	96.3	Very high	94.5	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.027	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.2	-179	-60.1	0	0	0	0	110	L91 I122 K123 M160	L91-C167 HydrophobicContact CD2-CB 4.25Å; I122-C167 HydrophobicContact CG2-CB 4.11Å; K123-C167 WeakPolarHBondContact O-CA 3.39Å; M160-C167 HydrophobicContact CB-CB 4.21Å; M160-C167 HydrophobicContact CE-CB 4.1Å; M160-C167 PolarHBondContact N-O 2.82Å; M160-C167 PolarHBondContact O-N 2.9Å
168	M	96.4	Very high	94.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.6	173.7	-66	-174.8	-75.4	0	0	109.6	I122 K123 I125 E141 L145 L156 M170	I122-M168 CarbonylContact C-O 3.41Å; I122-M168 WeakPolarHBondContact CA-O 3.44Å; K123-M168 HydrophobicContact CD-CE 3.98Å; K123-M168 HydrophobicContact CG-CE 4.29Å; K123-M168 PolarHBondContact N-O 2.82Å; K123-M168 PolarHBondContact O-N 2.76Å; I125-M168 HydrophobicContact CD1-CE 3.69Å; E141-M168 HydrophobicContact CG-CE 4.46Å; L145-M168 HydrophobicContact CD1-SD 4.16Å; L156-M168 HydrophobicContact CD1-CB 3.97Å; L156-M168 HydrophobicContact CD1-CG 4.4Å; M168-M170 HydrophobicContact CB-CG 4.4Å
169	V	97.6	Very high	94.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.4	176.6	-175.2	0	0	0	0	108.9	Y94 V120 I122 Y157 Q158 M160	Y94-V169 HydrophobicContact CD2-CG2 4.35Å; Y94-V169 HydrophobicContact CE1-CG1 3.8Å; Y94-V169 HydrophobicContact CE2-CG1 4.35Å; Y94-V169 HydrophobicContact CE2-CG2 3.85Å; V120-V169 HydrophobicContact CB-CG1 3.79Å; V120-V169 HydrophobicContact CG1-CG1 4.1Å; V120-V169 HydrophobicContact CG2-CG1 3.72Å; I122-V169 HydrophobicContact CD1-CG2 4.21Å; I122-V169 HydrophobicContact CG1-CG1 4.35Å; I122-V169 HydrophobicContact CG1-CG2 4.16Å; I122-V169 HydrophobicContact CG2-CG2 4.31Å; Y157-V169 PolarHBondContact N-O 2.69Å; Q158-V169 HydrophobicContact CB-CB 3.84Å; Q158-V169 HydrophobicContact CB-CG2 3.87Å; Q158-V169 PolarHBondContact N-O 2.87Å; Q158-V169 PolarHBondContact O-N 2.79Å; M160-V169 HydrophobicContact CE-CG2 3.57Å
170	M	96.8	Very high	94.4	Very high	24 Å²	24	46.8 Å²	46.8	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	166.4	-169	-54.9	-180	-58.3	0	0	111.5	V120 A121 K123 L145 V154 K155 L156 M168 Y172	V120-M170 WeakPolarHBondContact CB-O 3.41Å; A121-M170 PolarHBondContact N-O 3.48Å; A121-M170 PolarHBondContact O-N 2.92Å; K123-M170 HydrophobicContact CB-CE 3.68Å; K123-M170 HydrophobicContact CD-CE 4.4Å; L145-M170 HydrophobicContact CD1-SD 4.42Å; V154-M170 HydrophobicContact CG1-CB 3.94Å; K155-M170 CarbonylContact O-C 3.54Å; K155-M170 WeakPolarHBondContact O-CA 3.5Å; L156-M170 HydrophobicContact CD1-CG 4.15Å; M168-M170 HydrophobicContact CB-CG 4.4Å; M170-Y172 PolarHBondContact O-N 2.81Å
171	E	95.5	Very high	94.4	Very high	26 Å²	26	48.6 Å²	48.6	12%	0.121	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	127.8	168.9	-172.5	174.3	-159	0	0	111.6	V154 K155 Y157 V173 K231	V154-E171 HydrophobicContact CG1-CB 4.15Å; K155-E171 HydrophobicContact CB-CB 4.25Å; K155-E171 PolarHBondContact N-OE2 3.04Å; K155-E171 PolarHBondContact O-N 3.29Å; Y157-E171 HydrophobicContact CE2-CB 4.17Å; E171-V173 HydrophobicContact CG-CG2 4.41Å; E171-K231 WeakPolarHBondContact OE1-CE 3.45Å; E171-K231 IonicContact OE1-NZ 2.88Å; E171-K231 PolarHBondContact OE1-NZ 2.95Å; E171-K231 WeakPolarHBondContact OE2-CE 3.47Å; E171-K231 IonicContact OE2-NZ 3.21Å; E171-K231 PolarHBondContact OE2-NZ 3.37Å
172	Y	96.6	Very high	94.6	Very high	65 Å²	65	43.9 Å²	43.9	26%	0.255	22%	0.216	S	C	.	.			trans	-85	121.8	171.6	173.1	-113.3	0	0	0	109.9	I100 L110 F119 M170	I100-Y172 HydrophobicContact CD1-CD2 3.96Å; I100-Y172 HydrophobicContact CD1-CE2 3.95Å; L110-Y172 HydrophobicContact CD1-CD1 3.93Å; L110-Y172 HydrophobicContact CD1-CD2 3.67Å; L110-Y172 HydrophobicContact CD1-CE1 4.04Å; L110-Y172 HydrophobicContact CD1-CE2 3.79Å; L110-Y172 HydrophobicContact CD1-CG 3.74Å; F119-Y172 HydrophobicContact CB-CD1 4.1Å; M170-Y172 PolarHBondContact O-N 2.81Å
173	V	95.7	Very high	94.7	Very high	15 Å²	15	44.1 Å²	44.1	9%	0.091	22%	0.221	C	C	.	.			trans	-108.2	116.7	-178.4	-175.2	0	0	0	0	108.5	V154 E171 L223 L224 D225 K231	V154-V173 HydrophobicContact CG2-CG2 3.97Å; E171-V173 HydrophobicContact CG-CG2 4.41Å; V173-L223 HydrophobicContact CB-CB 3.92Å; V173-L223 HydrophobicContact CB-CD1 3.96Å; V173-L223 HydrophobicContact CG1-CB 3.48Å; V173-L223 VanDerWaalsContact CG1-CB 3.48Å; V173-L223 HydrophobicContact CG1-CD1 4.46Å; V173-L223 HydrophobicContact CG2-CB 4.38Å; V173-L223 HydrophobicContact CG2-CD1 4.15Å; V173-L224 WeakPolarHBondContact CG1-O 3.37Å; V173-D225 HydrophobicContact CG1-CB 4.29Å; V173-K231 HydrophobicContact CG1-CB 4.17Å; V173-K231 HydrophobicContact CG1-CG 4.13Å; V173-K231 HydrophobicContact CG2-CB 3.97Å; V173-K231 HydrophobicContact CG2-CG 3.92Å
174	S	92.7	Very high	94.9	Very high	46 Å²	46	41.2 Å²	41.2	32%	0.322	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-26.1	-154.5	64.3	0	0	0	0	116.6	S226	S174-S226 WeakPolarHBondContact OG-CA 3.24Å; S174-S226 PolarHBondContact OG-N 2.91Å
175	N	93.1	Very high	95.1	Very high	76 Å²	76	38 Å²	38	41%	0.406	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	13.2	-174.6	-65	-22.3	0	0	0	113	L224 D225 M228	N175-L224 WeakPolarHBondContact CA-O 3.47Å; N175-L224 HydrophobicContact CB-CB 4.02Å; N175-L224 VanDerWaalsContact CB-O 3.29Å; N175-L224 WeakPolarHBondContact CB-O 3.49Å; N175-L224 PolarHBondContact N-O 2.73Å; N175-D225 PolarHBondContact ND2-O 3.35Å; N175-M228 HydrophobicContact CB-SD 4.28Å; N175-M228 PolarHBondContact ND2-SD 2.82Å; N175-M228 VanDerWaalsContact ND2-SD 3.42Å
176	G	92.3	Very high	95.1	Very high	31 Å²	31	39.4 Å²	39.4	32%	0.32	23%	0.226	S	C	.	.			trans	72.2	-151.9	172.6	0	0	0	0	0	113.5	L223 L224	G176-L223 CarbonylContact O-C 3.6Å; G176-L223 VanDerWaalsContact O-CA 3.26Å; G176-L223 WeakPolarHBondContact O-CA 3.34Å; G176-L224 PolarHBondContact O-N 2.98Å
177	E	95.4	Very high	95.1	Very high	74 Å²	74	44.2 Å²	44.2	35%	0.346	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-86.1	146.9	-171.5	-59	177.1	-160	0	0	112.3	F179 D180 Y181 E220 L223	E177-F179 PolarHBondContact O-N 2.99Å; E177-D180 HydrophobicContact CB-CB 4.42Å; E177-D180 PolarHBondContact O-N 3.24Å; E177-Y181 PolarHBondContact O-N 3.32Å; E177-Y181 VanDerWaalsContact O-N 3.07Å; E177-E220 WeakPolarHBondContact CG-O 3.39Å; E177-E220 WeakPolarHBondContact OE2-CA 3.48Å; E177-E220 WeakPolarHBondContact OE2-CB 3.44Å; E177-L223 HydrophobicContact CB-CD2 4.36Å; E177-L223 HydrophobicContact CG-CD2 3.69Å
178	L	96.5	Very high	95.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-33.8	175.6	-178.7	69.3	0	0	0	111.1	Y181 I182 F188 A219 I222 L224 I230 M285	L178-Y181 PolarHBondContact O-N 3.4Å; L178-I182 HydrophobicContact CD1-CD1 4.21Å; L178-I182 HydrophobicContact CG-CD1 3.92Å; L178-I182 VanDerWaalsContact O-CG1 3.27Å; L178-I182 WeakPolarHBondContact O-CG1 3.44Å; L178-I182 PolarHBondContact O-N 2.77Å; L178-F188 HydrophobicContact CD1-CE2 3.57Å; L178-F188 HydrophobicContact CD1-CZ 3.95Å; L178-A219 WeakPolarHBondContact CB-O 3.43Å; L178-A219 PolarHBondContact N-O 2.77Å; L178-I222 HydrophobicContact CB-CB 4.09Å; L178-I222 HydrophobicContact CB-CG2 4.02Å; L178-I222 VanDerWaalsContact CB-O 3.25Å; L178-I222 WeakPolarHBondContact CB-O 3.34Å; L178-I222 HydrophobicContact CD2-CB 4.11Å; L178-I222 HydrophobicContact CD2-CD1 4.3Å; L178-I222 HydrophobicContact CD2-CG2 3.8Å; L178-I222 HydrophobicContact CG-CG2 4.48Å; L178-I222 PolarHBondContact N-O 3.41Å; L178-L224 HydrophobicContact CD1-CD1 4.08Å; L178-L224 HydrophobicContact CD1-CD2 4.32Å; L178-L224 HydrophobicContact CD1-CG 4.43Å; L178-I230 HydrophobicContact CD1-CD1 4.41Å; L178-M285 HydrophobicContact CD2-CG 4.05Å; L178-M285 HydrophobicContact CD2-SD 4.09Å
179	F	94.2	Very high	95	Very high	20 Å²	20	47.1 Å²	47.1	9%	0.088	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-56.1	174.5	-172.8	-90.8	0	0	0	111.7	E177 Y181 I182 A183 A219 E220 L574 I577	E177-F179 PolarHBondContact O-N 2.99Å; F179-Y181 VanDerWaalsContact C-N 3.26Å; F179-Y181 PolarHBondContact O-N 2.82Å; F179-I182 PolarHBondContact O-N 3.34Å; F179-I182 VanDerWaalsContact O-N 3.11Å; F179-A183 WeakPolarHBondContact O-CB 3.36Å; F179-A183 PolarHBondContact O-N 3.09Å; F179-A219 HydrophobicContact CB-CB 3.87Å; F179-A219 HydrophobicContact CD2-CB 4.22Å; F179-A219 PolarHBondContact N-O 2.91Å; F179-E220 HydrophobicContact CB-CG 3.98Å; F179-E220 HydrophobicContact CG-CG 4.17Å; F179-L574 HydrophobicContact CE2-CD2 4.26Å; F179-L574 HydrophobicContact CZ-CD2 4.24Å; F179-I577 HydrophobicContact CZ-CB 4.17Å; F179-I577 HydrophobicContact CZ-CD1 4.41Å; F179-I577 HydrophobicContact CZ-CG2 3.95Å
180	D	94.6	Very high	94.8	Very high	89 Å²	89	48.7 Å²	48.7	48%	0.476	27%	0.27	S	S	.	.	H	α-helix	trans	-56.2	-40.3	176.7	-89.1	-10.4	0	0	0	112.4	E177 A183 T184	E177-D180 HydrophobicContact CB-CB 4.42Å; E177-D180 PolarHBondContact O-N 3.24Å; D180-A183 PolarHBondContact O-N 3.2Å; D180-T184 VanDerWaalsContact O-CB 3.29Å; D180-T184 WeakPolarHBondContact O-CB 3.37Å; D180-T184 PolarHBondContact O-N 3.24Å; D180-T184 PolarHBondContact O-OG1 2.86Å
181	Y	95.9	Very high	94.6	Very high	70 Å²	70	50.7 Å²	50.7	28%	0.275	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-47.1	176.3	-176.3	-86.9	0	0	0	111.8	E177 L178 F179 T184 N185 F188 L224 M228	E177-Y181 PolarHBondContact O-N 3.32Å; E177-Y181 VanDerWaalsContact O-N 3.07Å; L178-Y181 PolarHBondContact O-N 3.4Å; F179-Y181 VanDerWaalsContact C-N 3.26Å; F179-Y181 PolarHBondContact O-N 2.82Å; Y181-T184 PolarHBondContact O-N 3.02Å; Y181-N185 HydrophobicContact CD1-CB 4.46Å; Y181-N185 WeakPolarHBondContact CD2-ND2 3.23Å; Y181-N185 HydrophobicContact CE1-CB 4.03Å; Y181-N185 WeakPolarHBondContact CE2-ND2 3.16Å; Y181-N185 WeakPolarHBondContact O-CB 3.18Å; Y181-N185 PolarHBondContact O-N 3.47Å; Y181-N185 PolarHBondContact O-ND2 2.96Å; Y181-F188 HydrophobicContact CD1-CE1 4.04Å; Y181-F188 AromaticContact CD1-CE2 3.99Å; Y181-F188 HydrophobicContact CD1-CE2 3.99Å; Y181-F188 AromaticContact CD1-CZ 3.37Å; Y181-F188 HydrophobicContact CD1-CZ 3.37Å; Y181-F188 HydrophobicContact CE1-CD1 4.44Å; Y181-F188 AromaticContact CE1-CE1 3.45Å; Y181-F188 HydrophobicContact CE1-CE1 3.45Å; Y181-F188 VanDerWaalsContact CE1-CE1 3.45Å; Y181-F188 HydrophobicContact CE1-CE2 4.19Å; Y181-F188 AromaticContact CE1-CZ 3.3Å; Y181-F188 HydrophobicContact CE1-CZ 3.3Å; Y181-F188 HydrophobicContact CG-CZ 4.49Å; Y181-L224 HydrophobicContact CD1-CD1 4.4Å; Y181-L224 HydrophobicContact CD2-CD1 4.13Å; Y181-L224 HydrophobicContact CG-CD1 3.78Å; Y181-M228 HydrophobicContact CD2-CE 3.66Å; Y181-M228 HydrophobicContact CE1-CE 4.26Å; Y181-M228 HydrophobicContact CE2-CE 3.28Å; Y181-M228 HydrophobicContact CE2-SD 4.42Å; Y181-M228 HydrophobicContact CG-CE 4.29Å
182	I	96.6	Very high	94.5	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-69.1	-38	179.3	-66.3	165.4	0	0	0	110.9	L178 F179 T184 G186 F188 V284 M285 L574	L178-I182 HydrophobicContact CD1-CD1 4.21Å; L178-I182 HydrophobicContact CG-CD1 3.92Å; L178-I182 VanDerWaalsContact O-CG1 3.27Å; L178-I182 WeakPolarHBondContact O-CG1 3.44Å; L178-I182 PolarHBondContact O-N 2.77Å; F179-I182 PolarHBondContact O-N 3.34Å; F179-I182 VanDerWaalsContact O-N 3.11Å; I182-T184 VanDerWaalsContact C-N 3.28Å; I182-T184 PolarHBondContact O-N 3.36Å; I182-G186 CarbonylContact O-C 3.46Å; I182-G186 WeakPolarHBondContact O-CA 3.4Å; I182-G186 PolarHBondContact O-N 2.87Å; I182-F188 HydrophobicContact CD1-CD2 4.22Å; I182-F188 HydrophobicContact CD1-CE2 3.97Å; I182-F188 HydrophobicContact CG1-CD2 4.04Å; I182-F188 HydrophobicContact CG1-CE2 3.65Å; I182-V284 HydrophobicContact CD1-CG1 4.04Å; I182-M285 HydrophobicContact CD1-CG 4.1Å; I182-L574 HydrophobicContact CB-CD1 4.49Å; I182-L574 HydrophobicContact CG2-CD1 3.78Å
183	A	93.7	Very high	94.4	Very high	38 Å²	38	50.1 Å²	50.1	31%	0.314	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-35.2	175.3	0	0	0	0	0	112.4	F179 D180 L574	F179-A183 WeakPolarHBondContact O-CB 3.36Å; F179-A183 PolarHBondContact O-N 3.09Å; D180-A183 PolarHBondContact O-N 3.2Å; A183-L574 HydrophobicContact CB-CB 3.8Å; A183-L574 HydrophobicContact CB-CD1 4.15Å
184	T	94.8	Very high	94.3	Very high	113 Å²	113	50.2 Å²	50.2	69%	0.693	29%	0.285	S	S	*	.	H	α-helix	trans	-84.4	-41.7	-178.9	-56.4	0	0	0	0	113.3	D180 Y181 I182	D180-T184 VanDerWaalsContact O-CB 3.29Å; D180-T184 WeakPolarHBondContact O-CB 3.37Å; D180-T184 PolarHBondContact O-N 3.24Å; D180-T184 PolarHBondContact O-OG1 2.86Å; Y181-T184 PolarHBondContact O-N 3.02Å; I182-T184 VanDerWaalsContact C-N 3.28Å; I182-T184 PolarHBondContact O-N 3.36Å
185	N	94.4	Very high	94.3	Very high	100 Å²	100	50.8 Å²	50.8	54%	0.535	28%	0.283	S	S	.	.	H	α-helix	trans	-105.4	-9.8	-170.5	-59	-87.7	0	0	0	113.4	Y181	Y181-N185 HydrophobicContact CD1-CB 4.46Å; Y181-N185 WeakPolarHBondContact CD2-ND2 3.23Å; Y181-N185 HydrophobicContact CE1-CB 4.03Å; Y181-N185 WeakPolarHBondContact CE2-ND2 3.16Å; Y181-N185 WeakPolarHBondContact O-CB 3.18Å; Y181-N185 PolarHBondContact O-N 3.47Å; Y181-N185 PolarHBondContact O-ND2 2.96Å
186	G	94	Very high	94.4	Very high	34 Å²	34	48.6 Å²	48.6	35%	0.351	27%	0.271	S	S	.	.			trans	83.9	-176.6	-170.5	0	0	0	0	0	113.3	I182	I182-G186 CarbonylContact O-C 3.46Å; I182-G186 WeakPolarHBondContact O-CA 3.4Å; I182-G186 PolarHBondContact O-N 2.87Å
187	R	94.3	Very high	94.6	Very high	101 Å²	101	47.1 Å²	47.1	38%	0.381	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-62.3	148.4	178.6	74.4	-161.4	-170.3	78.4	2.1	112.3	V286 W314	R187-V286 VanDerWaalsContact CD-O 3.3Å; R187-V286 WeakPolarHBondContact CD-O 3.18Å; R187-V286 PolarHBondContact NH1-O 2.65Å; R187-W314 VanDerWaalsContact NH2-CD1 3.29Å
188	F	95.1	Very high	94.6	Very high	14 Å²	14	44.2 Å²	44.2	6%	0.061	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-68.9	156.4	170.9	-72.4	-78.2	0	0	0	111.7	L178 Y181 I182 D192 A193 K196 M285	L178-F188 HydrophobicContact CD1-CE2 3.57Å; L178-F188 HydrophobicContact CD1-CZ 3.95Å; Y181-F188 HydrophobicContact CD1-CE1 4.04Å; Y181-F188 AromaticContact CD1-CE2 3.99Å; Y181-F188 HydrophobicContact CD1-CE2 3.99Å; Y181-F188 AromaticContact CD1-CZ 3.37Å; Y181-F188 HydrophobicContact CD1-CZ 3.37Å; Y181-F188 HydrophobicContact CE1-CD1 4.44Å; Y181-F188 AromaticContact CE1-CE1 3.45Å; Y181-F188 HydrophobicContact CE1-CE1 3.45Å; Y181-F188 VanDerWaalsContact CE1-CE1 3.45Å; Y181-F188 HydrophobicContact CE1-CE2 4.19Å; Y181-F188 AromaticContact CE1-CZ 3.3Å; Y181-F188 HydrophobicContact CE1-CZ 3.3Å; Y181-F188 HydrophobicContact CG-CZ 4.49Å; I182-F188 HydrophobicContact CD1-CD2 4.22Å; I182-F188 HydrophobicContact CD1-CE2 3.97Å; I182-F188 HydrophobicContact CG1-CD2 4.04Å; I182-F188 HydrophobicContact CG1-CE2 3.65Å; F188-D192 HydrophobicContact CB-CB 4.34Å; F188-D192 HydrophobicContact CD1-CB 3.92Å; F188-A193 HydrophobicContact CB-CB 3.86Å; F188-K196 HydrophobicContact CD1-CD 4.4Å; F188-K196 HydrophobicContact CE1-CD 3.82Å; F188-K196 HydrophobicContact CE2-CD 4.33Å; F188-K196 HydrophobicContact CZ-CD 3.77Å; F188-M285 HydrophobicContact CD2-CB 4.3Å; F188-M285 PolarHBondContact N-O 2.71Å
189	S	94.7	Very high	94.5	Very high	52 Å²	52	44.7 Å²	44.7	36%	0.364	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-64.2	154.2	159.9	86	0	0	0	0	109.4	V191 D192 A193	S189-V191 PolarHBondContact O-N 3.47Å; S189-V191 VanDerWaalsContact O-N 3.16Å; S189-V191 PolarHBondContact OG-N 2.93Å; S189-D192 WeakPolarHBondContact CB-OD2 3.47Å; S189-D192 PolarHBondContact O-N 3.34Å; S189-D192 VanDerWaalsContact OG-CG 3.28Å; S189-D192 PolarHBondContact OG-N 3.08Å; S189-D192 VanDerWaalsContact OG-N 3.14Å; S189-D192 PolarHBondContact OG-OD2 3.19Å; S189-A193 VanDerWaalsContact O-CB 3.23Å; S189-A193 WeakPolarHBondContact O-CB 3.41Å; S189-A193 PolarHBondContact O-N 3.4Å
190	E	94.7	Very high	94.6	Very high	32 Å²	32	43.8 Å²	43.8	15%	0.15	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-26.2	175.6	-77.7	-171.5	-144.6	0	0	112.9	R194 V286 S316 W345	E190-R194 WeakPolarHBondContact O-CB 3.32Å; E190-R194 PolarHBondContact O-N 3.3Å; E190-R194 VanDerWaalsContact O-N 3.13Å; E190-V286 HydrophobicContact CG-CG1 4.45Å; E190-S316 WeakPolarHBondContact OE1-CB 3.41Å; E190-S316 PolarHBondContact OE1-N 3.13Å; E190-S316 PolarHBondContact OE1-OG 3.39Å; E190-S316 WeakPolarHBondContact OE2-CB 3.08Å; E190-S316 PolarHBondContact OE2-OG 2.92Å; E190-W345 HydrophobicContact CB-CZ2 4.1Å; E190-W345 HydrophobicContact CG-CZ2 4.32Å; E190-W345 WeakPolarHBondContact O-CZ2 3.38Å; E190-W345 PolarHBondContact OE2-NE1 2.79Å
191	V	91.7	Very high	94.7	Very high	67 Å²	67	39.6 Å²	39.6	41%	0.406	22%	0.218	S	C	.	.	H	α-helix	trans	-71	-47.7	177.8	-179.7	0	0	0	0	110.4	S189 R194 I195	S189-V191 PolarHBondContact O-N 3.47Å; S189-V191 VanDerWaalsContact O-N 3.16Å; S189-V191 PolarHBondContact OG-N 2.93Å; V191-R194 PolarHBondContact O-N 3.14Å; V191-I195 WeakPolarHBondContact O-CG1 3.31Å; V191-I195 PolarHBondContact O-N 2.64Å
192	D	93	Very high	94.6	Very high	78 Å²	78	36.3 Å²	36.3	42%	0.417	21%	0.206	S	C	.	.	H	α-helix	trans	-69.6	-43.1	179.4	-56.6	-57.3	0	0	0	111.4	F188 S189 R194 I195 K196	F188-D192 HydrophobicContact CB-CB 4.34Å; F188-D192 HydrophobicContact CD1-CB 3.92Å; S189-D192 WeakPolarHBondContact CB-OD2 3.47Å; S189-D192 PolarHBondContact O-N 3.34Å; S189-D192 VanDerWaalsContact OG-CG 3.28Å; S189-D192 PolarHBondContact OG-N 3.08Å; S189-D192 VanDerWaalsContact OG-N 3.14Å; S189-D192 PolarHBondContact OG-OD2 3.19Å; D192-R194 VanDerWaalsContact C-N 3.26Å; D192-R194 PolarHBondContact O-N 3.47Å; D192-I195 PolarHBondContact O-N 3.39Å; D192-K196 WeakPolarHBondContact O-CG 3.5Å; D192-K196 PolarHBondContact O-N 2.84Å; D192-K196 VanDerWaalsContact O-N 3.08Å
193	A	95.7	Very high	94.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57	-42.4	177.2	0	0	0	0	0	111	F188 S189 K196 F197 M285 V286 W345	F188-A193 HydrophobicContact CB-CB 3.86Å; S189-A193 VanDerWaalsContact O-CB 3.23Å; S189-A193 WeakPolarHBondContact O-CB 3.41Å; S189-A193 PolarHBondContact O-N 3.4Å; A193-K196 PolarHBondContact O-N 2.97Å; A193-F197 WeakPolarHBondContact O-CB 3.26Å; A193-F197 PolarHBondContact O-N 3.32Å; A193-M285 HydrophobicContact CB-CB 4.32Å; A193-M285 HydrophobicContact CB-CE 4.43Å; A193-M285 WeakPolarHBondContact O-CE 3.14Å; A193-V286 HydrophobicContact CB-CG1 3.57Å; A193-W345 HydrophobicContact CB-CH2 4.38Å
194	R	94	Very high	94.8	Very high	17 Å²	17	34.4 Å²	34.4	6%	0.064	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-44	179.9	-171.2	-173.7	-54.1	147.4	-4.1	113	E190 V191 D192 F197 L198 W345 F346 T350 I351	E190-R194 WeakPolarHBondContact O-CB 3.32Å; E190-R194 PolarHBondContact O-N 3.3Å; E190-R194 VanDerWaalsContact O-N 3.13Å; V191-R194 PolarHBondContact O-N 3.14Å; D192-R194 VanDerWaalsContact C-N 3.26Å; D192-R194 PolarHBondContact O-N 3.47Å; R194-F197 PolarHBondContact O-N 2.97Å; R194-L198 HydrophobicContact CG-CD1 4.46Å; R194-L198 WeakPolarHBondContact O-CB 3.47Å; R194-L198 WeakPolarHBondContact O-CD1 3.48Å; R194-L198 VanDerWaalsContact O-CG 3.25Å; R194-L198 WeakPolarHBondContact O-CG 3.27Å; R194-L198 PolarHBondContact O-N 2.91Å; R194-W345 VanDerWaalsContact CA-CH2 3.42Å; R194-W345 HydrophobicContact CB-CE3 4.32Å; R194-W345 HydrophobicContact CB-CH2 3.49Å; R194-W345 VanDerWaalsContact CB-CH2 3.49Å; R194-W345 HydrophobicContact CB-CZ2 3.8Å; R194-W345 HydrophobicContact CB-CZ3 3.78Å; R194-W345 WeakPolarHBondContact CD-O 3.06Å; R194-W345 HydrophobicContact CG-CD2 4.28Å; R194-W345 HydrophobicContact CG-CE3 3.9Å; R194-W345 HydrophobicContact CG-CH2 3.99Å; R194-W345 HydrophobicContact CG-CZ2 4.34Å; R194-W345 HydrophobicContact CG-CZ3 3.76Å; R194-W345 PolarHBondContact NE-O 2.8Å; R194-F346 HydrophobicContact CG-CD1 3.66Å; R194-F346 HydrophobicContact CG-CE1 4.06Å; R194-T350 PolarHBondContact NH1-OG1 2.73Å; R194-I351 HydrophobicContact CG-CD1 3.92Å
195	I	91.6	Very high	94.8	Very high	58 Å²	58	31.1 Å²	31.1	30%	0.297	17%	0.168	S	C	.	.	H	α-helix	trans	-62.4	-45.7	177	-65.3	167.8	0	0	0	110	V191 D192 D199	V191-I195 WeakPolarHBondContact O-CG1 3.31Å; V191-I195 PolarHBondContact O-N 2.64Å; D192-I195 PolarHBondContact O-N 3.39Å; I195-D199 PolarHBondContact O-N 3.49Å
196	K	95.1	Very high	94.8	Very high	31 Å²	31	27 Å²	27	14%	0.135	15%	0.145	C	C	.	.	H	α-helix	trans	-67.5	-41.6	178.2	-67.6	-173.1	-167	-49.8	0	112.3	F188 D192 A193 L198 D199 V200 L224 M228 I230 M285	F188-K196 HydrophobicContact CD1-CD 4.4Å; F188-K196 HydrophobicContact CE1-CD 3.82Å; F188-K196 HydrophobicContact CE2-CD 4.33Å; F188-K196 HydrophobicContact CZ-CD 3.77Å; D192-K196 WeakPolarHBondContact O-CG 3.5Å; D192-K196 PolarHBondContact O-N 2.84Å; D192-K196 VanDerWaalsContact O-N 3.08Å; A193-K196 PolarHBondContact O-N 2.97Å; K196-L198 VanDerWaalsContact C-N 3.32Å; K196-L198 PolarHBondContact O-N 3.09Å; K196-D199 WeakPolarHBondContact O-CB 3.38Å; K196-D199 PolarHBondContact O-N 2.98Å; K196-D199 VanDerWaalsContact O-N 3.11Å; K196-V200 PolarHBondContact O-N 3.39Å; K196-V200 VanDerWaalsContact O-N 3.08Å; K196-L224 HydrophobicContact CD-CD2 4.48Å; K196-M228 PolarHBondContact NZ-O 3.34Å; K196-I230 HydrophobicContact CB-CD1 4.07Å; K196-I230 HydrophobicContact CB-CG1 3.84Å; K196-I230 HydrophobicContact CD-CD1 4.4Å; K196-I230 HydrophobicContact CG-CD1 4.43Å; K196-I230 HydrophobicContact CG-CG1 4.22Å; K196-M285 HydrophobicContact CB-CE 3.53Å
197	F	97	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71	-27.2	-178.8	-165.1	-98.5	0	0	0	112.6	A193 R194 D199 V200 L201 L278 I281 L282 M285 M326 F346	A193-F197 WeakPolarHBondContact O-CB 3.26Å; A193-F197 PolarHBondContact O-N 3.32Å; R194-F197 PolarHBondContact O-N 2.97Å; F197-D199 VanDerWaalsContact C-N 3.31Å; F197-V200 HydrophobicContact CD2-CB 4.5Å; F197-V200 PolarHBondContact O-N 3.25Å; F197-L201 HydrophobicContact CD1-CD1 3.63Å; F197-L201 HydrophobicContact CD1-CG 3.83Å; F197-L201 HydrophobicContact CE1-CD1 3.66Å; F197-L201 HydrophobicContact CE1-CD2 3.93Å; F197-L201 HydrophobicContact CE1-CG 3.66Å; F197-L201 HydrophobicContact CZ-CD2 4.43Å; F197-L201 HydrophobicContact CZ-CG 4.41Å; F197-L201 WeakPolarHBondContact O-CB 3.34Å; F197-L201 VanDerWaalsContact O-CG 3.28Å; F197-L201 WeakPolarHBondContact O-CG 3.42Å; F197-L201 PolarHBondContact O-N 2.89Å; F197-L278 HydrophobicContact CE2-CD2 4.15Å; F197-L278 VanDerWaalsContact CE2-O 3.3Å; F197-L278 WeakPolarHBondContact CE2-O 3.14Å; F197-L278 HydrophobicContact CZ-CB 4.03Å; F197-L278 HydrophobicContact CZ-CD2 4.17Å; F197-L278 WeakPolarHBondContact CZ-O 3.31Å; F197-I281 HydrophobicContact CD2-CG2 4.38Å; F197-I281 HydrophobicContact CE2-CB 4.46Å; F197-I281 HydrophobicContact CE2-CG2 4.18Å; F197-L282 HydrophobicContact CB-CD1 4.28Å; F197-L282 HydrophobicContact CD1-CD1 4.28Å; F197-L282 HydrophobicContact CD1-CD2 4.44Å; F197-L282 HydrophobicContact CD2-CB 3.98Å; F197-L282 HydrophobicContact CD2-CD1 4.1Å; F197-L282 HydrophobicContact CE1-CB 4.33Å; F197-L282 HydrophobicContact CE1-CD2 4.19Å; F197-L282 HydrophobicContact CE2-CB 3.6Å; F197-L282 HydrophobicContact CG-CD1 3.96Å; F197-L282 HydrophobicContact CZ-CB 3.78Å; F197-L282 HydrophobicContact CZ-CD2 4.4Å; F197-M285 HydrophobicContact CB-CE 4.25Å; F197-M285 HydrophobicContact CB-SD 4.36Å; F197-M285 HydrophobicContact CD2-SD 3.87Å; F197-M326 HydrophobicContact CE1-CE 3.87Å; F197-M326 HydrophobicContact CE1-SD 4.35Å; F197-M326 HydrophobicContact CZ-CE 3.63Å; F197-M326 HydrophobicContact CZ-SD 4.05Å; F197-F346 HydrophobicContact CD1-CE1 4.11Å; F197-F346 AromaticContact CD1-CZ 3.76Å; F197-F346 HydrophobicContact CD1-CZ 3.76Å; F197-F346 HydrophobicContact CE1-CZ 4.21Å
198	L	94.4	Very high	94.9	Very high	13 Å²	13	21.5 Å²	21.5	7%	0.068	12%	0.115	C	C	.	.	H	α-helix	trans	-63.2	-36.1	168.4	-76.7	165.5	0	0	0	112.5	R194 K196 S202 F346 I351 Y356	R194-L198 HydrophobicContact CG-CD1 4.46Å; R194-L198 WeakPolarHBondContact O-CB 3.47Å; R194-L198 WeakPolarHBondContact O-CD1 3.48Å; R194-L198 VanDerWaalsContact O-CG 3.25Å; R194-L198 WeakPolarHBondContact O-CG 3.27Å; R194-L198 PolarHBondContact O-N 2.91Å; K196-L198 VanDerWaalsContact C-N 3.32Å; K196-L198 PolarHBondContact O-N 3.09Å; L198-S202 WeakPolarHBondContact O-CB 3.38Å; L198-S202 PolarHBondContact O-N 3.36Å; L198-F346 HydrophobicContact CD1-CD1 4.03Å; L198-F346 HydrophobicContact CD2-CB 4.48Å; L198-F346 HydrophobicContact CD2-CD1 3.44Å; L198-F346 VanDerWaalsContact CD2-CD1 3.44Å; L198-F346 HydrophobicContact CD2-CE1 3.85Å; L198-F346 HydrophobicContact CD2-CG 4.12Å; L198-F346 HydrophobicContact CG-CD1 3.6Å; L198-F346 HydrophobicContact CG-CE1 3.85Å; L198-I351 HydrophobicContact CD1-CD1 4.18Å; L198-Y356 HydrophobicContact CB-CD2 3.96Å; L198-Y356 HydrophobicContact CB-CE2 4.46Å; L198-Y356 HydrophobicContact CD2-CD1 4.33Å; L198-Y356 HydrophobicContact CD2-CD2 3.59Å; L198-Y356 HydrophobicContact CD2-CE2 3.89Å; L198-Y356 HydrophobicContact CD2-CG 3.8Å; L198-Y356 HydrophobicContact CG-CD2 4.28Å
199	D	94.1	Very high	94.8	Very high	10 Å²	10	25 Å²	25	5%	0.053	14%	0.141	C	C	.	.	H	α-helix	trans	-69.3	-42.1	173.5	-79.2	17.6	0	0	0	111.6	N152 I195 K196 F197 S202 A203 I230 K359	N152-D199 HydrophobicContact CB-CB 4.43Å; N152-D199 WeakPolarHBondContact ND2-CB 3.46Å; N152-D199 PolarHBondContact ND2-OD2 3.23Å; I195-D199 PolarHBondContact O-N 3.49Å; K196-D199 WeakPolarHBondContact O-CB 3.38Å; K196-D199 PolarHBondContact O-N 2.98Å; K196-D199 VanDerWaalsContact O-N 3.11Å; F197-D199 VanDerWaalsContact C-N 3.31Å; D199-S202 PolarHBondContact O-N 2.69Å; D199-A203 PolarHBondContact O-N 3.3Å; D199-I230 HydrophobicContact CB-CB 3.79Å; D199-I230 HydrophobicContact CB-CG1 4.2Å; D199-I230 HydrophobicContact CB-CG2 4.23Å; D199-K359 IonicContact OD1-NZ 2.68Å; D199-K359 PolarHBondContact OD1-NZ 3.36Å; D199-K359 IonicContact OD2-NZ 3.77Å; D199-K359 PolarHBondContact OD2-NZ 3.43Å
200	V	97.3	Very high	94.7	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-48.2	172.4	-177.5	0	0	0	0	110.4	K196 F197 S202 A203 V204 I222 I230 L278	K196-V200 PolarHBondContact O-N 3.39Å; K196-V200 VanDerWaalsContact O-N 3.08Å; F197-V200 HydrophobicContact CD2-CB 4.5Å; F197-V200 PolarHBondContact O-N 3.25Å; V200-S202 VanDerWaalsContact C-N 3.3Å; V200-S202 PolarHBondContact O-N 3.28Å; V200-A203 PolarHBondContact O-N 2.82Å; V200-V204 PolarHBondContact O-N 3.28Å; V200-I222 HydrophobicContact CG1-CD1 4.01Å; V200-I222 HydrophobicContact CG2-CD1 4.04Å; V200-I222 HydrophobicContact CG2-CG2 4.47Å; V200-I230 HydrophobicContact CG2-CD1 4.36Å; V200-I230 HydrophobicContact CG2-CG1 4.33Å; V200-I230 HydrophobicContact CG2-CG2 3.67Å; V200-L278 HydrophobicContact CG1-CD2 3.5Å
201	L	96.8	Very high	94.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.9	-38.9	176.3	-76.1	169.8	0	0	0	111.9	F197 V204 D205 L278 I340 F346	F197-L201 HydrophobicContact CD1-CD1 3.63Å; F197-L201 HydrophobicContact CD1-CG 3.83Å; F197-L201 HydrophobicContact CE1-CD1 3.66Å; F197-L201 HydrophobicContact CE1-CD2 3.93Å; F197-L201 HydrophobicContact CE1-CG 3.66Å; F197-L201 HydrophobicContact CZ-CD2 4.43Å; F197-L201 HydrophobicContact CZ-CG 4.41Å; F197-L201 WeakPolarHBondContact O-CB 3.34Å; F197-L201 VanDerWaalsContact O-CG 3.28Å; F197-L201 WeakPolarHBondContact O-CG 3.42Å; F197-L201 PolarHBondContact O-N 2.89Å; L201-V204 PolarHBondContact O-N 3.46Å; L201-D205 WeakPolarHBondContact O-CB 3.29Å; L201-D205 PolarHBondContact O-N 3.01Å; L201-L278 HydrophobicContact CD2-CD1 4.04Å; L201-I340 HydrophobicContact CD1-CB 4.47Å; L201-I340 HydrophobicContact CD1-CG2 3.71Å; L201-I340 HydrophobicContact CD2-CB 4.27Å; L201-I340 HydrophobicContact CD2-CD1 4.2Å; L201-I340 HydrophobicContact CD2-CG2 3.95Å; L201-I340 HydrophobicContact CG-CG2 4.5Å; L201-F346 HydrophobicContact CD1-CE1 4.13Å; L201-F346 HydrophobicContact CD1-CE2 4.38Å; L201-F346 HydrophobicContact CD1-CZ 3.77Å
202	S	94.4	Very high	94.9	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-66.6	-38.7	177.4	-168.6	0	0	0	0	112.3	H150 L198 D199 V200 Y206 N363	H150-S202 VanDerWaalsContact CE1-C 3.46Å; H150-S202 WeakPolarHBondContact CE1-CB 3.25Å; H150-S202 PolarHBondContact CE1-OG 2.92Å; H150-S202 VanDerWaalsContact CE1-OG 3.23Å; H150-S202 WeakPolarHBondContact NE2-CB 3.48Å; H150-S202 PolarHBondContact NE2-O 2.98Å; H150-S202 PolarHBondContact NE2-OG 2.68Å; L198-S202 WeakPolarHBondContact O-CB 3.38Å; L198-S202 PolarHBondContact O-N 3.36Å; D199-S202 PolarHBondContact O-N 2.69Å; V200-S202 VanDerWaalsContact C-N 3.3Å; V200-S202 PolarHBondContact O-N 3.28Å; S202-Y206 WeakPolarHBondContact O-CB 3.35Å; S202-Y206 PolarHBondContact O-N 3.27Å; S202-Y206 VanDerWaalsContact O-N 3.13Å; S202-N363 PolarHBondContact OG-ND2 3.4Å
203	A	95.7	Very high	95	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.7	-46.7	175	0	0	0	0	0	111.7	H150 N152 I153 D199 V200 Y206 T207 L232	H150-A203 PolarHBondContact CE1-N 2.78Å; H150-A203 VanDerWaalsContact CE1-N 3.29Å; N152-A203 HydrophobicContact CB-CB 4.16Å; I153-A203 HydrophobicContact CD1-CB 4.35Å; I153-A203 HydrophobicContact CG1-CB 3.83Å; D199-A203 PolarHBondContact O-N 3.3Å; V200-A203 PolarHBondContact O-N 2.82Å; A203-Y206 PolarHBondContact O-N 3.04Å; A203-T207 PolarHBondContact O-N 2.9Å; A203-L232 HydrophobicContact CB-CB 4.11Å; A203-L232 HydrophobicContact CB-CD2 3.95Å
204	V	97.2	Very high	95.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-71.7	-39.1	-178.2	178.3	0	0	0	0	112.4	V200 L201 Y206 T207 H208 L217 L232 L278 T337	V200-V204 PolarHBondContact O-N 3.28Å; L201-V204 PolarHBondContact O-N 3.46Å; V204-Y206 VanDerWaalsContact C-N 3.28Å; V204-Y206 PolarHBondContact O-N 3.36Å; V204-T207 WeakPolarHBondContact CA-OG1 3.43Å; V204-T207 PolarHBondContact O-N 2.86Å; V204-T207 PolarHBondContact O-OG1 3.17Å; V204-H208 VanDerWaalsContact CG1-CE1 3.41Å; V204-H208 WeakPolarHBondContact CG1-CE1 3.18Å; V204-H208 WeakPolarHBondContact O-CB 3.25Å; V204-H208 VanDerWaalsContact O-CG 3.3Å; V204-H208 PolarHBondContact O-N 2.84Å; V204-L217 HydrophobicContact CG1-CD1 4.24Å; V204-L217 HydrophobicContact CG2-CD1 3.88Å; V204-L217 HydrophobicContact CG2-CD2 4.01Å; V204-L232 HydrophobicContact CG2-CD2 4.05Å; V204-L278 HydrophobicContact CB-CD1 4.28Å; V204-L278 HydrophobicContact CG1-CD1 4.01Å; V204-L278 HydrophobicContact CG2-CD1 4.45Å; V204-L278 HydrophobicContact CG2-CD2 4.22Å; V204-T337 HydrophobicContact CG1-CG2 4.31Å
205	D	95.8	Very high	95.1	Very high	43 Å²	43	17 Å²	17	23%	0.23	10%	0.098	C	C	.	.	H	α-helix	trans	-58.6	-42.1	172.8	-169.6	62.6	0	0	0	111	L201 S209 T337	L201-D205 WeakPolarHBondContact O-CB 3.29Å; L201-D205 PolarHBondContact O-N 3.01Å; D205-S209 WeakPolarHBondContact O-CB 3.37Å; D205-S209 PolarHBondContact O-N 3.24Å; D205-T337 HydrophobicContact CB-CG2 4.13Å; D205-T337 VanDerWaalsContact OD1-CB 3.26Å; D205-T337 WeakPolarHBondContact OD1-CB 3.38Å; D205-T337 PolarHBondContact OD1-OG1 3.19Å
206	Y	94.9	Very high	95.3	Very high	14 Å²	14	14.5 Å²	14.5	6%	0.055	9%	0.086	C	C	.	.	H	α-helix	trans	-63.8	-48.6	174.4	173.4	-102.8	0	0	0	112.2	E147 L148 H149 H150 I153 S202 A203 V204 H208 S209 C210	E147-Y206 PolarHBondContact O-OH 3.12Å; L148-Y206 HydrophobicContact CB-CE1 4.33Å; L148-Y206 HydrophobicContact CD2-CD1 4.13Å; L148-Y206 HydrophobicContact CD2-CE1 3.67Å; H149-Y206 PolarHBondContact N-OH 2.89Å; H150-Y206 HydrophobicContact CB-CD1 3.58Å; H150-Y206 HydrophobicContact CB-CE1 3.79Å; H150-Y206 HydrophobicContact CB-CG 4.11Å; H150-Y206 AromaticContact CD2-CG 3.71Å; I153-Y206 HydrophobicContact CD1-CD1 3.75Å; I153-Y206 HydrophobicContact CD1-CE1 4.22Å; S202-Y206 WeakPolarHBondContact O-CB 3.35Å; S202-Y206 PolarHBondContact O-N 3.27Å; S202-Y206 VanDerWaalsContact O-N 3.13Å; A203-Y206 PolarHBondContact O-N 3.04Å; V204-Y206 VanDerWaalsContact C-N 3.28Å; V204-Y206 PolarHBondContact O-N 3.36Å; Y206-H208 VanDerWaalsContact C-N 3.32Å; Y206-H208 PolarHBondContact O-N 2.97Å; Y206-S209 WeakPolarHBondContact O-CB 3.41Å; Y206-S209 PolarHBondContact O-N 2.88Å; Y206-S209 VanDerWaalsContact O-N 3.08Å; Y206-S209 PolarHBondContact O-OG 2.84Å; Y206-C210 PolarHBondContact O-N 2.77Å; Y206-C210 PolarHBondContact O-SG 3.25Å
207	T	95.5	Very high	95.4	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.7	-44.2	177.5	52.8	0	0	0	0	111.7	L148 I153 A203 V204 S209 C210 G211 I212 F235	L148-T207 HydrophobicContact CD1-CG2 4Å; L148-T207 HydrophobicContact CD2-CG2 3.77Å; I153-T207 HydrophobicContact CD1-CG2 3.7Å; A203-T207 PolarHBondContact O-N 2.9Å; V204-T207 WeakPolarHBondContact CA-OG1 3.43Å; V204-T207 PolarHBondContact O-N 2.86Å; V204-T207 PolarHBondContact O-OG1 3.17Å; T207-S209 VanDerWaalsContact C-N 3.31Å; T207-S209 PolarHBondContact O-N 2.83Å; T207-C210 PolarHBondContact O-N 2.89Å; T207-C210 VanDerWaalsContact O-N 3.15Å; T207-G211 PolarHBondContact O-N 3.39Å; T207-I212 CarbonylContact C-O 3.53Å; T207-I212 PolarHBondContact O-N 2.8Å; T207-F235 HydrophobicContact CG2-CE1 3.68Å; T207-F235 HydrophobicContact CG2-CZ 3.79Å
208	H	95.1	Very high	95.3	Very high	20 Å²	20	14.5 Å²	14.5	9%	0.093	9%	0.086	C	C	.	.	H	α-helix	trans	-64.3	-36.2	177	-67.6	176	0	0	0	111.4	V204 Y206 C210 G211 I212 F241 D274	V204-H208 VanDerWaalsContact CG1-CE1 3.41Å; V204-H208 WeakPolarHBondContact CG1-CE1 3.18Å; V204-H208 WeakPolarHBondContact O-CB 3.25Å; V204-H208 VanDerWaalsContact O-CG 3.3Å; V204-H208 PolarHBondContact O-N 2.84Å; Y206-H208 VanDerWaalsContact C-N 3.32Å; Y206-H208 PolarHBondContact O-N 2.97Å; H208-C210 VanDerWaalsContact C-N 3.3Å; H208-C210 PolarHBondContact O-N 3.08Å; H208-G211 PolarHBondContact O-N 2.78Å; H208-G211 VanDerWaalsContact O-N 3.08Å; H208-I212 PolarHBondContact CD2-O 3.15Å; H208-I212 PolarHBondContact N-O 2.83Å; H208-F241 WeakPolarHBondContact O-CZ 3.45Å; H208-D274 IonicContact CD2-OD2 3.34Å; H208-D274 IonicContact CE1-OD2 2.76Å; H208-D274 IonicContact NE2-OD2 2.63Å; H208-D274 PolarHBondContact NE2-OD2 2.88Å
209	S	92.8	Very high	95.4	Very high	88 Å²	88	13.9 Å²	13.9	62%	0.615	8%	0.083	S	C	*	.	H	α-helix	trans	-67.4	-28.2	175.3	80.6	0	0	0	0	113.7	D205 Y206 T207 G211	D205-S209 WeakPolarHBondContact O-CB 3.37Å; D205-S209 PolarHBondContact O-N 3.24Å; Y206-S209 WeakPolarHBondContact O-CB 3.41Å; Y206-S209 PolarHBondContact O-N 2.88Å; Y206-S209 VanDerWaalsContact O-N 3.08Å; Y206-S209 PolarHBondContact O-OG 2.84Å; T207-S209 VanDerWaalsContact C-N 3.31Å; T207-S209 PolarHBondContact O-N 2.83Å; S209-G211 PolarHBondContact O-N 3.47Å
210	C	92	Very high	95.4	Very high	35 Å²	35	15.8 Å²	15.8	24%	0.236	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	2.2	171.9	-65	0	0	0	0	113.2	L148 Y206 T207 H208 I212	L148-C210 HydrophobicContact CD2-CB 4.48Å; Y206-C210 PolarHBondContact O-N 2.77Å; Y206-C210 PolarHBondContact O-SG 3.25Å; T207-C210 PolarHBondContact O-N 2.89Å; T207-C210 VanDerWaalsContact O-N 3.15Å; H208-C210 VanDerWaalsContact C-N 3.3Å; H208-C210 PolarHBondContact O-N 3.08Å; C210-I212 HydrophobicContact CB-CD1 4.04Å; C210-I212 HydrophobicContact CB-CG1 4.49Å
211	G	94.3	Very high	95.3	Very high	16 Å²	16	16.5 Å²	16.5	17%	0.165	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	26.1	-175.8	0	0	0	0	0	113.4	T207 H208 S209 H240 F241	T207-G211 PolarHBondContact O-N 3.39Å; H208-G211 PolarHBondContact O-N 2.78Å; H208-G211 VanDerWaalsContact O-N 3.08Å; S209-G211 PolarHBondContact O-N 3.47Å; G211-H240 CarbonylContact O-C 3.57Å; G211-H240 WeakPolarHBondContact O-CA 3.38Å; G211-F241 WeakPolarHBondContact O-CD1 3.5Å; G211-F241 PolarHBondContact O-N 3.08Å
212	I	95.5	Very high	95.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132	-178.7	-63.8	159.8	0	0	0	109.6	I144 E147 L148 T207 H208 C210	I144-I212 HydrophobicContact CD1-CG2 4.22Å; I144-I212 HydrophobicContact CG1-CD1 4.44Å; I144-I212 HydrophobicContact CG1-CG2 4.42Å; I144-I212 HydrophobicContact CG2-CD1 4.26Å; I144-I212 HydrophobicContact CG2-CG2 4.01Å; E147-I212 HydrophobicContact CB-CD1 4.43Å; L148-I212 HydrophobicContact CD2-CD1 3.95Å; L148-I212 HydrophobicContact CG-CD1 4.27Å; T207-I212 CarbonylContact C-O 3.53Å; T207-I212 PolarHBondContact O-N 2.8Å; H208-I212 PolarHBondContact CD2-O 3.15Å; H208-I212 PolarHBondContact N-O 2.83Å; C210-I212 HydrophobicContact CB-CD1 4.04Å; C210-I212 HydrophobicContact CB-CG1 4.49Å
213	V	96.4	Very high	95.5	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	149.6	167.5	-73.8	0	0	0	0	110.5	R215 G238 T239 F241 L248 V271	V213-R215 HydrophobicContact CB-CG 4.07Å; V213-R215 HydrophobicContact CG2-CG 3.76Å; V213-G238 VanDerWaalsContact O-CA 3.28Å; V213-G238 WeakPolarHBondContact O-CA 3.35Å; V213-T239 HydrophobicContact CG2-CG2 3.71Å; V213-T239 WeakPolarHBondContact CG2-O 3.18Å; V213-T239 PolarHBondContact N-O 3.36Å; V213-T239 PolarHBondContact O-N 2.96Å; V213-T239 VanDerWaalsContact O-N 3.09Å; V213-F241 HydrophobicContact CB-CD1 4.43Å; V213-F241 HydrophobicContact CG1-CD1 3.7Å; V213-F241 HydrophobicContact CG1-CE1 3.68Å; V213-F241 HydrophobicContact CG2-CD1 4.33Å; V213-L248 HydrophobicContact CG2-CD1 3.94Å; V213-V271 HydrophobicContact CG1-CB 4.45Å; V213-V271 HydrophobicContact CG1-CG2 3.7Å
214	H	96.5	Very high	95.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.103	C	C	.	.			trans	-91.8	-44.8	-174.7	-174.2	-39.3	0	0	0	112.8	D216 L217 A233 D234 F235 F237 D274	H214-D216 PolarHBondContact CE1-O 2.82Å; H214-D216 PolarHBondContact ND1-N 3.41Å; H214-D216 PolarHBondContact O-N 2.98Å; H214-D216 VanDerWaalsContact O-N 3.12Å; H214-L217 HydrophobicContact CB-CD2 3.96Å; H214-L217 HydrophobicContact CB-CG 3.98Å; H214-L217 WeakPolarHBondContact CD2-CD2 3.29Å; H214-A233 PolarHBondContact NE2-O 3.41Å; H214-D234 PolarHBondContact CE1-O 3.06Å; H214-D234 PolarHBondContact NE2-O 3.46Å; H214-F235 HydrophobicContact CB-CE1 4.42Å; H214-F235 AromaticContact CD2-CE1 3.89Å; H214-F237 CarbonylContact O-C 3.57Å; H214-D274 PolarHBondContact N-OD2 3.11Å
215	R	95	Very high	95.3	Very high	25 Å²	25	19.4 Å²	19.4	9%	0.094	11%	0.11	C	C	.	.	S	Bend	trans	62.6	11.6	174.3	-44.1	-172.3	-61.2	158.6	-1.4	117	V213 F237 G253 Y268 D274	V213-R215 HydrophobicContact CB-CG 4.07Å; V213-R215 HydrophobicContact CG2-CG 3.76Å; R215-F237 VanDerWaalsContact CZ-O 3.24Å; R215-F237 PolarHBondContact NE-O 3.28Å; R215-F237 PolarHBondContact NH2-O 3.48Å; R215-G253 WeakPolarHBondContact O-CA 3.34Å; R215-Y268 PolarHBondContact NH1-OH 2.91Å; R215-D274 WeakPolarHBondContact CA-OD1 3.01Å; R215-D274 PolarHBondContact N-OD1 3.01Å
216	D	95.1	Very high	95.1	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.027	13%	0.13	C	C	.	.			trans	-149.6	45.7	168.8	-169.7	42.4	0	0	0	109.7	H214 K218 N221 F237 G253 S254	H214-D216 PolarHBondContact CE1-O 2.82Å; H214-D216 PolarHBondContact ND1-N 3.41Å; H214-D216 PolarHBondContact O-N 2.98Å; H214-D216 VanDerWaalsContact O-N 3.12Å; D216-K218 PolarHBondContact O-N 2.91Å; D216-K218 IonicContact OD1-NZ 2.74Å; D216-K218 WeakPolarHBondContact OD2-CE 3.35Å; D216-K218 IonicContact OD2-NZ 3.18Å; D216-K218 PolarHBondContact OD2-NZ 3.31Å; D216-N221 PolarHBondContact O-ND2 3.4Å; D216-N221 PolarHBondContact OD2-ND2 3.23Å; D216-F237 HydrophobicContact CB-CB 4.18Å; D216-F237 HydrophobicContact CB-CD2 3.56Å; D216-F237 HydrophobicContact CB-CE2 4.35Å; D216-F237 HydrophobicContact CB-CG 4.2Å; D216-G253 VanDerWaalsContact OD1-CA 3.29Å; D216-G253 WeakPolarHBondContact OD1-CA 3.17Å; D216-S254 WeakPolarHBondContact OD1-CB 3.4Å; D216-S254 PolarHBondContact OD1-N 2.97Å; D216-S254 PolarHBondContact OD1-OG 3.33Å
217	L	97.5	Very high	94.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.			trans	-69.9	115.1	175.3	-71.7	176.1	0	0	0	109.6	V204 H214 L232 Y257 D274 S277 L278 I281	V204-L217 HydrophobicContact CG1-CD1 4.24Å; V204-L217 HydrophobicContact CG2-CD1 3.88Å; V204-L217 HydrophobicContact CG2-CD2 4.01Å; H214-L217 HydrophobicContact CB-CD2 3.96Å; H214-L217 HydrophobicContact CB-CG 3.98Å; H214-L217 WeakPolarHBondContact CD2-CD2 3.29Å; L217-L232 HydrophobicContact CD2-CD1 3.69Å; L217-L232 HydrophobicContact CD2-CD2 4.24Å; L217-Y257 WeakPolarHBondContact O-CB 3.2Å; L217-Y257 WeakPolarHBondContact O-CD1 3.35Å; L217-D274 HydrophobicContact CD1-CB 3.68Å; L217-S277 WeakPolarHBondContact O-CB 3.32Å; L217-L278 HydrophobicContact CD1-CD2 4.41Å; L217-L278 HydrophobicContact CD1-CG 4.09Å; L217-I281 HydrophobicContact CB-CD1 3.91Å
218	K	95.9	Very high	94.7	Very high	31 Å²	31	29.9 Å²	29.9	14%	0.135	17%	0.169	C	C	.	.			trans	-147.8	167	179	66.3	-164	-171.4	-154	0	111	D216 E220 N221 S254 Y257	D216-K218 PolarHBondContact O-N 2.91Å; D216-K218 IonicContact OD1-NZ 2.74Å; D216-K218 WeakPolarHBondContact OD2-CE 3.35Å; D216-K218 IonicContact OD2-NZ 3.18Å; D216-K218 PolarHBondContact OD2-NZ 3.31Å; K218-E220 WeakPolarHBondContact CB-OE2 3.33Å; K218-E220 HydrophobicContact CD-CB 4.31Å; K218-E220 HydrophobicContact CG-CB 4Å; K218-E220 HydrophobicContact CG-CG 4.49Å; K218-E220 PolarHBondContact O-N 2.84Å; K218-N221 WeakPolarHBondContact CE-ND2 3.11Å; K218-N221 WeakPolarHBondContact CE-OD1 3.47Å; K218-N221 HydrophobicContact CG-CB 3.97Å; K218-N221 PolarHBondContact O-N 3.48Å; K218-S254 WeakPolarHBondContact CD-OG 3.34Å; K218-S254 PolarHBondContact NZ-OG 3.17Å; K218-Y257 HydrophobicContact CB-CD1 3.98Å; K218-Y257 HydrophobicContact CB-CD2 3.6Å; K218-Y257 HydrophobicContact CB-CE1 3.91Å; K218-Y257 HydrophobicContact CB-CE2 3.48Å; K218-Y257 VanDerWaalsContact CB-CE2 3.48Å; K218-Y257 HydrophobicContact CB-CG 3.83Å
219	A	95.5	Very high	94.6	Very high	1 Å²	1	31 Å²	31	1%	0.008	18%	0.176	C	C	.	.	S	Bend	trans	-69.6	-23.1	-177.9	0	0	0	0	0	112.8	L178 F179 I222 Y257 V284	L178-A219 WeakPolarHBondContact CB-O 3.43Å; L178-A219 PolarHBondContact N-O 2.77Å; F179-A219 HydrophobicContact CB-CB 3.87Å; F179-A219 HydrophobicContact CD2-CB 4.22Å; F179-A219 PolarHBondContact N-O 2.91Å; A219-I222 PolarHBondContact O-N 3.42Å; A219-Y257 WeakPolarHBondContact CB-OH 3.27Å; A219-Y257 PolarHBondContact N-OH 2.66Å; A219-V284 HydrophobicContact CB-CG1 4.43Å
220	E	93.4	Very high	94.8	Very high	49 Å²	49	26.9 Å²	26.9	23%	0.229	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-38.2	174.9	-50.1	89.3	104.7	0	0	111	E177 F179 K218 I222 Y257	E177-E220 WeakPolarHBondContact CG-O 3.39Å; E177-E220 WeakPolarHBondContact OE2-CA 3.48Å; E177-E220 WeakPolarHBondContact OE2-CB 3.44Å; F179-E220 HydrophobicContact CB-CG 3.98Å; F179-E220 HydrophobicContact CG-CG 4.17Å; K218-E220 WeakPolarHBondContact CB-OE2 3.33Å; K218-E220 HydrophobicContact CD-CB 4.31Å; K218-E220 HydrophobicContact CG-CB 4Å; K218-E220 HydrophobicContact CG-CG 4.49Å; K218-E220 PolarHBondContact O-N 2.84Å; E220-I222 PolarHBondContact O-N 3.04Å; E220-Y257 PolarHBondContact OE2-OH 2.93Å
221	N	96.4	Very high	95.1	Very high	16 Å²	16	25.8 Å²	25.8	9%	0.086	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	5.9	176	-69.4	-10	0	0	0	113.2	D216 K218 A233	D216-N221 PolarHBondContact O-ND2 3.4Å; D216-N221 PolarHBondContact OD2-ND2 3.23Å; K218-N221 WeakPolarHBondContact CE-ND2 3.11Å; K218-N221 WeakPolarHBondContact CE-OD1 3.47Å; K218-N221 HydrophobicContact CG-CB 3.97Å; K218-N221 PolarHBondContact O-N 3.48Å; N221-A233 PolarHBondContact O-N 3.23Å
222	I	97.8	Very high	95.2	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.2	175.2	-64.5	168.8	0	0	0	108.8	L178 V200 A219 E220 I230 L232 I281	L178-I222 HydrophobicContact CB-CB 4.09Å; L178-I222 HydrophobicContact CB-CG2 4.02Å; L178-I222 VanDerWaalsContact CB-O 3.25Å; L178-I222 WeakPolarHBondContact CB-O 3.34Å; L178-I222 HydrophobicContact CD2-CB 4.11Å; L178-I222 HydrophobicContact CD2-CD1 4.3Å; L178-I222 HydrophobicContact CD2-CG2 3.8Å; L178-I222 HydrophobicContact CG-CG2 4.48Å; L178-I222 PolarHBondContact N-O 3.41Å; V200-I222 HydrophobicContact CG1-CD1 4.01Å; V200-I222 HydrophobicContact CG2-CD1 4.04Å; V200-I222 HydrophobicContact CG2-CG2 4.47Å; A219-I222 PolarHBondContact O-N 3.42Å; E220-I222 PolarHBondContact O-N 3.04Å; I222-I230 HydrophobicContact CG2-CD1 3.63Å; I222-I230 HydrophobicContact CG2-CG2 3.95Å; I222-L232 HydrophobicContact CG1-CD1 4.13Å; I222-I281 HydrophobicContact CD1-CD1 3.88Å; I222-I281 HydrophobicContact CD1-CG1 4.35Å; I222-I281 HydrophobicContact CD1-CG2 3.84Å
223	L	97.4	Very high	95.2	Very high	36 Å²	36	25.7 Å²	25.7	19%	0.188	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	160.2	-177.4	-51.5	-177.6	0	0	0	112.1	V154 V173 G176 E177 K231 A233	V154-L223 HydrophobicContact CG2-CD1 4.24Å; V173-L223 HydrophobicContact CB-CB 3.92Å; V173-L223 HydrophobicContact CB-CD1 3.96Å; V173-L223 HydrophobicContact CG1-CB 3.48Å; V173-L223 VanDerWaalsContact CG1-CB 3.48Å; V173-L223 HydrophobicContact CG1-CD1 4.46Å; V173-L223 HydrophobicContact CG2-CB 4.38Å; V173-L223 HydrophobicContact CG2-CD1 4.15Å; G176-L223 CarbonylContact O-C 3.6Å; G176-L223 VanDerWaalsContact O-CA 3.26Å; G176-L223 WeakPolarHBondContact O-CA 3.34Å; E177-L223 HydrophobicContact CB-CD2 4.36Å; E177-L223 HydrophobicContact CG-CD2 3.69Å; L223-K231 HydrophobicContact CB-CB 4.21Å; L223-K231 PolarHBondContact N-O 3.27Å; L223-K231 PolarHBondContact O-N 3.38Å; L223-A233 HydrophobicContact CD1-CB 3.8Å; L223-A233 HydrophobicContact CG-CB 3.95Å
224	L	96.4	Very high	95	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.6	-179.8	-69.5	163.7	0	0	0	111.3	V173 N175 G176 L178 Y181 K196 M228 N229 I230	V173-L224 WeakPolarHBondContact CG1-O 3.37Å; N175-L224 WeakPolarHBondContact CA-O 3.47Å; N175-L224 HydrophobicContact CB-CB 4.02Å; N175-L224 VanDerWaalsContact CB-O 3.29Å; N175-L224 WeakPolarHBondContact CB-O 3.49Å; N175-L224 PolarHBondContact N-O 2.73Å; G176-L224 PolarHBondContact O-N 2.98Å; L178-L224 HydrophobicContact CD1-CD1 4.08Å; L178-L224 HydrophobicContact CD1-CD2 4.32Å; L178-L224 HydrophobicContact CD1-CG 4.43Å; Y181-L224 HydrophobicContact CD1-CD1 4.4Å; Y181-L224 HydrophobicContact CD2-CD1 4.13Å; Y181-L224 HydrophobicContact CG-CD1 3.78Å; K196-L224 HydrophobicContact CD-CD2 4.48Å; L224-M228 HydrophobicContact CD1-CE 3.84Å; L224-M228 HydrophobicContact CD2-CE 4.29Å; L224-M228 HydrophobicContact CG-CE 4.48Å; L224-N229 WeakPolarHBondContact CA-O 3.31Å; L224-I230 HydrophobicContact CD2-CD1 3.86Å
225	D	93.1	Very high	94.9	Very high	27 Å²	27	28.3 Å²	28.3	14%	0.144	15%	0.149	C	C	.	.			trans	-75.7	178.6	176.5	78.6	9.6	0	0	0	112.6	V173 N175 E227 M228 N229	V173-D225 HydrophobicContact CG1-CB 4.29Å; N175-D225 PolarHBondContact ND2-O 3.35Å; D225-E227 PolarHBondContact O-N 2.91Å; D225-E227 VanDerWaalsContact O-N 3.17Å; D225-E227 WeakPolarHBondContact OD1-CA 3.36Å; D225-E227 WeakPolarHBondContact OD1-CB 3.37Å; D225-E227 PolarHBondContact OD1-N 3.37Å; D225-M228 WeakPolarHBondContact O-CA 3.21Å; D225-M228 PolarHBondContact O-N 3.49Å; D225-M228 PolarHBondContact OD1-N 2.64Å; D225-N229 PolarHBondContact N-O 3.02Å; D225-N229 PolarHBondContact OD1-N 3.01Å; D225-N229 PolarHBondContact OD1-ND2 3.15Å; D225-N229 WeakPolarHBondContact OD2-CB 3.35Å; D225-N229 PolarHBondContact OD2-ND2 3.45Å
226	S	90.9	Very high	94.6	Very high	92 Å²	92	28.7 Å²	28.7	64%	0.643	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.6	-179.3	50.6	0	0	0	0	114.4	S174	S174-S226 WeakPolarHBondContact OG-CA 3.24Å; S174-S226 PolarHBondContact OG-N 2.91Å
227	E	90.1	Very high	94.4	Very high	139 Å²	139	31.3 Å²	31.3	65%	0.65	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	5	177.2	-63.4	177.2	178.2	0	0	112	D225 N229	D225-E227 PolarHBondContact O-N 2.91Å; D225-E227 VanDerWaalsContact O-N 3.17Å; D225-E227 WeakPolarHBondContact OD1-CA 3.36Å; D225-E227 WeakPolarHBondContact OD1-CB 3.37Å; D225-E227 PolarHBondContact OD1-N 3.37Å; E227-N229 VanDerWaalsContact C-N 3.27Å; E227-N229 WeakPolarHBondContact CB-ND2 3.17Å; E227-N229 PolarHBondContact O-N 3.46Å; E227-N229 PolarHBondContact OE2-ND2 3.41Å
228	M	92.7	Very high	94.2	Very high	46 Å²	46	31.4 Å²	31.4	23%	0.227	17%	0.169	C	C	.	.	S	Bend	trans	65.6	21.4	-173.8	-57.1	-67.5	-64	0	0	114.3	N175 Y181 K196 L224 D225	N175-M228 HydrophobicContact CB-SD 4.28Å; N175-M228 PolarHBondContact ND2-SD 2.82Å; N175-M228 VanDerWaalsContact ND2-SD 3.42Å; Y181-M228 HydrophobicContact CD2-CE 3.66Å; Y181-M228 HydrophobicContact CE1-CE 4.26Å; Y181-M228 HydrophobicContact CE2-CE 3.28Å; Y181-M228 HydrophobicContact CE2-SD 4.42Å; Y181-M228 HydrophobicContact CG-CE 4.29Å; K196-M228 PolarHBondContact NZ-O 3.34Å; L224-M228 HydrophobicContact CD1-CE 3.84Å; L224-M228 HydrophobicContact CD2-CE 4.29Å; L224-M228 HydrophobicContact CG-CE 4.48Å; D225-M228 WeakPolarHBondContact O-CA 3.21Å; D225-M228 PolarHBondContact O-N 3.49Å; D225-M228 PolarHBondContact OD1-N 2.64Å
229	N	92.7	Very high	94.2	Very high	45 Å²	45	30.9 Å²	30.9	24%	0.241	17%	0.168	C	C	.	.			trans	-74.4	159.7	167.7	-47.6	-65	0	0	0	110.6	L224 D225 E227	L224-N229 WeakPolarHBondContact CA-O 3.31Å; D225-N229 PolarHBondContact N-O 3.02Å; D225-N229 PolarHBondContact OD1-N 3.01Å; D225-N229 PolarHBondContact OD1-ND2 3.15Å; D225-N229 WeakPolarHBondContact OD2-CB 3.35Å; D225-N229 PolarHBondContact OD2-ND2 3.45Å; E227-N229 VanDerWaalsContact C-N 3.27Å; E227-N229 WeakPolarHBondContact CB-ND2 3.17Å; E227-N229 PolarHBondContact O-N 3.46Å; E227-N229 PolarHBondContact OE2-ND2 3.41Å
230	I	96.9	Very high	94.1	Very high	1 Å²	1	34 Å²	34	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.6	-176.5	-70.6	-70.1	0	0	0	111.3	N152 L178 K196 D199 V200 I222 L224	N152-I230 VanDerWaalsContact CA-O 3.31Å; N152-I230 WeakPolarHBondContact CA-O 3.43Å; N152-I230 WeakPolarHBondContact CB-O 3.28Å; N152-I230 PolarHBondContact ND2-O 3.46Å; L178-I230 HydrophobicContact CD1-CD1 4.41Å; K196-I230 HydrophobicContact CB-CD1 4.07Å; K196-I230 HydrophobicContact CB-CG1 3.84Å; K196-I230 HydrophobicContact CD-CD1 4.4Å; K196-I230 HydrophobicContact CG-CD1 4.43Å; K196-I230 HydrophobicContact CG-CG1 4.22Å; D199-I230 HydrophobicContact CB-CB 3.79Å; D199-I230 HydrophobicContact CB-CG1 4.2Å; D199-I230 HydrophobicContact CB-CG2 4.23Å; V200-I230 HydrophobicContact CG2-CD1 4.36Å; V200-I230 HydrophobicContact CG2-CG1 4.33Å; V200-I230 HydrophobicContact CG2-CG2 3.67Å; I222-I230 HydrophobicContact CG2-CD1 3.63Å; I222-I230 HydrophobicContact CG2-CG2 3.95Å; L224-I230 HydrophobicContact CD2-CD1 3.86Å
231	K	97	Very high	94	Very high	11 Å²	11	32.9 Å²	32.9	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	107.7	172.9	-71	-70.1	-169.2	164.7	0	110.1	S151 N152 V154 E171 V173 L223	S151-K231 WeakPolarHBondContact O-CE 3.32Å; S151-K231 PolarHBondContact O-NZ 3.29Å; N152-K231 CarbonylContact O-C 3.39Å; N152-K231 WeakPolarHBondContact O-CA 3.14Å; V154-K231 HydrophobicContact CG2-CB 4.06Å; E171-K231 WeakPolarHBondContact OE1-CE 3.45Å; E171-K231 IonicContact OE1-NZ 2.88Å; E171-K231 PolarHBondContact OE1-NZ 2.95Å; E171-K231 WeakPolarHBondContact OE2-CE 3.47Å; E171-K231 IonicContact OE2-NZ 3.21Å; E171-K231 PolarHBondContact OE2-NZ 3.37Å; V173-K231 HydrophobicContact CG1-CB 4.17Å; V173-K231 HydrophobicContact CG1-CG 4.13Å; V173-K231 HydrophobicContact CG2-CB 3.97Å; V173-K231 HydrophobicContact CG2-CG 3.92Å; L223-K231 HydrophobicContact CB-CB 4.21Å; L223-K231 PolarHBondContact N-O 3.27Å; L223-K231 PolarHBondContact O-N 3.38Å
232	L	97.9	Very high	93.5	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.1	172.2	-177.2	61.6	0	0	0	110.1	N152 I153 V154 A203 V204 L217 I222 F235	N152-L232 PolarHBondContact O-N 3.39Å; I153-L232 HydrophobicContact CG1-CB 4.33Å; V154-L232 PolarHBondContact N-O 2.93Å; A203-L232 HydrophobicContact CB-CB 4.11Å; A203-L232 HydrophobicContact CB-CD2 3.95Å; V204-L232 HydrophobicContact CG2-CD2 4.05Å; L217-L232 HydrophobicContact CD2-CD1 3.69Å; L217-L232 HydrophobicContact CD2-CD2 4.24Å; I222-L232 HydrophobicContact CG1-CD1 4.13Å; L232-F235 HydrophobicContact CD2-CZ 4.04Å; L232-F235 HydrophobicContact CG-CE2 4.49Å; L232-F235 HydrophobicContact CG-CZ 4.24Å
233	A	95.5	Very high	93	Very high	13 Å²	13	42.4 Å²	42.4	11%	0.107	23%	0.232	C	C	.	.			trans	-133.8	170.4	-173.1	0	0	0	0	0	111.9	V154 H214 N221 L223	V154-A233 HydrophobicContact CB-CB 4.45Å; V154-A233 HydrophobicContact CG2-CB 3.74Å; H214-A233 PolarHBondContact NE2-O 3.41Å; N221-A233 PolarHBondContact O-N 3.23Å; L223-A233 HydrophobicContact CD1-CB 3.8Å; L223-A233 HydrophobicContact CG-CB 3.95Å
234	D	92.3	Very high	92.2	Very high	55 Å²	55	44.6 Å²	44.6	29%	0.294	25%	0.248	S	C	.	.			trans	54.4	88.3	174.9	-151.6	-53.9	0	0	0	117	K123 H214 S236	K123-D234 IonicContact NZ-OD1 2.71Å; K123-D234 IonicContact NZ-OD2 3.53Å; K123-D234 PolarHBondContact NZ-OD2 3.19Å; H214-D234 PolarHBondContact CE1-O 3.06Å; H214-D234 PolarHBondContact NE2-O 3.46Å; D234-S236 VanDerWaalsContact C-N 3.32Å; D234-S236 PolarHBondContact O-N 2.96Å; D234-S236 WeakPolarHBondContact OD1-CB 3.46Å; D234-S236 PolarHBondContact OD1-N 3.25Å; D234-S236 PolarHBondContact OD1-OG 3.17Å
235	F	94	Very high	91.6	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	28%	0.278	C	S	.	.			trans	-92.5	25.8	175.1	-72.1	-97.4	0	0	0	113	E141 I144 L145 L148 I153 T207 H214 L232 F237 G238	E141-F235 HydrophobicContact CG-CB 4.41Å; I144-F235 HydrophobicContact CG2-CB 3.87Å; I144-F235 HydrophobicContact CG2-CD1 3.8Å; I144-F235 HydrophobicContact CG2-CG 3.91Å; L145-F235 HydrophobicContact CD2-CD2 3.77Å; L145-F235 HydrophobicContact CD2-CE2 4.43Å; L145-F235 HydrophobicContact CD2-CG 4.5Å; L148-F235 HydrophobicContact CD1-CD1 3.91Å; L148-F235 HydrophobicContact CD1-CD2 4.2Å; L148-F235 HydrophobicContact CD1-CE1 3.52Å; L148-F235 HydrophobicContact CD1-CE2 3.84Å; L148-F235 HydrophobicContact CD1-CG 4.24Å; L148-F235 HydrophobicContact CD1-CZ 3.49Å; L148-F235 VanDerWaalsContact CD1-CZ 3.49Å; I153-F235 HydrophobicContact CD1-CZ 4.48Å; I153-F235 HydrophobicContact CG2-CE2 3.95Å; I153-F235 HydrophobicContact CG2-CZ 4.34Å; T207-F235 HydrophobicContact CG2-CE1 3.68Å; T207-F235 HydrophobicContact CG2-CZ 3.79Å; H214-F235 HydrophobicContact CB-CE1 4.42Å; H214-F235 AromaticContact CD2-CE1 3.89Å; L232-F235 HydrophobicContact CD2-CZ 4.04Å; L232-F235 HydrophobicContact CG-CE2 4.49Å; L232-F235 HydrophobicContact CG-CZ 4.24Å; F235-F237 PolarHBondContact O-N 2.98Å; F235-G238 WeakPolarHBondContact O-CA 3.46Å; F235-G238 PolarHBondContact O-N 3.34Å
236	S	89.3	Confident	91.3	Very high	34 Å²	34	53 Å²	53	24%	0.238	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.3	-177.2	55.8	0	0	0	0	114.6	D234	D234-S236 VanDerWaalsContact C-N 3.32Å; D234-S236 PolarHBondContact O-N 2.96Å; D234-S236 WeakPolarHBondContact OD1-CB 3.46Å; D234-S236 PolarHBondContact OD1-N 3.25Å; D234-S236 PolarHBondContact OD1-OG 3.17Å
237	F	90.4	Very high	91.3	Very high	59 Å²	59	53.2 Å²	53.2	26%	0.259	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-0	172.7	-64	-72.7	0	0	0	113.8	H214 R215 D216 F235 C252 L586	H214-F237 CarbonylContact O-C 3.57Å; R215-F237 VanDerWaalsContact CZ-O 3.24Å; R215-F237 PolarHBondContact NE-O 3.28Å; R215-F237 PolarHBondContact NH2-O 3.48Å; D216-F237 HydrophobicContact CB-CB 4.18Å; D216-F237 HydrophobicContact CB-CD2 3.56Å; D216-F237 HydrophobicContact CB-CE2 4.35Å; D216-F237 HydrophobicContact CB-CG 4.2Å; F235-F237 PolarHBondContact O-N 2.98Å; F237-C252 HydrophobicContact CD1-CB 3.48Å; F237-C252 VanDerWaalsContact CD1-CB 3.48Å; F237-C252 HydrophobicContact CE1-CB 3.94Å; F237-C252 HydrophobicContact CG-CB 4.21Å; F237-L586 HydrophobicContact CE1-CD2 4.4Å
238	G	93.6	Very high	91.2	Very high	3 Å²	3	47.4 Å²	47.4	3%	0.031	26%	0.257	C	S	.	.			trans	-60.8	151	-177.3	0	0	0	0	0	113.4	R140 I144 V213 F235	R140-G238 WeakPolarHBondContact CD-O 3.5Å; I144-G238 VanDerWaalsContact CD1-C 3.49Å; V213-G238 VanDerWaalsContact O-CA 3.28Å; V213-G238 WeakPolarHBondContact O-CA 3.35Å; F235-G238 WeakPolarHBondContact O-CA 3.46Å; F235-G238 PolarHBondContact O-N 3.34Å
239	T	94.5	Very high	90.9	Very high	19 Å²	19	50.2 Å²	50.2	12%	0.117	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	146.8	170.8	-166.4	0	0	0	0	111.9	V213 L248	V213-T239 HydrophobicContact CG2-CG2 3.71Å; V213-T239 WeakPolarHBondContact CG2-O 3.18Å; V213-T239 PolarHBondContact N-O 3.36Å; V213-T239 PolarHBondContact O-N 2.96Å; V213-T239 VanDerWaalsContact O-N 3.09Å; T239-L248 HydrophobicContact CG2-CD1 4.01Å; T239-L248 HydrophobicContact CG2-CD2 4.24Å
240	H	94.2	Very high	90.4	Very high	68 Å²	68	51.3 Å²	51.3	32%	0.315	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	153.3	166.6	-57.4	85.1	0	0	0	111.6	E147 G211	E147-H240 VanDerWaalsContact CD-NE2 3.26Å; E147-H240 IonicContact OE1-CE1 3.34Å; E147-H240 PolarHBondContact OE1-CE1 2.92Å; E147-H240 IonicContact OE1-NE2 2.92Å; E147-H240 PolarHBondContact OE1-NE2 2.87Å; E147-H240 IonicContact OE2-CD2 2.99Å; E147-H240 IonicContact OE2-NE2 2.79Å; E147-H240 PolarHBondContact OE2-NE2 3Å; G211-H240 CarbonylContact O-C 3.57Å; G211-H240 WeakPolarHBondContact O-CA 3.38Å
241	F	91.7	Very high	89.7	Confident	25 Å²	25	56.3 Å²	56.3	11%	0.11	30%	0.304	C	S	.	.			trans	-138.3	139.8	173.1	66.5	-98.8	0	0	0	110.5	H208 G211 V213 S243 P244 H246 V271	H208-F241 WeakPolarHBondContact O-CZ 3.45Å; G211-F241 WeakPolarHBondContact O-CD1 3.5Å; G211-F241 PolarHBondContact O-N 3.08Å; V213-F241 HydrophobicContact CB-CD1 4.43Å; V213-F241 HydrophobicContact CG1-CD1 3.7Å; V213-F241 HydrophobicContact CG1-CE1 3.68Å; V213-F241 HydrophobicContact CG2-CD1 4.33Å; F241-S243 VanDerWaalsContact CD2-C 3.45Å; F241-S243 WeakPolarHBondContact CD2-O 3.37Å; F241-P244 HydrophobicContact CE2-CB 4.47Å; F241-P244 HydrophobicContact CE2-CG 4.28Å; F241-H246 HydrophobicContact CB-CB 4.3Å; F241-V271 HydrophobicContact CE1-CG2 3.89Å; F241-V271 HydrophobicContact CE2-CG2 4.46Å; F241-V271 HydrophobicContact CZ-CG2 3.78Å
242	N	85.8	Confident	89	Confident	161 Å²	161	56.7 Å²	56.7	86%	0.861	31%	0.308	S	S	*	.	S	Bend	trans	-85.9	-15	-176	-64.1	-12.1	0	0	0	113.8
243	S	86.9	Confident	88.2	Confident	55 Å²	55	57.9 Å²	57.9	39%	0.385	32%	0.32	S	S	.	.	S	Bend	trans	-152.6	142.3	-180	170	0	0	0	0	109.2	F241 N245 H246	F241-S243 VanDerWaalsContact CD2-C 3.45Å; F241-S243 WeakPolarHBondContact CD2-O 3.37Å; S243-N245 PolarHBondContact O-N 3.38Å; S243-N245 PolarHBondContact OG-N 3.42Å; S243-H246 WeakPolarHBondContact O-CB 3.41Å; S243-H246 PolarHBondContact O-N 3.43Å
244	P	79.9	Confident	87.8	Confident	81 Å²	81	58.4 Å²	58.4	53%	0.526	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.3	177.3	-26.7	35.3	0	0	0	114.9	F241 I269	F241-P244 HydrophobicContact CE2-CB 4.47Å; F241-P244 HydrophobicContact CE2-CG 4.28Å; P244-I269 WeakPolarHBondContact O-CG2 3.46Å
245	N	84.8	Confident	87.8	Confident	119 Å²	119	58 Å²	58	64%	0.636	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	12.1	176.9	-62.2	-15.2	0	0	0	113	S243 L247	S243-N245 PolarHBondContact O-N 3.38Å; S243-N245 PolarHBondContact OG-N 3.42Å; N245-L247 PolarHBondContact O-N 2.98Å
246	H	87.1	Confident	87.7	Confident	86 Å²	86	59.3 Å²	59.3	40%	0.398	33%	0.332	S	S	.	.			trans	-66.5	124.8	177.6	-177.6	68.4	0	0	0	110.3	F241 S243	F241-H246 HydrophobicContact CB-CB 4.3Å; S243-H246 WeakPolarHBondContact O-CB 3.41Å; S243-H246 PolarHBondContact O-N 3.43Å
247	L	89.3	Confident	88.1	Confident	96 Å²	96	58 Å²	58	50%	0.503	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	131.3	-179.2	-62.6	174.4	0	0	0	110.7	N245 P267 Y268 I269	N245-L247 PolarHBondContact O-N 2.98Å; L247-P267 HydrophobicContact CB-CB 3.98Å; L247-P267 HydrophobicContact CD1-CB 4.2Å; L247-P267 HydrophobicContact CG-CB 4.49Å; L247-Y268 WeakPolarHBondContact CA-O 3.2Å; L247-I269 HydrophobicContact CD2-CG1 3.79Å
248	L	88.6	Confident	88.3	Confident	16 Å²	16	55.7 Å²	55.7	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.7	175.1	-59.9	177.8	0	0	0	109.3	V213 T239 P267 Y268	V213-L248 HydrophobicContact CG2-CD1 3.94Å; T239-L248 HydrophobicContact CG2-CD1 4.01Å; T239-L248 HydrophobicContact CG2-CD2 4.24Å; L248-P267 CarbonylContact O-C 3.57Å; L248-P267 WeakPolarHBondContact O-CA 3.27Å; L248-Y268 HydrophobicContact CB-CD2 4.47Å; L248-Y268 HydrophobicContact CB-CE1 4.07Å; L248-Y268 HydrophobicContact CB-CE2 4Å; L248-Y268 HydrophobicContact CD1-CE2 4.1Å; L248-Y268 PolarHBondContact N-O 2.96Å; L248-Y268 WeakPolarHBondContact O-CD1 3.41Å; L248-Y268 WeakPolarHBondContact O-CE1 3.1Å; L248-Y268 PolarHBondContact O-N 3.44Å
249	T	86.3	Confident	88.4	Confident	106 Å²	106	55.5 Å²	55.5	65%	0.65	31%	0.312	S	S	*	.			trans	-108.4	-15.2	-179.3	55	0	0	0	0	113.3	W251 P267	T249-W251 PolarHBondContact O-N 3.36Å; T249-P267 HydrophobicContact CG2-CB 4.21Å; T249-P267 HydrophobicContact CG2-CG 4.26Å
250	T	82.2	Confident	88.4	Confident	68 Å²	68	55 Å²	55	42%	0.417	31%	0.309	S	S	.	.			trans	-77.1	117	179.3	-43.1	0	0	0	0	110.5	Y268	T250-Y268 WeakPolarHBondContact O-CE1 3.21Å; T250-Y268 PolarHBondContact O-OH 3.48Å
251	W	82.8	Confident	88.5	Confident	105 Å²	105	52.5 Å²	52.5	40%	0.398	30%	0.298	S	S	.	.			trans	-70.4	130.6	165.6	-71	53.6	0	0	0	110.1	T249 I262 G265	T249-W251 PolarHBondContact O-N 3.36Å; W251-I262 HydrophobicContact CD2-CG2 3.88Å; W251-I262 VanDerWaalsContact CD2-O 3.3Å; W251-I262 HydrophobicContact CE3-CG2 3.62Å; W251-I262 HydrophobicContact CG-CG2 4.23Å; W251-I262 WeakPolarHBondContact CH2-O 3.29Å; W251-I262 WeakPolarHBondContact CZ2-O 3.33Å; W251-I262 HydrophobicContact CZ3-CG2 4.35Å; W251-I262 WeakPolarHBondContact CZ3-O 3.46Å; W251-G265 VanDerWaalsContact CZ2-N 3.28Å
252	C	83	Confident	88.5	Confident	20 Å²	20	52 Å²	52	14%	0.135	30%	0.296	C	S	.	.			trans	-161.6	169.8	172.1	57.3	0	0	0	0	109.9	F237	F237-C252 HydrophobicContact CD1-CB 3.48Å; F237-C252 VanDerWaalsContact CD1-CB 3.48Å; F237-C252 HydrophobicContact CE1-CB 3.94Å; F237-C252 HydrophobicContact CG-CB 4.21Å
253	G	79.9	Confident	88.8	Confident	25 Å²	25	44.9 Å²	44.9	26%	0.258	26%	0.257	S	S	.	.	S	Bend	trans	96.4	166.9	-179.7	0	0	0	0	0	113.8	R215 D216	R215-G253 WeakPolarHBondContact O-CA 3.34Å; D216-G253 VanDerWaalsContact OD1-CA 3.29Å; D216-G253 WeakPolarHBondContact OD1-CA 3.17Å
254	S	87.7	Confident	88.9	Confident	25 Å²	25	47 Å²	47	18%	0.175	26%	0.264	C	S	.	.			trans	-79	122.9	-169.9	-55.1	0	0	0	0	111.5	D216 K218 P256 Y257 A258	D216-S254 WeakPolarHBondContact OD1-CB 3.4Å; D216-S254 PolarHBondContact OD1-N 2.97Å; D216-S254 PolarHBondContact OD1-OG 3.33Å; K218-S254 WeakPolarHBondContact CD-OG 3.34Å; K218-S254 PolarHBondContact NZ-OG 3.17Å; S254-P256 VanDerWaalsContact C-CD 3.46Å; S254-P256 VanDerWaalsContact O-N 3.14Å; S254-Y257 PolarHBondContact O-N 3.03Å; S254-A258 PolarHBondContact O-N 3.46Å
255	P	91.5	Very high	89.3	Confident	47 Å²	47	45 Å²	45	31%	0.305	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-52.5	-38.4	-168.1	-29.2	34.4	0	0	0	117.3	Y257 A258 F263 L297 L300	P255-Y257 PolarHBondContact O-N 3.27Å; P255-A258 PolarHBondContact O-N 2.97Å; P255-F263 HydrophobicContact CB-CZ 4.11Å; P255-F263 WeakPolarHBondContact O-CE2 3.47Å; P255-F263 WeakPolarHBondContact O-CZ 3.45Å; P255-L297 HydrophobicContact CB-CD1 4.07Å; P255-L297 HydrophobicContact CG-CD1 4.45Å; P255-L300 HydrophobicContact CB-CD2 3.88Å
256	P	93.4	Very high	89.4	Confident	28 Å²	28	44.7 Å²	44.7	18%	0.182	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-66.2	-20.2	177.8	-21.9	34.7	0	0	0	114.5	S254 L290 L300	S254-P256 VanDerWaalsContact C-CD 3.46Å; S254-P256 VanDerWaalsContact O-N 3.14Å; P256-L290 HydrophobicContact CB-CD1 3.91Å; P256-L290 HydrophobicContact CB-CD2 4.04Å; P256-L290 HydrophobicContact CG-CD1 4.37Å; P256-L300 HydrophobicContact CG-CD2 4.29Å
257	Y	96.4	Very high	89.7	Confident	7 Å²	7	43.5 Å²	43.5	3%	0.027	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-102.2	-7.5	179.3	-62.2	-91.6	0	0	0	112.8	L217 K218 A219 E220 S254 P255 S277 V280 I281 L290	L217-Y257 WeakPolarHBondContact O-CB 3.2Å; L217-Y257 WeakPolarHBondContact O-CD1 3.35Å; K218-Y257 HydrophobicContact CB-CD1 3.98Å; K218-Y257 HydrophobicContact CB-CD2 3.6Å; K218-Y257 HydrophobicContact CB-CE1 3.91Å; K218-Y257 HydrophobicContact CB-CE2 3.48Å; K218-Y257 VanDerWaalsContact CB-CE2 3.48Å; K218-Y257 HydrophobicContact CB-CG 3.83Å; A219-Y257 WeakPolarHBondContact CB-OH 3.27Å; A219-Y257 PolarHBondContact N-OH 2.66Å; E220-Y257 PolarHBondContact OE2-OH 2.93Å; S254-Y257 PolarHBondContact O-N 3.03Å; P255-Y257 PolarHBondContact O-N 3.27Å; Y257-S277 WeakPolarHBondContact O-CB 3.43Å; Y257-S277 PolarHBondContact O-OG 3.44Å; Y257-V280 HydrophobicContact CD1-CB 3.81Å; Y257-V280 HydrophobicContact CD1-CG1 3.36Å; Y257-V280 HydrophobicContact CE1-CB 4.34Å; Y257-V280 HydrophobicContact CE1-CG1 3.6Å; Y257-V280 HydrophobicContact CG-CG1 4.08Å; Y257-I281 HydrophobicContact CD1-CG1 4.22Å; Y257-I281 HydrophobicContact CE1-CG1 3.99Å; Y257-L290 HydrophobicContact CE1-CD2 4.41Å; Y257-L290 HydrophobicContact CE2-CD2 4.31Å
258	A	95.1	Very high	89.9	Confident	9 Å²	9	39.1 Å²	39.1	7%	0.074	23%	0.23	C	C	.	.			trans	-75.8	145.3	-177.5	0	0	0	0	0	112.2	S254 P255 I262 F263 W276	S254-A258 PolarHBondContact O-N 3.46Å; P255-A258 PolarHBondContact O-N 2.97Å; A258-I262 HydrophobicContact CB-CD1 4.32Å; A258-I262 HydrophobicContact CB-CG2 4.43Å; A258-F263 HydrophobicContact CB-CD2 4.36Å; A258-F263 HydrophobicContact CB-CE2 3.83Å; A258-W276 PolarHBondContact O-NE1 3.08Å
259	A	95.5	Very high	90.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.			trans	-79.9	156.7	-176.8	0	0	0	0	0	112.8	E261 I262 F263 A273 W276	A259-E261 VanDerWaalsContact C-N 3.3Å; A259-E261 VanDerWaalsContact CB-CD 3.48Å; A259-E261 WeakPolarHBondContact CB-OE1 3.28Å; A259-E261 VanDerWaalsContact CB-OE2 3.23Å; A259-E261 WeakPolarHBondContact CB-OE2 3.47Å; A259-E261 PolarHBondContact O-N 3.31Å; A259-I262 HydrophobicContact CB-CD1 4.43Å; A259-I262 HydrophobicContact CB-CG1 4.44Å; A259-I262 WeakPolarHBondContact O-CB 3.19Å; A259-I262 PolarHBondContact O-N 2.8Å; A259-F263 PolarHBondContact O-N 3.35Å; A259-A273 HydrophobicContact CB-CB 4.34Å; A259-W276 HydrophobicContact CB-CB 3.78Å; A259-W276 HydrophobicContact CB-CD2 4.26Å; A259-W276 HydrophobicContact CB-CG 3.71Å
260	P	95.5	Very high	90.6	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-54.5	-41	-178.6	-27.5	35.8	0	0	0	114.1	I262 F263 L264 W276 V304 L305	P260-I262 VanDerWaalsContact C-N 3.28Å; P260-I262 PolarHBondContact O-N 2.9Å; P260-F263 WeakPolarHBondContact O-CB 3.16Å; P260-F263 PolarHBondContact O-N 3.45Å; P260-F263 VanDerWaalsContact O-N 3.12Å; P260-L264 WeakPolarHBondContact O-CG 3.21Å; P260-L264 PolarHBondContact O-N 3.45Å; P260-L264 VanDerWaalsContact O-N 3.16Å; P260-W276 HydrophobicContact CG-CD2 4.47Å; P260-W276 HydrophobicContact CG-CE3 4.08Å; P260-W276 HydrophobicContact CG-CH2 3.45Å; P260-W276 VanDerWaalsContact CG-CH2 3.45Å; P260-W276 HydrophobicContact CG-CZ2 3.88Å; P260-W276 HydrophobicContact CG-CZ3 3.55Å; P260-V304 HydrophobicContact CB-CG1 4.38Å; P260-V304 HydrophobicContact CG-CG1 3.97Å; P260-L305 HydrophobicContact CB-CD2 4.09Å
261	E	94.5	Very high	91.3	Very high	15 Å²	15	33.3 Å²	33.3	7%	0.07	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-31.3	178.7	67.9	-82.3	-159	0	0	112.8	A259 L264 E266 P331 R334	A259-E261 VanDerWaalsContact C-N 3.3Å; A259-E261 VanDerWaalsContact CB-CD 3.48Å; A259-E261 WeakPolarHBondContact CB-OE1 3.28Å; A259-E261 VanDerWaalsContact CB-OE2 3.23Å; A259-E261 WeakPolarHBondContact CB-OE2 3.47Å; A259-E261 PolarHBondContact O-N 3.31Å; E261-L264 PolarHBondContact O-N 3.23Å; E261-E266 PolarHBondContact O-N 2.86Å; E261-P331 HydrophobicContact CB-CG 4.44Å; E261-P331 HydrophobicContact CG-CG 4.2Å; E261-R334 IonicContact OE1-CZ 3.73Å; E261-R334 IonicContact OE1-NH1 2.7Å; E261-R334 PolarHBondContact OE1-NH1 3.46Å; E261-R334 IonicContact OE1-NH2 2.71Å; E261-R334 IonicContact OE2-CZ 2.8Å; E261-R334 IonicContact OE2-NH1 2.75Å; E261-R334 PolarHBondContact OE2-NH1 3.39Å; E261-R334 IonicContact OE2-NH2 2.74Å; E261-R334 PolarHBondContact OE2-NH2 2.98Å
262	I	92.9	Very high	92	Very high	14 Å²	14	30 Å²	30	7%	0.072	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-53.1	170.7	-60.5	178	0	0	0	108.1	W251 A258 A259 P260 L264 G265 Y268 A273	W251-I262 HydrophobicContact CD2-CG2 3.88Å; W251-I262 VanDerWaalsContact CD2-O 3.3Å; W251-I262 HydrophobicContact CE3-CG2 3.62Å; W251-I262 HydrophobicContact CG-CG2 4.23Å; W251-I262 WeakPolarHBondContact CH2-O 3.29Å; W251-I262 WeakPolarHBondContact CZ2-O 3.33Å; W251-I262 HydrophobicContact CZ3-CG2 4.35Å; W251-I262 WeakPolarHBondContact CZ3-O 3.46Å; A258-I262 HydrophobicContact CB-CD1 4.32Å; A258-I262 HydrophobicContact CB-CG2 4.43Å; A259-I262 HydrophobicContact CB-CD1 4.43Å; A259-I262 HydrophobicContact CB-CG1 4.44Å; A259-I262 WeakPolarHBondContact O-CB 3.19Å; A259-I262 PolarHBondContact O-N 2.8Å; P260-I262 VanDerWaalsContact C-N 3.28Å; P260-I262 PolarHBondContact O-N 2.9Å; I262-L264 PolarHBondContact O-N 2.93Å; I262-G265 PolarHBondContact O-N 2.87Å; I262-Y268 HydrophobicContact CG1-CD1 4.23Å; I262-Y268 HydrophobicContact CG1-CD2 4.47Å; I262-Y268 HydrophobicContact CG1-CE1 4.39Å; I262-Y268 HydrophobicContact CG1-CG 4.29Å; I262-A273 HydrophobicContact CD1-CB 4.17Å
263	F	90.8	Very high	92.6	Very high	11 Å²	11	29.2 Å²	29.2	5%	0.048	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-15.9	178.8	-80.1	-82.5	0	0	0	115.6	P255 A258 A259 P260 L297 L300 K301 V304 L305	P255-F263 HydrophobicContact CB-CZ 4.11Å; P255-F263 WeakPolarHBondContact O-CE2 3.47Å; P255-F263 WeakPolarHBondContact O-CZ 3.45Å; A258-F263 HydrophobicContact CB-CD2 4.36Å; A258-F263 HydrophobicContact CB-CE2 3.83Å; A259-F263 PolarHBondContact O-N 3.35Å; P260-F263 WeakPolarHBondContact O-CB 3.16Å; P260-F263 PolarHBondContact O-N 3.45Å; P260-F263 VanDerWaalsContact O-N 3.12Å; F263-L297 HydrophobicContact CE1-CD1 3.92Å; F263-L300 HydrophobicContact CZ-CD2 4.39Å; F263-L300 HydrophobicContact CZ-CG 4.38Å; F263-K301 HydrophobicContact CB-CD 4.41Å; F263-K301 HydrophobicContact CB-CG 4.23Å; F263-K301 HydrophobicContact CD1-CB 3.76Å; F263-K301 HydrophobicContact CD1-CD 4.13Å; F263-K301 HydrophobicContact CD1-CG 3.89Å; F263-K301 HydrophobicContact CE1-CB 4.06Å; F263-K301 HydrophobicContact CG-CG 4.35Å; F263-K301 WeakPolarHBondContact O-CE 3.36Å; F263-K301 PolarHBondContact O-NZ 3.09Å; F263-V304 HydrophobicContact CD2-CB 4.14Å; F263-V304 HydrophobicContact CD2-CG1 3.6Å; F263-V304 HydrophobicContact CE2-CB 4.05Å; F263-V304 HydrophobicContact CE2-CG1 3.77Å; F263-V304 HydrophobicContact CE2-CG2 3.94Å; F263-V304 HydrophobicContact CZ-CG2 4.41Å; F263-L305 HydrophobicContact CB-CD2 4.24Å
264	L	90.7	Very high	93.5	Very high	99 Å²	99	28 Å²	28	52%	0.518	16%	0.164	S	C	.	.	H	α-helix	trans	-86.8	-27.8	179.9	-71.7	173.6	0	0	0	113.8	P260 E261 I262 E266 L305	P260-L264 WeakPolarHBondContact O-CG 3.21Å; P260-L264 PolarHBondContact O-N 3.45Å; P260-L264 VanDerWaalsContact O-N 3.16Å; E261-L264 PolarHBondContact O-N 3.23Å; I262-L264 PolarHBondContact O-N 2.93Å; L264-E266 HydrophobicContact CB-CG 4Å; L264-L305 HydrophobicContact CD1-CD2 4.34Å; L264-L305 HydrophobicContact CD2-CD1 4.21Å; L264-L305 HydrophobicContact CD2-CD2 3.7Å; L264-L305 HydrophobicContact CG-CD2 3.74Å
265	G	87.7	Confident	94	Very high	41 Å²	41	26.9 Å²	26.9	42%	0.423	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	107	-8.7	-171.3	0	0	0	0	0	114.6	W251 I262	W251-G265 VanDerWaalsContact CZ2-N 3.28Å; I262-G265 PolarHBondContact O-N 2.87Å
266	E	87.1	Confident	94.3	Very high	111 Å²	111	24.6 Å²	24.6	52%	0.519	14%	0.142	S	C	.	.			trans	-78.9	147.8	-165.9	-60.4	-55.6	149.1	0	0	113	E261 L264 Y268	E261-E266 PolarHBondContact O-N 2.86Å; L264-E266 HydrophobicContact CB-CG 4Å; E266-Y268 PolarHBondContact O-N 3.18Å
267	P	91.9	Very high	94.5	Very high	61 Å²	61	23.7 Å²	23.7	40%	0.396	14%	0.136	S	C	.	.			trans	-57	122.9	165.5	-20.6	32.2	0	0	0	110.4	L247 L248 T249	L247-P267 HydrophobicContact CB-CB 3.98Å; L247-P267 HydrophobicContact CD1-CB 4.2Å; L247-P267 HydrophobicContact CG-CB 4.49Å; L248-P267 CarbonylContact O-C 3.57Å; L248-P267 WeakPolarHBondContact O-CA 3.27Å; T249-P267 HydrophobicContact CG2-CB 4.21Å; T249-P267 HydrophobicContact CG2-CG 4.26Å
268	Y	93.9	Very high	94.6	Very high	5 Å²	5	23.4 Å²	23.4	2%	0.02	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	152.9	-170.6	65.6	-87.2	0	0	0	112.8	R215 L247 L248 T250 I262 E266 G270 A273	R215-Y268 PolarHBondContact NH1-OH 2.91Å; L247-Y268 WeakPolarHBondContact CA-O 3.2Å; L248-Y268 HydrophobicContact CB-CD2 4.47Å; L248-Y268 HydrophobicContact CB-CE1 4.07Å; L248-Y268 HydrophobicContact CB-CE2 4Å; L248-Y268 HydrophobicContact CD1-CE2 4.1Å; L248-Y268 PolarHBondContact N-O 2.96Å; L248-Y268 WeakPolarHBondContact O-CD1 3.41Å; L248-Y268 WeakPolarHBondContact O-CE1 3.1Å; L248-Y268 PolarHBondContact O-N 3.44Å; T250-Y268 WeakPolarHBondContact O-CE1 3.21Å; T250-Y268 PolarHBondContact O-OH 3.48Å; I262-Y268 HydrophobicContact CG1-CD1 4.23Å; I262-Y268 HydrophobicContact CG1-CD2 4.47Å; I262-Y268 HydrophobicContact CG1-CE1 4.39Å; I262-Y268 HydrophobicContact CG1-CG 4.29Å; E266-Y268 PolarHBondContact O-N 3.18Å; Y268-G270 PolarHBondContact O-N 3.12Å; Y268-A273 HydrophobicContact CD2-CB 3.91Å; Y268-A273 HydrophobicContact CE2-CB 4.19Å
269	I	95.2	Very high	94.8	Very high	42 Å²	42	23 Å²	23	22%	0.215	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	109.2	172.2	-61.6	175.1	0	0	0	108.3	P244 L247 V271 K272 A273	P244-I269 WeakPolarHBondContact O-CG2 3.46Å; L247-I269 HydrophobicContact CD2-CG1 3.79Å; I269-V271 VanDerWaalsContact C-N 3.26Å; I269-V271 HydrophobicContact CG2-CB 4.33Å; I269-V271 PolarHBondContact O-N 3.45Å; I269-V271 VanDerWaalsContact O-N 3.16Å; I269-K272 HydrophobicContact CB-CB 4.28Å; I269-K272 HydrophobicContact CB-CG 4.1Å; I269-K272 HydrophobicContact CG2-CB 4.4Å; I269-K272 HydrophobicContact CG2-CG 3.94Å; I269-K272 PolarHBondContact O-N 3Å; I269-A273 PolarHBondContact O-N 3.44Å; I269-A273 VanDerWaalsContact O-N 3.13Å
270	G	94.7	Very high	94.9	Very high	3 Å²	3	23 Å²	23	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-53.8	-39.3	-174.8	0	0	0	0	0	114.3	Y268 K272 A273 D274	Y268-G270 PolarHBondContact O-N 3.12Å; G270-K272 VanDerWaalsContact C-N 3.32Å; G270-K272 PolarHBondContact O-N 3.4Å; G270-A273 PolarHBondContact O-N 2.82Å; G270-D274 PolarHBondContact O-N 3Å
271	V	96.5	Very high	95.1	Very high	22 Å²	22	22.5 Å²	22.5	13%	0.133	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-42.1	175.8	169	0	0	0	0	111.3	V213 F241 I269 D274 I275	V213-V271 HydrophobicContact CG1-CB 4.45Å; V213-V271 HydrophobicContact CG1-CG2 3.7Å; F241-V271 HydrophobicContact CE1-CG2 3.89Å; F241-V271 HydrophobicContact CE2-CG2 4.46Å; F241-V271 HydrophobicContact CZ-CG2 3.78Å; I269-V271 VanDerWaalsContact C-N 3.26Å; I269-V271 HydrophobicContact CG2-CB 4.33Å; I269-V271 PolarHBondContact O-N 3.45Å; I269-V271 VanDerWaalsContact O-N 3.16Å; V271-D274 PolarHBondContact O-N 2.57Å; V271-I275 WeakPolarHBondContact O-CG1 3.47Å; V271-I275 PolarHBondContact O-N 3.41Å; V271-I275 VanDerWaalsContact O-N 3.16Å
272	K	97.2	Very high	95.2	Very high	36 Å²	36	21.8 Å²	21.8	16%	0.157	13%	0.125	C	C	.	.	H	α-helix	trans	-74.8	-27.6	-179.7	-62.5	-53.8	-163.2	106.2	0	112.8	I269 G270 W276 P331 S332 R334	I269-K272 HydrophobicContact CB-CB 4.28Å; I269-K272 HydrophobicContact CB-CG 4.1Å; I269-K272 HydrophobicContact CG2-CB 4.4Å; I269-K272 HydrophobicContact CG2-CG 3.94Å; I269-K272 PolarHBondContact O-N 3Å; G270-K272 VanDerWaalsContact C-N 3.32Å; G270-K272 PolarHBondContact O-N 3.4Å; K272-W276 PolarHBondContact O-N 2.94Å; K272-P331 HydrophobicContact CB-CB 4.01Å; K272-P331 WeakPolarHBondContact CD-O 2.92Å; K272-P331 WeakPolarHBondContact CE-O 3.2Å; K272-P331 HydrophobicContact CG-CB 4.34Å; K272-P331 WeakPolarHBondContact CG-O 3.18Å; K272-P331 PolarHBondContact NZ-O 2.85Å; K272-S332 PolarHBondContact NZ-O 3.31Å; K272-R334 HydrophobicContact CD-CB 4.4Å; K272-R334 PolarHBondContact NZ-O 2.98Å; K272-R334 WeakPolarHBondContact O-CD 3.17Å; K272-R334 PolarHBondContact O-NH1 2.77Å
273	A	96.6	Very high	95.5	Very high	3 Å²	3	21.9 Å²	21.9	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-67.2	-46.4	170.2	0	0	0	0	0	111	A259 I262 Y268 I269 G270 I275 W276 S277	A259-A273 HydrophobicContact CB-CB 4.34Å; I262-A273 HydrophobicContact CD1-CB 4.17Å; Y268-A273 HydrophobicContact CD2-CB 3.91Å; Y268-A273 HydrophobicContact CE2-CB 4.19Å; I269-A273 PolarHBondContact O-N 3.44Å; I269-A273 VanDerWaalsContact O-N 3.13Å; G270-A273 PolarHBondContact O-N 2.82Å; A273-I275 VanDerWaalsContact C-N 3.27Å; A273-I275 PolarHBondContact O-N 2.68Å; A273-W276 WeakPolarHBondContact O-CB 3.33Å; A273-W276 PolarHBondContact O-N 3.42Å; A273-S277 PolarHBondContact O-N 3.49Å; A273-S277 VanDerWaalsContact O-N 3.13Å; A273-S277 PolarHBondContact O-OG 3.22Å
274	D	97.7	Very high	95.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.3	-38	174.5	-78.2	-13.6	0	0	0	111.9	H208 H214 R215 L217 G270 V271 W276 S277 L278	H208-D274 IonicContact CD2-OD2 3.34Å; H208-D274 IonicContact CE1-OD2 2.76Å; H208-D274 IonicContact NE2-OD2 2.63Å; H208-D274 PolarHBondContact NE2-OD2 2.88Å; H214-D274 PolarHBondContact N-OD2 3.11Å; R215-D274 WeakPolarHBondContact CA-OD1 3.01Å; R215-D274 PolarHBondContact N-OD1 3.01Å; L217-D274 HydrophobicContact CD1-CB 3.68Å; G270-D274 PolarHBondContact O-N 3Å; V271-D274 PolarHBondContact O-N 2.57Å; D274-W276 PolarHBondContact O-N 2.8Å; D274-S277 PolarHBondContact O-N 2.8Å; D274-L278 WeakPolarHBondContact O-CG 3.21Å; D274-L278 PolarHBondContact O-N 2.85Å
275	I	98.4	Very high	96.2	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-38.7	173.8	-61.9	-52.3	0	0	0	112.6	V271 A273 L278 G279 M326 R334 T337 I340	V271-I275 WeakPolarHBondContact O-CG1 3.47Å; V271-I275 PolarHBondContact O-N 3.41Å; V271-I275 VanDerWaalsContact O-N 3.16Å; A273-I275 VanDerWaalsContact C-N 3.27Å; A273-I275 PolarHBondContact O-N 2.68Å; I275-L278 HydrophobicContact CD1-CD1 4.06Å; I275-L278 WeakPolarHBondContact O-CB 3.03Å; I275-L278 PolarHBondContact O-N 2.81Å; I275-G279 PolarHBondContact O-N 2.91Å; I275-G279 VanDerWaalsContact O-N 3.11Å; I275-M326 HydrophobicContact CG2-CB 4.13Å; I275-M326 HydrophobicContact CG2-CG 3.92Å; I275-R334 HydrophobicContact CB-CB 4.47Å; I275-R334 HydrophobicContact CG2-CB 3.94Å; I275-T337 HydrophobicContact CD1-CG2 3.9Å; I275-I340 HydrophobicContact CD1-CD1 3.91Å; I275-I340 HydrophobicContact CG2-CD1 4.07Å
276	W	98.2	Very high	96.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-47.5	176	172.9	-82.6	0	0	0	110.9	A258 A259 P260 K272 A273 D274 L278 G279 V280 F292 V304 A307 L327	A258-W276 PolarHBondContact O-NE1 3.08Å; A259-W276 HydrophobicContact CB-CB 3.78Å; A259-W276 HydrophobicContact CB-CD2 4.26Å; A259-W276 HydrophobicContact CB-CG 3.71Å; P260-W276 HydrophobicContact CG-CD2 4.47Å; P260-W276 HydrophobicContact CG-CE3 4.08Å; P260-W276 HydrophobicContact CG-CH2 3.45Å; P260-W276 VanDerWaalsContact CG-CH2 3.45Å; P260-W276 HydrophobicContact CG-CZ2 3.88Å; P260-W276 HydrophobicContact CG-CZ3 3.55Å; K272-W276 PolarHBondContact O-N 2.94Å; A273-W276 WeakPolarHBondContact O-CB 3.33Å; A273-W276 PolarHBondContact O-N 3.42Å; D274-W276 PolarHBondContact O-N 2.8Å; W276-L278 VanDerWaalsContact C-N 3.28Å; W276-L278 PolarHBondContact O-N 2.8Å; W276-G279 VanDerWaalsContact O-CA 3.32Å; W276-G279 WeakPolarHBondContact O-CA 3.28Å; W276-G279 PolarHBondContact O-N 2.83Å; W276-V280 PolarHBondContact O-N 2.88Å; W276-V280 VanDerWaalsContact O-N 3.09Å; W276-F292 AromaticContact CH2-CE2 3.97Å; W276-F292 HydrophobicContact CH2-CE2 3.97Å; W276-F292 AromaticContact CH2-CZ 3.94Å; W276-F292 HydrophobicContact CH2-CZ 3.94Å; W276-F292 HydrophobicContact CZ2-CD2 4.11Å; W276-F292 AromaticContact CZ2-CE2 3.31Å; W276-F292 HydrophobicContact CZ2-CE2 3.31Å; W276-F292 AromaticContact CZ2-CZ 3.76Å; W276-F292 HydrophobicContact CZ2-CZ 3.76Å; W276-V304 HydrophobicContact CZ2-CG1 3.89Å; W276-A307 HydrophobicContact CH2-CB 3.94Å; W276-A307 HydrophobicContact CZ3-CB 4.37Å; W276-L327 HydrophobicContact CD2-CD2 3.76Å; W276-L327 HydrophobicContact CE3-CB 4.4Å; W276-L327 HydrophobicContact CE3-CD2 4.06Å; W276-L327 HydrophobicContact CG-CD2 4.16Å; W276-L327 HydrophobicContact CH2-CB 4.49Å; W276-L327 HydrophobicContact CH2-CD2 4.48Å; W276-L327 HydrophobicContact CZ2-CD2 4.21Å; W276-L327 VanDerWaalsContact CZ3-C 3.48Å; W276-L327 HydrophobicContact CZ3-CB 4.19Å; W276-L327 HydrophobicContact CZ3-CD2 4.41Å; W276-L327 WeakPolarHBondContact CZ3-O 3.46Å; W276-L327 WeakPolarHBondContact O-CD2 3.36Å
277	S	98.3	Very high	97.1	Very high	9 Å²	9	10.2 Å²	10.2	6%	0.063	6%	0.058	C	C	.	.	H	α-helix	trans	-60.6	-36.6	177.7	-52.2	0	0	0	0	112.3	L217 Y257 A273 D274 G279 V280 I281	L217-S277 WeakPolarHBondContact O-CB 3.32Å; Y257-S277 WeakPolarHBondContact O-CB 3.43Å; Y257-S277 PolarHBondContact O-OG 3.44Å; A273-S277 PolarHBondContact O-N 3.49Å; A273-S277 VanDerWaalsContact O-N 3.13Å; A273-S277 PolarHBondContact O-OG 3.22Å; D274-S277 PolarHBondContact O-N 2.8Å; S277-G279 VanDerWaalsContact C-N 3.32Å; S277-G279 PolarHBondContact O-N 2.77Å; S277-V280 WeakPolarHBondContact O-CB 3.41Å; S277-V280 PolarHBondContact O-N 2.88Å; S277-V280 VanDerWaalsContact O-N 3.17Å; S277-I281 WeakPolarHBondContact O-CD1 3.48Å; S277-I281 WeakPolarHBondContact O-CG1 3.37Å; S277-I281 PolarHBondContact O-N 2.85Å
278	L	98.6	Very high	97.2	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60.4	-37.3	169.3	-77.2	174	0	0	0	113	F197 V200 L201 V204 L217 D274 I275 W276 I281 L282 M326	F197-L278 HydrophobicContact CE2-CD2 4.15Å; F197-L278 VanDerWaalsContact CE2-O 3.3Å; F197-L278 WeakPolarHBondContact CE2-O 3.14Å; F197-L278 HydrophobicContact CZ-CB 4.03Å; F197-L278 HydrophobicContact CZ-CD2 4.17Å; F197-L278 WeakPolarHBondContact CZ-O 3.31Å; V200-L278 HydrophobicContact CG1-CD2 3.5Å; L201-L278 HydrophobicContact CD2-CD1 4.04Å; V204-L278 HydrophobicContact CB-CD1 4.28Å; V204-L278 HydrophobicContact CG1-CD1 4.01Å; V204-L278 HydrophobicContact CG2-CD1 4.45Å; V204-L278 HydrophobicContact CG2-CD2 4.22Å; L217-L278 HydrophobicContact CD1-CD2 4.41Å; L217-L278 HydrophobicContact CD1-CG 4.09Å; D274-L278 WeakPolarHBondContact O-CG 3.21Å; D274-L278 PolarHBondContact O-N 2.85Å; I275-L278 HydrophobicContact CD1-CD1 4.06Å; I275-L278 WeakPolarHBondContact O-CB 3.03Å; I275-L278 PolarHBondContact O-N 2.81Å; W276-L278 VanDerWaalsContact C-N 3.28Å; W276-L278 PolarHBondContact O-N 2.8Å; L278-I281 HydrophobicContact CD2-CD1 4.45Å; L278-I281 PolarHBondContact O-N 2.79Å; L278-L282 PolarHBondContact O-N 2.91Å; L278-M326 HydrophobicContact CB-SD 3.88Å
279	G	98.4	Very high	97.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-60.2	-42.7	171.2	0	0	0	0	0	112.9	I275 W276 S277 Y283	I275-G279 PolarHBondContact O-N 2.91Å; I275-G279 VanDerWaalsContact O-N 3.11Å; W276-G279 VanDerWaalsContact O-CA 3.32Å; W276-G279 WeakPolarHBondContact O-CA 3.28Å; W276-G279 PolarHBondContact O-N 2.83Å; S277-G279 VanDerWaalsContact C-N 3.32Å; S277-G279 PolarHBondContact O-N 2.77Å; G279-Y283 PolarHBondContact O-N 2.98Å; G279-Y283 VanDerWaalsContact O-N 3.15Å
280	V	98.3	Very high	97.2	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64.9	-46.6	175.5	179.9	0	0	0	0	110.9	Y257 W276 S277 L282 Y283 V284 L290 P291 L327	Y257-V280 HydrophobicContact CD1-CB 3.81Å; Y257-V280 HydrophobicContact CD1-CG1 3.36Å; Y257-V280 HydrophobicContact CE1-CB 4.34Å; Y257-V280 HydrophobicContact CE1-CG1 3.6Å; Y257-V280 HydrophobicContact CG-CG1 4.08Å; W276-V280 PolarHBondContact O-N 2.88Å; W276-V280 VanDerWaalsContact O-N 3.09Å; S277-V280 WeakPolarHBondContact O-CB 3.41Å; S277-V280 PolarHBondContact O-N 2.88Å; S277-V280 VanDerWaalsContact O-N 3.17Å; V280-L282 PolarHBondContact O-N 3.35Å; V280-Y283 PolarHBondContact O-N 3.06Å; V280-V284 WeakPolarHBondContact O-CG2 3.36Å; V280-V284 PolarHBondContact O-N 3.45Å; V280-L290 HydrophobicContact CG1-CD2 3.91Å; V280-P291 HydrophobicContact CB-CG 4.28Å; V280-P291 HydrophobicContact CG1-CG 3.93Å; V280-P291 HydrophobicContact CG2-CG 4.07Å; V280-L327 HydrophobicContact CG2-CD2 3.85Å
281	I	98.4	Very high	97.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.9	-47.3	177.3	-69.8	157.6	0	0	0	111.4	F197 L217 I222 Y257 S277 L278 Y283 V284 M285	F197-I281 HydrophobicContact CD2-CG2 4.38Å; F197-I281 HydrophobicContact CE2-CB 4.46Å; F197-I281 HydrophobicContact CE2-CG2 4.18Å; L217-I281 HydrophobicContact CB-CD1 3.91Å; I222-I281 HydrophobicContact CD1-CD1 3.88Å; I222-I281 HydrophobicContact CD1-CG1 4.35Å; I222-I281 HydrophobicContact CD1-CG2 3.84Å; Y257-I281 HydrophobicContact CD1-CG1 4.22Å; Y257-I281 HydrophobicContact CE1-CG1 3.99Å; S277-I281 WeakPolarHBondContact O-CD1 3.48Å; S277-I281 WeakPolarHBondContact O-CG1 3.37Å; S277-I281 PolarHBondContact O-N 2.85Å; L278-I281 HydrophobicContact CD2-CD1 4.45Å; L278-I281 PolarHBondContact O-N 2.79Å; I281-Y283 VanDerWaalsContact C-N 3.31Å; I281-Y283 PolarHBondContact O-N 3.08Å; I281-V284 PolarHBondContact O-N 3.21Å; I281-M285 HydrophobicContact CG2-CG 4.45Å; I281-M285 HydrophobicContact CG2-SD 3.9Å; I281-M285 VanDerWaalsContact O-CG 3.31Å; I281-M285 WeakPolarHBondContact O-CG 3.38Å; I281-M285 PolarHBondContact O-N 3.27Å
282	L	98.3	Very high	97.2	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-59.9	-44.1	178.5	-179.9	55.6	0	0	0	111.3	F197 L278 V280 M285 V286 V322 I323 M326 W345	F197-L282 HydrophobicContact CB-CD1 4.28Å; F197-L282 HydrophobicContact CD1-CD1 4.28Å; F197-L282 HydrophobicContact CD1-CD2 4.44Å; F197-L282 HydrophobicContact CD2-CB 3.98Å; F197-L282 HydrophobicContact CD2-CD1 4.1Å; F197-L282 HydrophobicContact CE1-CB 4.33Å; F197-L282 HydrophobicContact CE1-CD2 4.19Å; F197-L282 HydrophobicContact CE2-CB 3.6Å; F197-L282 HydrophobicContact CG-CD1 3.96Å; F197-L282 HydrophobicContact CZ-CB 3.78Å; F197-L282 HydrophobicContact CZ-CD2 4.4Å; L278-L282 PolarHBondContact O-N 2.91Å; V280-L282 PolarHBondContact O-N 3.35Å; L282-M285 PolarHBondContact O-N 2.84Å; L282-V286 HydrophobicContact CD1-CG1 4.06Å; L282-V286 WeakPolarHBondContact O-CG2 3.38Å; L282-V286 PolarHBondContact O-N 3.35Å; L282-V286 VanDerWaalsContact O-N 3.08Å; L282-V322 HydrophobicContact CD2-CB 4.34Å; L282-V322 HydrophobicContact CD2-CG1 3.63Å; L282-I323 HydrophobicContact CB-CG1 4.35Å; L282-I323 HydrophobicContact CD2-CD1 4.45Å; L282-I323 HydrophobicContact CD2-CG1 3.67Å; L282-I323 HydrophobicContact CG-CD1 4.19Å; L282-I323 HydrophobicContact CG-CG1 3.84Å; L282-M326 HydrophobicContact CB-CE 3.98Å; L282-M326 HydrophobicContact CD2-CE 3.6Å; L282-M326 HydrophobicContact CG-CE 4.45Å; L282-W345 HydrophobicContact CD1-CH2 3.6Å; L282-W345 HydrophobicContact CD1-CZ3 3.86Å; L282-W345 HydrophobicContact CD2-CZ3 4.3Å
283	Y	98.3	Very high	96.9	Very high	16 Å²	16	10.2 Å²	10.2	6%	0.063	7%	0.065	C	C	.	.	H	α-helix	trans	-59.9	-47.4	176.1	-176.2	-81.5	0	0	0	111.3	G279 V280 I281 M285 V286 C287 A289 L290 P291 F309 R310 I323	G279-Y283 PolarHBondContact O-N 2.98Å; G279-Y283 VanDerWaalsContact O-N 3.15Å; V280-Y283 PolarHBondContact O-N 3.06Å; I281-Y283 VanDerWaalsContact C-N 3.31Å; I281-Y283 PolarHBondContact O-N 3.08Å; Y283-M285 VanDerWaalsContact C-N 3.29Å; Y283-M285 PolarHBondContact O-N 3.05Å; Y283-V286 PolarHBondContact O-N 3.32Å; Y283-C287 HydrophobicContact CD1-CB 4.02Å; Y283-C287 HydrophobicContact CE1-CB 3.72Å; Y283-C287 HydrophobicContact CE2-CB 4.32Å; Y283-C287 HydrophobicContact CG-CB 4.45Å; Y283-C287 WeakPolarHBondContact O-CB 3.36Å; Y283-C287 PolarHBondContact O-N 3.45Å; Y283-A289 WeakPolarHBondContact CD1-O 3.42Å; Y283-A289 WeakPolarHBondContact CE1-O 3.34Å; Y283-L290 VanDerWaalsContact CE1-C 3.42Å; Y283-L290 WeakPolarHBondContact CE1-O 3.15Å; Y283-P291 HydrophobicContact CD1-CB 3.66Å; Y283-P291 HydrophobicContact CD1-CG 4.02Å; Y283-P291 HydrophobicContact CD2-CB 4.05Å; Y283-P291 VanDerWaalsContact CE1-CA 3.45Å; Y283-P291 HydrophobicContact CE1-CB 3.89Å; Y283-P291 HydrophobicContact CE2-CB 4.25Å; Y283-P291 HydrophobicContact CG-CB 3.75Å; Y283-P291 HydrophobicContact CG-CG 4.17Å; Y283-F309 HydrophobicContact CD2-CD2 4.05Å; Y283-F309 HydrophobicContact CD2-CE2 4.31Å; Y283-F309 AromaticContact CE2-CD2 3.79Å; Y283-F309 HydrophobicContact CE2-CD2 3.79Å; Y283-F309 HydrophobicContact CE2-CE2 4.36Å; Y283-R310 WeakPolarHBondContact CE2-O 3.47Å; Y283-R310 PolarHBondContact OH-O 3.43Å; Y283-R310 VanDerWaalsContact OH-O 3.07Å; Y283-I323 HydrophobicContact CD2-CD1 4.31Å; Y283-I323 HydrophobicContact CD2-CG2 4.35Å
284	V	97.7	Very high	96.5	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.006	7%	0.07	C	C	.	.	H	α-helix	trans	-56.5	-43	175.6	171.4	0	0	0	0	111.3	I182 A219 V280 I281 G288 A289 L290	I182-V284 HydrophobicContact CD1-CG1 4.04Å; A219-V284 HydrophobicContact CB-CG1 4.43Å; V280-V284 WeakPolarHBondContact O-CG2 3.36Å; V280-V284 PolarHBondContact O-N 3.45Å; I281-V284 PolarHBondContact O-N 3.21Å; V284-G288 VanDerWaalsContact O-CA 3.27Å; V284-G288 WeakPolarHBondContact O-CA 3Å; V284-G288 PolarHBondContact O-N 3.17Å; V284-A289 WeakPolarHBondContact CA-O 3.12Å; V284-L290 HydrophobicContact CG2-CD2 3.76Å; V284-L290 HydrophobicContact CG2-CG 4.32Å
285	M	97.9	Very high	95.9	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-63	-43	178.6	-68.7	171.1	73.9	0	0	113.7	L178 I182 F188 A193 K196 F197 I281 L282 Y283	L178-M285 HydrophobicContact CD2-CG 4.05Å; L178-M285 HydrophobicContact CD2-SD 4.09Å; I182-M285 HydrophobicContact CD1-CG 4.1Å; F188-M285 HydrophobicContact CD2-CB 4.3Å; F188-M285 PolarHBondContact N-O 2.71Å; A193-M285 HydrophobicContact CB-CB 4.32Å; A193-M285 HydrophobicContact CB-CE 4.43Å; A193-M285 WeakPolarHBondContact O-CE 3.14Å; K196-M285 HydrophobicContact CB-CE 3.53Å; F197-M285 HydrophobicContact CB-CE 4.25Å; F197-M285 HydrophobicContact CB-SD 4.36Å; F197-M285 HydrophobicContact CD2-SD 3.87Å; I281-M285 HydrophobicContact CG2-CG 4.45Å; I281-M285 HydrophobicContact CG2-SD 3.9Å; I281-M285 VanDerWaalsContact O-CG 3.31Å; I281-M285 WeakPolarHBondContact O-CG 3.38Å; I281-M285 PolarHBondContact O-N 3.27Å; L282-M285 PolarHBondContact O-N 2.84Å; Y283-M285 VanDerWaalsContact C-N 3.29Å; Y283-M285 PolarHBondContact O-N 3.05Å
286	V	97.3	Very high	95.6	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-93.8	-21.6	-173.8	-57.9	0	0	0	0	114.2	R187 E190 A193 L282 Y283 L315 I323 W345	R187-V286 VanDerWaalsContact CD-O 3.3Å; R187-V286 WeakPolarHBondContact CD-O 3.18Å; R187-V286 PolarHBondContact NH1-O 2.65Å; E190-V286 HydrophobicContact CG-CG1 4.45Å; A193-V286 HydrophobicContact CB-CG1 3.57Å; L282-V286 HydrophobicContact CD1-CG1 4.06Å; L282-V286 WeakPolarHBondContact O-CG2 3.38Å; L282-V286 PolarHBondContact O-N 3.35Å; L282-V286 VanDerWaalsContact O-N 3.08Å; Y283-V286 PolarHBondContact O-N 3.32Å; V286-L315 HydrophobicContact CB-CD1 3.97Å; V286-L315 HydrophobicContact CG2-CD1 3.52Å; V286-I323 HydrophobicContact CG2-CD1 3.97Å; V286-W345 HydrophobicContact CG1-CZ2 4.42Å
287	C	96.8	Very high	95.1	Very high	15 Å²	15	26.9 Å²	26.9	10%	0.101	15%	0.153	C	C	.	.	H	α-helix	trans	-105.4	-27.5	179.9	-65	0	0	0	0	113.4	Y283 A289	Y283-C287 HydrophobicContact CD1-CB 4.02Å; Y283-C287 HydrophobicContact CE1-CB 3.72Å; Y283-C287 HydrophobicContact CE2-CB 4.32Å; Y283-C287 HydrophobicContact CG-CB 4.45Å; Y283-C287 WeakPolarHBondContact O-CB 3.36Å; Y283-C287 PolarHBondContact O-N 3.45Å; C287-A289 VanDerWaalsContact C-N 3.35Å
288	G	95.3	Very high	94.8	Very high	18 Å²	18	30.5 Å²	30.5	19%	0.186	18%	0.176	C	C	.	.	S	Bend	trans	75.1	22.6	-177.6	0	0	0	0	0	114.1	V284 L574	V284-G288 VanDerWaalsContact O-CA 3.27Å; V284-G288 WeakPolarHBondContact O-CA 3Å; V284-G288 PolarHBondContact O-N 3.17Å; G288-L574 WeakPolarHBondContact O-CD1 3.22Å; G288-L574 WeakPolarHBondContact O-CG 3.38Å
289	A	94.3	Very high	94.5	Very high	31 Å²	31	36 Å²	36	26%	0.256	20%	0.202	S	C	.	.	S	Bend	trans	-154.2	163.5	179.2	0	0	0	0	0	109	Y283 V284 C287	Y283-A289 WeakPolarHBondContact CD1-O 3.42Å; Y283-A289 WeakPolarHBondContact CE1-O 3.34Å; V284-A289 WeakPolarHBondContact CA-O 3.12Å; C287-A289 VanDerWaalsContact C-N 3.35Å
290	L	95.1	Very high	94.3	Very high	20 Å²	20	36.6 Å²	36.6	11%	0.105	20%	0.204	C	C	.	.			trans	-73.3	149	172.3	-73.9	162.3	0	0	0	111.4	P256 Y257 V280 Y283 V284 D293 I577	P256-L290 HydrophobicContact CB-CD1 3.91Å; P256-L290 HydrophobicContact CB-CD2 4.04Å; P256-L290 HydrophobicContact CG-CD1 4.37Å; Y257-L290 HydrophobicContact CE1-CD2 4.41Å; Y257-L290 HydrophobicContact CE2-CD2 4.31Å; V280-L290 HydrophobicContact CG1-CD2 3.91Å; Y283-L290 VanDerWaalsContact CE1-C 3.42Å; Y283-L290 WeakPolarHBondContact CE1-O 3.15Å; V284-L290 HydrophobicContact CG2-CD2 3.76Å; V284-L290 HydrophobicContact CG2-CG 4.32Å; L290-D293 HydrophobicContact CB-CB 4.24Å; L290-I577 HydrophobicContact CD1-CD1 4.45Å
291	P	96.2	Very high	94	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.065	22%	0.22	C	C	.	.	S	Bend	trans	-75.5	-29.4	174.8	28.7	-30.8	0	0	0	112.5	V280 Y283 F309 L327	V280-P291 HydrophobicContact CB-CG 4.28Å; V280-P291 HydrophobicContact CG1-CG 3.93Å; V280-P291 HydrophobicContact CG2-CG 4.07Å; Y283-P291 HydrophobicContact CD1-CB 3.66Å; Y283-P291 HydrophobicContact CD1-CG 4.02Å; Y283-P291 HydrophobicContact CD2-CB 4.05Å; Y283-P291 VanDerWaalsContact CE1-CA 3.45Å; Y283-P291 HydrophobicContact CE1-CB 3.89Å; Y283-P291 HydrophobicContact CE2-CB 4.25Å; Y283-P291 HydrophobicContact CG-CB 3.75Å; Y283-P291 HydrophobicContact CG-CG 4.17Å; P291-F309 HydrophobicContact CB-CB 3.78Å; P291-F309 HydrophobicContact CB-CG 4.22Å; P291-F309 WeakPolarHBondContact O-CB 3.41Å; P291-L327 HydrophobicContact CB-CD1 4.3Å; P291-L327 HydrophobicContact CG-CD1 4.35Å
292	F	95	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-127.6	121	176	-43.3	-67.6	0	0	0	107.4	W276 L300 Q303 V304 F309 L327	W276-F292 AromaticContact CH2-CE2 3.97Å; W276-F292 HydrophobicContact CH2-CE2 3.97Å; W276-F292 AromaticContact CH2-CZ 3.94Å; W276-F292 HydrophobicContact CH2-CZ 3.94Å; W276-F292 HydrophobicContact CZ2-CD2 4.11Å; W276-F292 AromaticContact CZ2-CE2 3.31Å; W276-F292 HydrophobicContact CZ2-CE2 3.31Å; W276-F292 AromaticContact CZ2-CZ 3.76Å; W276-F292 HydrophobicContact CZ2-CZ 3.76Å; F292-L300 HydrophobicContact CB-CD1 3.98Å; F292-Q303 HydrophobicContact CB-CB 4.26Å; F292-Q303 HydrophobicContact CD1-CB 4.23Å; F292-V304 HydrophobicContact CB-CG2 3.89Å; F292-V304 HydrophobicContact CD2-CG2 4.02Å; F292-V304 HydrophobicContact CG-CG2 3.95Å; F292-F309 HydrophobicContact CD1-CB 4.39Å; F292-F309 HydrophobicContact CE1-CB 3.87Å; F292-F309 HydrophobicContact CE1-CD1 4.16Å; F292-F309 HydrophobicContact CE1-CG 4.5Å; F292-F309 HydrophobicContact CZ-CB 4.34Å; F292-F309 HydrophobicContact CZ-CD1 4.01Å; F292-L327 HydrophobicContact CE2-CD1 4.14Å; F292-L327 HydrophobicContact CE2-CD2 4.29Å; F292-L327 HydrophobicContact CZ-CD1 4.17Å
293	D	89.2	Confident	93.5	Very high	89 Å²	89	48 Å²	48	48%	0.476	26%	0.26	S	S	.	.			trans	-150.2	132.5	-178.1	-175	15.9	0	0	0	109.9	L290 Q303	L290-D293 HydrophobicContact CB-CB 4.24Å; D293-Q303 PolarHBondContact O-NE2 3.13Å; D293-Q303 PolarHBondContact O-OE1 3.37Å
294	A	88.8	Confident	93.3	Very high	16 Å²	16	47.2 Å²	47.2	13%	0.132	26%	0.257	C	S	.	.			trans	-160.6	142.3	177.1	0	0	0	0	0	110.9	S296 H299 L300	A294-S296 PolarHBondContact O-N 2.68Å; A294-S296 VanDerWaalsContact O-N 3.07Å; A294-H299 HydrophobicContact CB-CB 3.66Å; A294-L300 HydrophobicContact CB-CB 4.17Å
295	Q	85.8	Confident	93.2	Very high	189 Å²	189	49.4 Å²	49.4	88%	0.883	27%	0.268	S	S	*	.	S	Bend	trans	-62.9	-15.3	179.1	-67.5	179.6	-12.9	0	0	114.8	M580	Q295-M580 VanDerWaalsContact O-CE 3.31Å; Q295-M580 WeakPolarHBondContact O-CE 3.14Å
296	S	90.7	Very high	93	Very high	48 Å²	48	51.8 Å²	51.8	34%	0.336	29%	0.285	S	S	.	.	S	Bend	trans	-134.3	140.4	-179.8	60.3	0	0	0	0	111.7	A294 P298 H299 L300	A294-S296 PolarHBondContact O-N 2.68Å; A294-S296 VanDerWaalsContact O-N 3.07Å; S296-P298 VanDerWaalsContact C-CD 3.46Å; S296-H299 PolarHBondContact O-N 3.37Å; S296-H299 PolarHBondContact OG-ND1 2.92Å; S296-L300 PolarHBondContact O-N 3.1Å
297	L	89.3	Confident	92.8	Very high	102 Å²	102	52.6 Å²	52.6	53%	0.534	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-38	-176	-170.2	64	0	0	0	114.2	P255 F263 H299 L300 K301	P255-L297 HydrophobicContact CB-CD1 4.07Å; P255-L297 HydrophobicContact CG-CD1 4.45Å; F263-L297 HydrophobicContact CE1-CD1 3.92Å; L297-H299 PolarHBondContact O-N 3.38Å; L297-L300 HydrophobicContact CD1-CD2 4.44Å; L297-L300 PolarHBondContact O-N 2.7Å; L297-K301 VanDerWaalsContact O-CB 3.31Å; L297-K301 WeakPolarHBondContact O-CB 3.5Å; L297-K301 PolarHBondContact O-N 3.41Å
298	P	91.7	Very high	92.4	Very high	84 Å²	84	56 Å²	56	55%	0.545	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-38	175.2	-23.7	35.7	0	0	0	113.3	S296 N302	S296-P298 VanDerWaalsContact C-CD 3.46Å; P298-N302 WeakPolarHBondContact O-CB 3.39Å; P298-N302 PolarHBondContact O-N 3.37Å; P298-N302 PolarHBondContact O-ND2 2.99Å
299	H	92.1	Very high	92.3	Very high	117 Å²	117	56 Å²	56	54%	0.542	31%	0.31	S	S	.	.	H	α-helix	trans	-72	-37.9	177	-72.6	88.5	0	0	0	111.6	A294 S296 L297 N302 Q303	A294-H299 HydrophobicContact CB-CB 3.66Å; S296-H299 PolarHBondContact O-N 3.37Å; S296-H299 PolarHBondContact OG-ND1 2.92Å; L297-H299 PolarHBondContact O-N 3.38Å; H299-N302 PolarHBondContact O-N 2.92Å; H299-Q303 PolarHBondContact O-N 3.4Å
300	L	93.1	Very high	92.3	Very high	11 Å²	11	64.8 Å²	64.8	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-48.4	173	-178.6	61.9	0	0	0	110.8	P255 P256 F263 F292 A294 S296 L297 N302 Q303 V304	P255-L300 HydrophobicContact CB-CD2 3.88Å; P256-L300 HydrophobicContact CG-CD2 4.29Å; F263-L300 HydrophobicContact CZ-CD2 4.39Å; F263-L300 HydrophobicContact CZ-CG 4.38Å; F292-L300 HydrophobicContact CB-CD1 3.98Å; A294-L300 HydrophobicContact CB-CB 4.17Å; S296-L300 PolarHBondContact O-N 3.1Å; L297-L300 HydrophobicContact CD1-CD2 4.44Å; L297-L300 PolarHBondContact O-N 2.7Å; L300-N302 VanDerWaalsContact C-N 3.32Å; L300-N302 PolarHBondContact O-N 3.26Å; L300-Q303 PolarHBondContact O-N 3.08Å; L300-Q303 VanDerWaalsContact O-N 3.11Å; L300-V304 HydrophobicContact CD1-CG2 4.23Å; L300-V304 HydrophobicContact CG-CG2 4.42Å; L300-V304 WeakPolarHBondContact O-CG2 3.46Å; L300-V304 PolarHBondContact O-N 2.91Å
301	K	92.9	Very high	92.2	Very high	74 Å²	74	66 Å²	66	32%	0.322	35%	0.345	S	S	.	.	H	α-helix	trans	-53.5	-47.9	174.3	175.3	165.4	175.4	162.5	0	111	F263 L297 Q303 V304 L305	F263-K301 HydrophobicContact CB-CD 4.41Å; F263-K301 HydrophobicContact CB-CG 4.23Å; F263-K301 HydrophobicContact CD1-CB 3.76Å; F263-K301 HydrophobicContact CD1-CD 4.13Å; F263-K301 HydrophobicContact CD1-CG 3.89Å; F263-K301 HydrophobicContact CE1-CB 4.06Å; F263-K301 HydrophobicContact CG-CG 4.35Å; F263-K301 WeakPolarHBondContact O-CE 3.36Å; F263-K301 PolarHBondContact O-NZ 3.09Å; L297-K301 VanDerWaalsContact O-CB 3.31Å; L297-K301 WeakPolarHBondContact O-CB 3.5Å; L297-K301 PolarHBondContact O-N 3.41Å; K301-Q303 PolarHBondContact O-N 3.45Å; K301-V304 PolarHBondContact O-N 2.77Å; K301-L305 HydrophobicContact CD-CD1 4.4Å; K301-L305 HydrophobicContact CG-CD1 3.73Å; K301-L305 HydrophobicContact CG-CG 4.11Å; K301-L305 WeakPolarHBondContact O-CB 3.35Å; K301-L305 VanDerWaalsContact O-CG 3.24Å; K301-L305 WeakPolarHBondContact O-CG 3.44Å; K301-L305 PolarHBondContact O-N 2.84Å
302	N	93.4	Very high	92.1	Very high	103 Å²	103	66.7 Å²	66.7	55%	0.551	35%	0.35	S	S	*	.	H	α-helix	trans	-60.8	-41.5	177.4	-72.1	-17.7	0	0	0	112.8	P298 H299 L300 S306	P298-N302 WeakPolarHBondContact O-CB 3.39Å; P298-N302 PolarHBondContact O-N 3.37Å; P298-N302 PolarHBondContact O-ND2 2.99Å; H299-N302 PolarHBondContact O-N 2.92Å; L300-N302 VanDerWaalsContact C-N 3.32Å; L300-N302 PolarHBondContact O-N 3.26Å; N302-S306 VanDerWaalsContact O-CB 3.24Å; N302-S306 WeakPolarHBondContact O-CB 3.43Å; N302-S306 PolarHBondContact O-N 3.27Å; N302-S306 PolarHBondContact O-OG 2.95Å
303	Q	93.5	Very high	92.1	Very high	63 Å²	63	77.1 Å²	77.1	29%	0.294	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-49	174.3	-71.7	-176.8	23.1	0	0	111.9	F292 D293 H299 L300 K301 S306 A307	F292-Q303 HydrophobicContact CB-CB 4.26Å; F292-Q303 HydrophobicContact CD1-CB 4.23Å; D293-Q303 PolarHBondContact O-NE2 3.13Å; D293-Q303 PolarHBondContact O-OE1 3.37Å; H299-Q303 PolarHBondContact O-N 3.4Å; L300-Q303 PolarHBondContact O-N 3.08Å; L300-Q303 VanDerWaalsContact O-N 3.11Å; K301-Q303 PolarHBondContact O-N 3.45Å; Q303-S306 CarbonylContact O-C 3.43Å; Q303-S306 PolarHBondContact O-N 3.38Å; Q303-S306 PolarHBondContact O-OG 3.48Å; Q303-A307 PolarHBondContact O-N 3.43Å
304	V	94.3	Very high	92.2	Very high	0 Å²	0	77.3 Å²	77.3	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-48.4	-179.1	171.6	0	0	0	0	111.5	P260 F263 W276 F292 L300 K301 S306 A307	P260-V304 HydrophobicContact CB-CG1 4.38Å; P260-V304 HydrophobicContact CG-CG1 3.97Å; F263-V304 HydrophobicContact CD2-CB 4.14Å; F263-V304 HydrophobicContact CD2-CG1 3.6Å; F263-V304 HydrophobicContact CE2-CB 4.05Å; F263-V304 HydrophobicContact CE2-CG1 3.77Å; F263-V304 HydrophobicContact CE2-CG2 3.94Å; F263-V304 HydrophobicContact CZ-CG2 4.41Å; W276-V304 HydrophobicContact CZ2-CG1 3.89Å; F292-V304 HydrophobicContact CB-CG2 3.89Å; F292-V304 HydrophobicContact CD2-CG2 4.02Å; F292-V304 HydrophobicContact CG-CG2 3.95Å; L300-V304 HydrophobicContact CD1-CG2 4.23Å; L300-V304 HydrophobicContact CG-CG2 4.42Å; L300-V304 WeakPolarHBondContact O-CG2 3.46Å; L300-V304 PolarHBondContact O-N 2.91Å; K301-V304 PolarHBondContact O-N 2.77Å; V304-S306 VanDerWaalsContact C-N 3.26Å; V304-S306 PolarHBondContact O-N 2.64Å; V304-A307 WeakPolarHBondContact O-CA 3.46Å; V304-A307 PolarHBondContact O-N 3Å
305	L	94.6	Very high	92.5	Very high	46 Å²	46	77.4 Å²	77.4	24%	0.241	38%	0.383	C	S	.	.	H	α-helix	trans	-62.8	-31.5	175.4	-65.6	-179.3	0	0	0	112.6	P260 F263 L264 K301 A307 K329	P260-L305 HydrophobicContact CB-CD2 4.09Å; F263-L305 HydrophobicContact CB-CD2 4.24Å; L264-L305 HydrophobicContact CD1-CD2 4.34Å; L264-L305 HydrophobicContact CD2-CD1 4.21Å; L264-L305 HydrophobicContact CD2-CD2 3.7Å; L264-L305 HydrophobicContact CG-CD2 3.74Å; K301-L305 HydrophobicContact CD-CD1 4.4Å; K301-L305 HydrophobicContact CG-CD1 3.73Å; K301-L305 HydrophobicContact CG-CG 4.11Å; K301-L305 WeakPolarHBondContact O-CB 3.35Å; K301-L305 VanDerWaalsContact O-CG 3.24Å; K301-L305 WeakPolarHBondContact O-CG 3.44Å; K301-L305 PolarHBondContact O-N 2.84Å; L305-A307 VanDerWaalsContact C-N 3.28Å; L305-K329 WeakPolarHBondContact O-CE 3.29Å; L305-K329 PolarHBondContact O-NZ 3.03Å
306	S	93.6	Very high	93	Very high	52 Å²	52	70.3 Å²	70.3	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-72.4	-21.4	172.6	81.8	0	0	0	0	113.1	N302 Q303 V304 S308 K329	N302-S306 VanDerWaalsContact O-CB 3.24Å; N302-S306 WeakPolarHBondContact O-CB 3.43Å; N302-S306 PolarHBondContact O-N 3.27Å; N302-S306 PolarHBondContact O-OG 2.95Å; Q303-S306 CarbonylContact O-C 3.43Å; Q303-S306 PolarHBondContact O-N 3.38Å; Q303-S306 PolarHBondContact O-OG 3.48Å; V304-S306 VanDerWaalsContact C-N 3.26Å; V304-S306 PolarHBondContact O-N 2.64Å; S306-S308 PolarHBondContact O-N 3.34Å; S306-S308 VanDerWaalsContact O-N 3.11Å; S306-S308 WeakPolarHBondContact OG-CB 3.39Å; S306-S308 PolarHBondContact OG-N 3.44Å; S306-K329 VanDerWaalsContact C-NZ 3.34Å; S306-K329 WeakPolarHBondContact O-CE 3.36Å; S306-K329 PolarHBondContact O-NZ 2.77Å
307	A	92.9	Very high	93.2	Very high	16 Å²	16	75.6 Å²	75.6	13%	0.132	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	26.8	-168.1	0	0	0	0	0	114.2	W276 Q303 V304 L305 F309 K329	W276-A307 HydrophobicContact CH2-CB 3.94Å; W276-A307 HydrophobicContact CZ3-CB 4.37Å; Q303-A307 PolarHBondContact O-N 3.43Å; V304-A307 WeakPolarHBondContact O-CA 3.46Å; V304-A307 PolarHBondContact O-N 3Å; L305-A307 VanDerWaalsContact C-N 3.28Å; A307-F309 PolarHBondContact O-N 3.15Å; A307-K329 HydrophobicContact CB-CD 4.3Å; A307-K329 HydrophobicContact CB-CG 3.52Å
308	S	89.1	Confident	93.5	Very high	87 Å²	87	72 Å²	72	61%	0.608	36%	0.361	S	S	*	.			trans	-96.8	94.2	-175.8	175.9	0	0	0	0	111	S306	S306-S308 PolarHBondContact O-N 3.34Å; S306-S308 VanDerWaalsContact O-N 3.11Å; S306-S308 WeakPolarHBondContact OG-CB 3.39Å; S306-S308 PolarHBondContact OG-N 3.44Å
309	F	93.6	Very high	93.8	Very high	17 Å²	17	68 Å²	68	8%	0.075	34%	0.335	C	S	.	.			trans	-105.4	159	171.9	63.3	-84.4	0	0	0	111.6	Y283 P291 F292 A307 V311 I323 R324 L327	Y283-F309 HydrophobicContact CD2-CD2 4.05Å; Y283-F309 HydrophobicContact CD2-CE2 4.31Å; Y283-F309 AromaticContact CE2-CD2 3.79Å; Y283-F309 HydrophobicContact CE2-CD2 3.79Å; Y283-F309 HydrophobicContact CE2-CE2 4.36Å; P291-F309 HydrophobicContact CB-CB 3.78Å; P291-F309 HydrophobicContact CB-CG 4.22Å; P291-F309 WeakPolarHBondContact O-CB 3.41Å; F292-F309 HydrophobicContact CD1-CB 4.39Å; F292-F309 HydrophobicContact CE1-CB 3.87Å; F292-F309 HydrophobicContact CE1-CD1 4.16Å; F292-F309 HydrophobicContact CE1-CG 4.5Å; F292-F309 HydrophobicContact CZ-CB 4.34Å; F292-F309 HydrophobicContact CZ-CD1 4.01Å; A307-F309 PolarHBondContact O-N 3.15Å; F309-V311 HydrophobicContact CD2-CG2 4.19Å; F309-V311 HydrophobicContact CE2-CG2 3.76Å; F309-I323 HydrophobicContact CE2-CG2 3.84Å; F309-I323 HydrophobicContact CZ-CG2 3.73Å; F309-R324 HydrophobicContact CE1-CG 4.43Å; F309-R324 HydrophobicContact CZ-CG 3.78Å; F309-L327 HydrophobicContact CD1-CD1 3.95Å; F309-L327 HydrophobicContact CE1-CB 4.03Å; F309-L327 HydrophobicContact CE1-CD1 3.78Å; F309-L327 HydrophobicContact CG-CD1 4.48Å; F309-L327 HydrophobicContact CZ-CD1 4.17Å
310	R	93.9	Very high	94	Very high	217 Å²	217	64.6 Å²	64.6	82%	0.819	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-87	137.8	177.6	-66.8	-178.7	178.6	173.3	1	110.3	Y283	Y283-R310 WeakPolarHBondContact CE2-O 3.47Å; Y283-R310 PolarHBondContact OH-O 3.43Å; Y283-R310 VanDerWaalsContact OH-O 3.07Å
311	V	92.9	Very high	94.2	Very high	46 Å²	46	69 Å²	69	28%	0.279	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-103.8	118.6	172.7	178.6	0	0	0	0	109	F309 L315 E320	F309-V311 HydrophobicContact CD2-CG2 4.19Å; F309-V311 HydrophobicContact CE2-CG2 3.76Å; V311-L315 HydrophobicContact CG1-CB 4.26Å; V311-L315 HydrophobicContact CG1-CD2 3.97Å; V311-E320 HydrophobicContact CG1-CB 4.37Å; V311-E320 HydrophobicContact CG1-CG 4.09Å; V311-E320 HydrophobicContact CG2-CG 3.96Å
312	P	93.8	Very high	94.4	Very high	24 Å²	24	65.5 Å²	65.5	16%	0.156	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-70.7	147.4	177.1	-20.7	34	0	0	0	113.1	W314 L315	P312-W314 HydrophobicContact CB-CD2 3.56Å; P312-W314 HydrophobicContact CB-CE3 3.85Å; P312-W314 HydrophobicContact CB-CG 4.23Å; P312-W314 HydrophobicContact CB-CH2 3.68Å; P312-W314 HydrophobicContact CB-CZ2 3.35Å; P312-W314 HydrophobicContact CB-CZ3 3.9Å; P312-W314 HydrophobicContact CG-CH2 4.21Å; P312-W314 HydrophobicContact CG-CZ2 3.66Å; P312-W314 PolarHBondContact O-N 3.01Å; P312-L315 WeakPolarHBondContact O-CB 3.35Å; P312-L315 PolarHBondContact O-N 3.25Å
313	Y	93.8	Very high	94.6	Very high	218 Å²	218	60.6 Å²	60.6	86%	0.855	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.8	-177	70.4	-97.1	0	0	0	115.2
314	W	92.6	Very high	94.8	Very high	94 Å²	94	63.1 Å²	63.1	36%	0.356	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.7	179.5	60.9	70.4	0	0	0	113.7	R187 P312	R187-W314 VanDerWaalsContact NH2-CD1 3.29Å; P312-W314 HydrophobicContact CB-CD2 3.56Å; P312-W314 HydrophobicContact CB-CE3 3.85Å; P312-W314 HydrophobicContact CB-CG 4.23Å; P312-W314 HydrophobicContact CB-CH2 3.68Å; P312-W314 HydrophobicContact CB-CZ2 3.35Å; P312-W314 HydrophobicContact CB-CZ3 3.9Å; P312-W314 HydrophobicContact CG-CH2 4.21Å; P312-W314 HydrophobicContact CG-CZ2 3.66Å; P312-W314 PolarHBondContact O-N 3.01Å
315	L	95	Very high	95	Very high	17 Å²	17	64 Å²	64	9%	0.089	31%	0.311	C	S	.	.	S	Bend	trans	-82.8	133.8	179.6	-165.3	72.1	0	0	0	109.8	V286 V311 P312 C319 E320 I323	V286-L315 HydrophobicContact CB-CD1 3.97Å; V286-L315 HydrophobicContact CG2-CD1 3.52Å; V311-L315 HydrophobicContact CG1-CB 4.26Å; V311-L315 HydrophobicContact CG1-CD2 3.97Å; P312-L315 WeakPolarHBondContact O-CB 3.35Å; P312-L315 PolarHBondContact O-N 3.25Å; L315-C319 HydrophobicContact CD1-CB 3.93Å; L315-C319 HydrophobicContact CD2-CB 4.46Å; L315-C319 HydrophobicContact CG-CB 3.99Å; L315-E320 HydrophobicContact CD2-CB 4.2Å; L315-I323 HydrophobicContact CD2-CD1 4.11Å
316	S	95.6	Very high	95.1	Very high	40 Å²	40	61.9 Å²	61.9	28%	0.28	30%	0.3	S	S	.	.			trans	-68.4	144	175.7	76.7	0	0	0	0	111.3	E190 A318 C319 E320	E190-S316 WeakPolarHBondContact OE1-CB 3.41Å; E190-S316 PolarHBondContact OE1-N 3.13Å; E190-S316 PolarHBondContact OE1-OG 3.39Å; E190-S316 WeakPolarHBondContact OE2-CB 3.08Å; E190-S316 PolarHBondContact OE2-OG 2.92Å; S316-A318 PolarHBondContact O-N 3.16Å; S316-A318 VanDerWaalsContact O-N 3.14Å; S316-C319 WeakPolarHBondContact O-CB 3.4Å; S316-C319 PolarHBondContact O-N 3.16Å; S316-C319 WeakPolarHBondContact OG-CB 3.35Å; S316-C319 PolarHBondContact OG-N 2.82Å; S316-E320 PolarHBondContact O-N 2.92Å
317	M	95.7	Very high	95.4	Very high	159 Å²	159	59.7 Å²	59.7	78%	0.783	28%	0.284	S	S	*	.	H	α-helix	trans	-55.5	-32.5	175.3	-65.3	176.4	68.8	0	0	112.2	Q321	M317-Q321 WeakPolarHBondContact O-CB 3.47Å; M317-Q321 PolarHBondContact O-N 3.23Å
318	A	96	Very high	95.6	Very high	27 Å²	27	60.4 Å²	60.4	22%	0.223	29%	0.288	C	S	.	.	H	α-helix	trans	-67.2	-39.7	176.4	0	0	0	0	0	112	S316 V322 W345	S316-A318 PolarHBondContact O-N 3.16Å; S316-A318 VanDerWaalsContact O-N 3.14Å; A318-V322 WeakPolarHBondContact O-CG2 3.35Å; A318-V322 PolarHBondContact O-N 2.94Å; A318-W345 HydrophobicContact CB-CB 4.02Å; A318-W345 HydrophobicContact CB-CG 4.48Å
319	C	96.6	Very high	95.8	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.4	-44.8	174.8	-164.2	0	0	0	0	111.3	L315 S316 Q321 V322 I323 W345	L315-C319 HydrophobicContact CD1-CB 3.93Å; L315-C319 HydrophobicContact CD2-CB 4.46Å; L315-C319 HydrophobicContact CG-CB 3.99Å; S316-C319 WeakPolarHBondContact O-CB 3.4Å; S316-C319 PolarHBondContact O-N 3.16Å; S316-C319 WeakPolarHBondContact OG-CB 3.35Å; S316-C319 PolarHBondContact OG-N 2.82Å; C319-Q321 VanDerWaalsContact C-N 3.29Å; C319-Q321 PolarHBondContact O-N 2.73Å; C319-V322 PolarHBondContact O-N 2.82Å; C319-V322 VanDerWaalsContact O-N 3.15Å; C319-I323 WeakPolarHBondContact O-CG1 3.23Å; C319-I323 PolarHBondContact O-N 2.71Å; C319-W345 HydrophobicContact CB-CD2 4.38Å; C319-W345 HydrophobicContact CB-CG 4.24Å
320	E	97	Very high	95.9	Very high	45 Å²	45	65.8 Å²	65.8	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-54.5	-45.2	174.5	-179.5	-178.1	-177.8	0	0	111.6	V311 L315 S316 V322 I323 R324	V311-E320 HydrophobicContact CG1-CB 4.37Å; V311-E320 HydrophobicContact CG1-CG 4.09Å; V311-E320 HydrophobicContact CG2-CG 3.96Å; L315-E320 HydrophobicContact CD2-CB 4.2Å; S316-E320 PolarHBondContact O-N 2.92Å; E320-V322 VanDerWaalsContact C-N 3.33Å; E320-V322 PolarHBondContact O-N 2.7Å; E320-I323 PolarHBondContact O-N 3.26Å; E320-R324 HydrophobicContact CG-CG 4.24Å; E320-R324 WeakPolarHBondContact O-CB 3.49Å; E320-R324 WeakPolarHBondContact O-CG 3.45Å; E320-R324 PolarHBondContact O-N 3.31Å; E320-R324 IonicContact OE1-CZ 2.64Å; E320-R324 IonicContact OE1-NE 2.82Å; E320-R324 PolarHBondContact OE1-NE 3.39Å; E320-R324 IonicContact OE1-NH2 3.93Å; E320-R324 PolarHBondContact OE1-NH2 3.26Å
321	Q	96.9	Very high	96	Very high	105 Å²	105	56.7 Å²	56.7	49%	0.491	27%	0.271	S	S	.	.	H	α-helix	trans	-60.3	-40.9	179.1	-169.9	-175.5	5.6	0	0	112.2	M317 C319 S325 F343	M317-Q321 WeakPolarHBondContact O-CB 3.47Å; M317-Q321 PolarHBondContact O-N 3.23Å; C319-Q321 VanDerWaalsContact C-N 3.29Å; C319-Q321 PolarHBondContact O-N 2.73Å; Q321-S325 WeakPolarHBondContact O-CB 3.19Å; Q321-S325 PolarHBondContact O-N 3.39Å; Q321-S325 VanDerWaalsContact O-N 3.11Å; Q321-S325 PolarHBondContact O-OG 3.07Å; Q321-F343 HydrophobicContact CG-CD1 4.35Å; Q321-F343 HydrophobicContact CG-CE1 4.16Å
322	V	97.3	Very high	96.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-51.3	175	174.1	0	0	0	0	110.4	L282 A318 C319 E320 R324 S325 M326 I340 F343 W345 F346	L282-V322 HydrophobicContact CD2-CB 4.34Å; L282-V322 HydrophobicContact CD2-CG1 3.63Å; A318-V322 WeakPolarHBondContact O-CG2 3.35Å; A318-V322 PolarHBondContact O-N 2.94Å; C319-V322 PolarHBondContact O-N 2.82Å; C319-V322 VanDerWaalsContact O-N 3.15Å; E320-V322 VanDerWaalsContact C-N 3.33Å; E320-V322 PolarHBondContact O-N 2.7Å; V322-R324 PolarHBondContact O-N 3.34Å; V322-S325 PolarHBondContact O-N 2.89Å; V322-S325 PolarHBondContact O-OG 3.32Å; V322-M326 HydrophobicContact CG1-CE 3.79Å; V322-M326 PolarHBondContact O-N 3.16Å; V322-M326 VanDerWaalsContact O-N 3.16Å; V322-I340 HydrophobicContact CG1-CG2 4.23Å; V322-F343 HydrophobicContact CG2-CB 3.49Å; V322-F343 VanDerWaalsContact CG2-CB 3.49Å; V322-F343 HydrophobicContact CG2-CD1 3.67Å; V322-F343 HydrophobicContact CG2-CG 3.7Å; V322-W345 HydrophobicContact CG2-CB 3.87Å; V322-F346 HydrophobicContact CG1-CE2 4.03Å; V322-F346 HydrophobicContact CG1-CZ 4.46Å; V322-F346 HydrophobicContact CG2-CE2 4.17Å
323	I	98	Very high	96.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-47.7	-179.1	-65.2	172.8	0	0	0	111	L282 Y283 V286 F309 L315 C319 E320 S325 M326 L327	L282-I323 HydrophobicContact CB-CG1 4.35Å; L282-I323 HydrophobicContact CD2-CD1 4.45Å; L282-I323 HydrophobicContact CD2-CG1 3.67Å; L282-I323 HydrophobicContact CG-CD1 4.19Å; L282-I323 HydrophobicContact CG-CG1 3.84Å; Y283-I323 HydrophobicContact CD2-CD1 4.31Å; Y283-I323 HydrophobicContact CD2-CG2 4.35Å; V286-I323 HydrophobicContact CG2-CD1 3.97Å; F309-I323 HydrophobicContact CE2-CG2 3.84Å; F309-I323 HydrophobicContact CZ-CG2 3.73Å; L315-I323 HydrophobicContact CD2-CD1 4.11Å; C319-I323 WeakPolarHBondContact O-CG1 3.23Å; C319-I323 PolarHBondContact O-N 2.71Å; E320-I323 PolarHBondContact O-N 3.26Å; I323-S325 VanDerWaalsContact C-N 3.3Å; I323-S325 PolarHBondContact O-N 2.86Å; I323-M326 PolarHBondContact O-N 3.12Å; I323-L327 HydrophobicContact CG2-CD1 3.71Å; I323-L327 HydrophobicContact CG2-CG 4.23Å; I323-L327 WeakPolarHBondContact O-CB 3.41Å; I323-L327 PolarHBondContact O-N 3.39Å
324	R	97.4	Very high	96.5	Very high	116 Å²	116	52 Å²	52	44%	0.438	26%	0.263	S	S	.	.	H	α-helix	trans	-60.5	-36.8	177.4	-74.3	-172.8	-176	-76.3	-1.4	112.9	F309 E320 V322 L327 S328	F309-R324 HydrophobicContact CE1-CG 4.43Å; F309-R324 HydrophobicContact CZ-CG 3.78Å; E320-R324 HydrophobicContact CG-CG 4.24Å; E320-R324 WeakPolarHBondContact O-CB 3.49Å; E320-R324 WeakPolarHBondContact O-CG 3.45Å; E320-R324 PolarHBondContact O-N 3.31Å; E320-R324 IonicContact OE1-CZ 2.64Å; E320-R324 IonicContact OE1-NE 2.82Å; E320-R324 PolarHBondContact OE1-NE 3.39Å; E320-R324 IonicContact OE1-NH2 3.93Å; E320-R324 PolarHBondContact OE1-NH2 3.26Å; V322-R324 PolarHBondContact O-N 3.34Å; R324-L327 CarbonylContact O-C 3.14Å; R324-S328 PolarHBondContact O-N 2.83Å; R324-S328 PolarHBondContact O-OG 3.04Å
325	S	97.8	Very high	96.7	Very high	19 Å²	19	48.2 Å²	48.2	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-37.2	177.6	74	0	0	0	0	112.5	Q321 V322 I323 S328 P335 F343	Q321-S325 WeakPolarHBondContact O-CB 3.19Å; Q321-S325 PolarHBondContact O-N 3.39Å; Q321-S325 VanDerWaalsContact O-N 3.11Å; Q321-S325 PolarHBondContact O-OG 3.07Å; V322-S325 PolarHBondContact O-N 2.89Å; V322-S325 PolarHBondContact O-OG 3.32Å; I323-S325 VanDerWaalsContact C-N 3.3Å; I323-S325 PolarHBondContact O-N 2.86Å; S325-S328 PolarHBondContact O-OG 2.67Å; S325-P335 WeakPolarHBondContact O-CD 3.4Å; S325-F343 VanDerWaalsContact OG-CZ 3.32Å; S325-F343 WeakPolarHBondContact OG-CZ 3.13Å
326	M	98.4	Very high	96.7	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-75.1	-40.9	175.2	-67.7	-166.7	-75.6	0	0	112.2	F197 I275 L278 L282 V322 I323 S328 R334 I340	F197-M326 HydrophobicContact CE1-CE 3.87Å; F197-M326 HydrophobicContact CE1-SD 4.35Å; F197-M326 HydrophobicContact CZ-CE 3.63Å; F197-M326 HydrophobicContact CZ-SD 4.05Å; I275-M326 HydrophobicContact CG2-CB 4.13Å; I275-M326 HydrophobicContact CG2-CG 3.92Å; L278-M326 HydrophobicContact CB-SD 3.88Å; L282-M326 HydrophobicContact CB-CE 3.98Å; L282-M326 HydrophobicContact CD2-CE 3.6Å; L282-M326 HydrophobicContact CG-CE 4.45Å; V322-M326 HydrophobicContact CG1-CE 3.79Å; V322-M326 PolarHBondContact O-N 3.16Å; V322-M326 VanDerWaalsContact O-N 3.16Å; I323-M326 PolarHBondContact O-N 3.12Å; M326-S328 PolarHBondContact O-N 3.31Å; M326-R334 WeakPolarHBondContact O-CD 3.44Å; M326-I340 HydrophobicContact CG-CD1 3.88Å; M326-I340 HydrophobicContact CG-CG1 4.27Å; M326-I340 HydrophobicContact SD-CD1 3.71Å; M326-I340 HydrophobicContact SD-CG1 4.37Å; M326-I340 HydrophobicContact SD-CG2 4.38Å
327	L	98.1	Very high	96.7	Very high	6 Å²	6	49.5 Å²	49.5	3%	0.031	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	31.8	177.1	-59	-175.9	0	0	0	113.2	W276 V280 P291 F292 F309 I323 R324	W276-L327 HydrophobicContact CD2-CD2 3.76Å; W276-L327 HydrophobicContact CE3-CB 4.4Å; W276-L327 HydrophobicContact CE3-CD2 4.06Å; W276-L327 HydrophobicContact CG-CD2 4.16Å; W276-L327 HydrophobicContact CH2-CB 4.49Å; W276-L327 HydrophobicContact CH2-CD2 4.48Å; W276-L327 HydrophobicContact CZ2-CD2 4.21Å; W276-L327 VanDerWaalsContact CZ3-C 3.48Å; W276-L327 HydrophobicContact CZ3-CB 4.19Å; W276-L327 HydrophobicContact CZ3-CD2 4.41Å; W276-L327 WeakPolarHBondContact CZ3-O 3.46Å; W276-L327 WeakPolarHBondContact O-CD2 3.36Å; V280-L327 HydrophobicContact CG2-CD2 3.85Å; P291-L327 HydrophobicContact CB-CD1 4.3Å; P291-L327 HydrophobicContact CG-CD1 4.35Å; F292-L327 HydrophobicContact CE2-CD1 4.14Å; F292-L327 HydrophobicContact CE2-CD2 4.29Å; F292-L327 HydrophobicContact CZ-CD1 4.17Å; F309-L327 HydrophobicContact CD1-CD1 3.95Å; F309-L327 HydrophobicContact CE1-CB 4.03Å; F309-L327 HydrophobicContact CE1-CD1 3.78Å; F309-L327 HydrophobicContact CG-CD1 4.48Å; F309-L327 HydrophobicContact CZ-CD1 4.17Å; I323-L327 HydrophobicContact CG2-CD1 3.71Å; I323-L327 HydrophobicContact CG2-CG 4.23Å; I323-L327 WeakPolarHBondContact O-CB 3.41Å; I323-L327 PolarHBondContact O-N 3.39Å; R324-L327 CarbonylContact O-C 3.14Å
328	S	97.1	Very high	96.5	Very high	31 Å²	31	48.7 Å²	48.7	22%	0.217	25%	0.25	C	S	.	.			trans	-76	133.9	172.3	-69.8	0	0	0	0	110	R324 S325 M326 E330 R334	R324-S328 PolarHBondContact O-N 2.83Å; R324-S328 PolarHBondContact O-OG 3.04Å; S325-S328 PolarHBondContact O-OG 2.67Å; M326-S328 PolarHBondContact O-N 3.31Å; S328-E330 PolarHBondContact O-N 2.73Å; S328-R334 PolarHBondContact O-NE 2.76Å; S328-R334 PolarHBondContact O-NH2 3.03Å
329	K	95.1	Very high	96.4	Very high	109 Å²	109	53.7 Å²	53.7	47%	0.474	26%	0.263	S	S	.	.	S	Bend	trans	-55	-56.1	-178.5	-68.7	-170	-175.8	-154.9	0	111.1	L305 S306 A307 P331 R334	L305-K329 WeakPolarHBondContact O-CE 3.29Å; L305-K329 PolarHBondContact O-NZ 3.03Å; S306-K329 VanDerWaalsContact C-NZ 3.34Å; S306-K329 WeakPolarHBondContact O-CE 3.36Å; S306-K329 PolarHBondContact O-NZ 2.77Å; A307-K329 HydrophobicContact CB-CD 4.3Å; A307-K329 HydrophobicContact CB-CG 3.52Å; K329-P331 WeakPolarHBondContact O-CD 3.4Å; K329-R334 PolarHBondContact O-NH2 2.82Å
330	E	95.4	Very high	96.4	Very high	109 Å²	109	53.7 Å²	53.7	51%	0.509	26%	0.263	S	S	.	.	S	Bend	trans	-70.1	121.5	-177.2	-171.7	55.8	-132	0	0	110.3	S328 S332 D333	S328-E330 PolarHBondContact O-N 2.73Å; E330-S332 WeakPolarHBondContact CG-OG 3.5Å; E330-S332 PolarHBondContact O-N 3.23Å; E330-D333 PolarHBondContact O-N 2.96Å
331	P	95.9	Very high	96.1	Very high	26 Å²	26	52.3 Å²	52.3	17%	0.169	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.7	179.8	-26	35.6	0	0	0	113.8	E261 K272 K329 D333	E261-P331 HydrophobicContact CB-CG 4.44Å; E261-P331 HydrophobicContact CG-CG 4.2Å; K272-P331 HydrophobicContact CB-CB 4.01Å; K272-P331 WeakPolarHBondContact CD-O 2.92Å; K272-P331 WeakPolarHBondContact CE-O 3.2Å; K272-P331 HydrophobicContact CG-CB 4.34Å; K272-P331 WeakPolarHBondContact CG-O 3.18Å; K272-P331 PolarHBondContact NZ-O 2.85Å; K329-P331 WeakPolarHBondContact O-CD 3.4Å; P331-D333 VanDerWaalsContact C-N 3.33Å; P331-D333 PolarHBondContact O-N 2.63Å
332	S	95.4	Very high	95.9	Very high	77 Å²	77	51.8 Å²	51.8	54%	0.538	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-41.5	176.2	62	0	0	0	0	112.5	K272 E330 R334	K272-S332 PolarHBondContact NZ-O 3.31Å; E330-S332 WeakPolarHBondContact CG-OG 3.5Å; E330-S332 PolarHBondContact O-N 3.23Å; S332-R334 VanDerWaalsContact C-N 3.3Å; S332-R334 PolarHBondContact O-N 2.75Å
333	D	97.1	Very high	95.8	Very high	109 Å²	109	53 Å²	53	58%	0.583	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-21.4	-170.1	-63.8	-4	0	0	0	112.7	E330 P331	E330-D333 PolarHBondContact O-N 2.96Å; P331-D333 VanDerWaalsContact C-N 3.33Å; P331-D333 PolarHBondContact O-N 2.63Å
334	R	97.7	Very high	95.5	Very high	2 Å²	2	56 Å²	56	1%	0.008	28%	0.281	C	S	.	.	S	Bend	trans	-62.4	123.5	177.3	-59.9	-176.5	-158.7	146.6	12.3	110.5	E261 K272 I275 M326 S328 K329 S332	E261-R334 IonicContact OE1-CZ 3.73Å; E261-R334 IonicContact OE1-NH1 2.7Å; E261-R334 PolarHBondContact OE1-NH1 3.46Å; E261-R334 IonicContact OE1-NH2 2.71Å; E261-R334 IonicContact OE2-CZ 2.8Å; E261-R334 IonicContact OE2-NH1 2.75Å; E261-R334 PolarHBondContact OE2-NH1 3.39Å; E261-R334 IonicContact OE2-NH2 2.74Å; E261-R334 PolarHBondContact OE2-NH2 2.98Å; K272-R334 HydrophobicContact CD-CB 4.4Å; K272-R334 PolarHBondContact NZ-O 2.98Å; K272-R334 WeakPolarHBondContact O-CD 3.17Å; K272-R334 PolarHBondContact O-NH1 2.77Å; I275-R334 HydrophobicContact CB-CB 4.47Å; I275-R334 HydrophobicContact CG2-CB 3.94Å; M326-R334 WeakPolarHBondContact O-CD 3.44Å; S328-R334 PolarHBondContact O-NE 2.76Å; S328-R334 PolarHBondContact O-NH2 3.03Å; K329-R334 PolarHBondContact O-NH2 2.82Å; S332-R334 VanDerWaalsContact C-N 3.3Å; S332-R334 PolarHBondContact O-N 2.75Å
335	P	97.2	Very high	95.4	Very high	16 Å²	16	50.5 Å²	50.5	10%	0.104	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-67.7	156.2	-178.4	28.4	-35.4	0	0	0	111.9	S325 R339 I340 F343	S325-P335 WeakPolarHBondContact O-CD 3.4Å; P335-R339 HydrophobicContact CB-CB 3.99Å; P335-R339 HydrophobicContact CB-CG 3.86Å; P335-I340 HydrophobicContact CB-CG1 3.98Å; P335-I340 HydrophobicContact CG-CD1 4.15Å; P335-I340 HydrophobicContact CG-CG1 3.53Å; P335-F343 HydrophobicContact CB-CE2 4.33Å; P335-F343 HydrophobicContact CG-CE2 4.28Å; P335-F343 HydrophobicContact CG-CZ 4.42Å
336	T	95.7	Very high	95	Very high	75 Å²	75	50 Å²	50	46%	0.46	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-70.5	156.8	167.4	58.5	0	0	0	0	110.9	K338 R339 I340	T336-K338 VanDerWaalsContact C-N 3.29Å; T336-K338 PolarHBondContact O-N 3.37Å; T336-R339 CarbonylContact O-C 3.43Å; T336-R339 WeakPolarHBondContact O-CA 3.34Å; T336-R339 WeakPolarHBondContact O-CB 3.42Å; T336-R339 PolarHBondContact O-N 2.82Å; T336-R339 PolarHBondContact OG1-N 2.9Å; T336-I340 WeakPolarHBondContact O-CG1 3.49Å; T336-I340 PolarHBondContact O-N 3.46Å
337	T	94	Very high	94.2	Very high	8 Å²	8	53.1 Å²	53.1	5%	0.049	28%	0.275	C	S	.	.	H	α-helix	trans	-40.7	-53	167.8	43.3	0	0	0	0	113.2	V204 D205 I275 R339 I340 S341	V204-T337 HydrophobicContact CG1-CG2 4.31Å; D205-T337 HydrophobicContact CB-CG2 4.13Å; D205-T337 VanDerWaalsContact OD1-CB 3.26Å; D205-T337 WeakPolarHBondContact OD1-CB 3.38Å; D205-T337 PolarHBondContact OD1-OG1 3.19Å; I275-T337 HydrophobicContact CD1-CG2 3.9Å; T337-R339 VanDerWaalsContact C-N 3.26Å; T337-R339 PolarHBondContact O-N 2.79Å; T337-I340 WeakPolarHBondContact O-CB 3.09Å; T337-I340 PolarHBondContact O-N 3.27Å; T337-I340 VanDerWaalsContact O-N 3.16Å; T337-S341 PolarHBondContact O-N 3.36Å; T337-S341 PolarHBondContact O-OG 2.63Å
338	K	91.7	Very high	93.1	Very high	142 Å²	142	55.4 Å²	55.4	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-61.5	-27.6	176.2	-176.2	173.9	-178.3	176.2	0	114	T336 S341 Q342	T336-K338 VanDerWaalsContact C-N 3.29Å; T336-K338 PolarHBondContact O-N 3.37Å; K338-S341 PolarHBondContact O-OG 3.06Å; K338-Q342 WeakPolarHBondContact O-CG 3.22Å; K338-Q342 PolarHBondContact O-NE2 3.2Å
339	R	94.8	Very high	91.1	Very high	133 Å²	133	59.3 Å²	59.3	50%	0.502	32%	0.319	S	S	.	.	H	α-helix	trans	-82.9	-35.5	174.3	-178.5	56.2	-179.9	161.7	2.3	111.6	P335 T336 T337 S341 Q342 F343	P335-R339 HydrophobicContact CB-CB 3.99Å; P335-R339 HydrophobicContact CB-CG 3.86Å; T336-R339 CarbonylContact O-C 3.43Å; T336-R339 WeakPolarHBondContact O-CA 3.34Å; T336-R339 WeakPolarHBondContact O-CB 3.42Å; T336-R339 PolarHBondContact O-N 2.82Å; T336-R339 PolarHBondContact OG1-N 2.9Å; T337-R339 VanDerWaalsContact C-N 3.26Å; T337-R339 PolarHBondContact O-N 2.79Å; R339-S341 PolarHBondContact O-N 2.73Å; R339-Q342 WeakPolarHBondContact O-CB 3.48Å; R339-Q342 PolarHBondContact O-N 3.38Å; R339-F343 HydrophobicContact CG-CE2 4.39Å; R339-F343 VanDerWaalsContact O-CD2 3.3Å; R339-F343 WeakPolarHBondContact O-CD2 3.24Å
340	I	96.3	Very high	89.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-46.8	177.2	-66.8	160.3	0	0	0	110.7	L201 I275 V322 M326 P335 T336 T337 Q342 F343 F346	L201-I340 HydrophobicContact CD1-CB 4.47Å; L201-I340 HydrophobicContact CD1-CG2 3.71Å; L201-I340 HydrophobicContact CD2-CB 4.27Å; L201-I340 HydrophobicContact CD2-CD1 4.2Å; L201-I340 HydrophobicContact CD2-CG2 3.95Å; L201-I340 HydrophobicContact CG-CG2 4.5Å; I275-I340 HydrophobicContact CD1-CD1 3.91Å; I275-I340 HydrophobicContact CG2-CD1 4.07Å; V322-I340 HydrophobicContact CG1-CG2 4.23Å; M326-I340 HydrophobicContact CG-CD1 3.88Å; M326-I340 HydrophobicContact CG-CG1 4.27Å; M326-I340 HydrophobicContact SD-CD1 3.71Å; M326-I340 HydrophobicContact SD-CG1 4.37Å; M326-I340 HydrophobicContact SD-CG2 4.38Å; P335-I340 HydrophobicContact CB-CG1 3.98Å; P335-I340 HydrophobicContact CG-CD1 4.15Å; P335-I340 HydrophobicContact CG-CG1 3.53Å; T336-I340 WeakPolarHBondContact O-CG1 3.49Å; T336-I340 PolarHBondContact O-N 3.46Å; T337-I340 WeakPolarHBondContact O-CB 3.09Å; T337-I340 PolarHBondContact O-N 3.27Å; T337-I340 VanDerWaalsContact O-N 3.16Å; I340-Q342 PolarHBondContact O-N 3.31Å; I340-F343 WeakPolarHBondContact O-CD2 3.11Å; I340-F343 PolarHBondContact O-N 3.36Å; I340-F343 VanDerWaalsContact O-N 3.1Å; I340-F346 HydrophobicContact CG2-CE2 3.72Å; I340-F346 HydrophobicContact CG2-CZ 4.15Å; I340-F346 WeakPolarHBondContact O-CD2 3.26Å; I340-F346 VanDerWaalsContact O-CE2 3.24Å; I340-F346 WeakPolarHBondContact O-CE2 3.23Å
341	S	91.3	Very high	87.3	Confident	16 Å²	16	54.5 Å²	54.5	11%	0.112	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.7	179.8	55	0	0	0	0	115	T337 K338 R339 Y356	T337-S341 PolarHBondContact O-N 3.36Å; T337-S341 PolarHBondContact O-OG 2.63Å; K338-S341 PolarHBondContact O-OG 3.06Å; R339-S341 PolarHBondContact O-N 2.73Å; S341-Y356 WeakPolarHBondContact CB-OH 3.14Å; S341-Y356 WeakPolarHBondContact OG-CE1 3.42Å; S341-Y356 PolarHBondContact OG-OH 3.23Å
342	Q	92.4	Very high	85.2	Confident	94 Å²	94	57.7 Å²	57.7	44%	0.439	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-6.2	175.7	-61.9	171.6	-3.4	0	0	113.9	K338 R339 I340	K338-Q342 WeakPolarHBondContact O-CG 3.22Å; K338-Q342 PolarHBondContact O-NE2 3.2Å; R339-Q342 WeakPolarHBondContact O-CB 3.48Å; R339-Q342 PolarHBondContact O-N 3.38Å; I340-Q342 PolarHBondContact O-N 3.31Å
343	F	94.5	Very high	83	Confident	25 Å²	25	59 Å²	59	11%	0.11	32%	0.323	C	S	.	.	S	Bend	trans	-65	151.3	-178.2	-85	-113.2	0	0	0	111.8	Q321 V322 S325 P335 R339 I340 W345 F346 T347	Q321-F343 HydrophobicContact CG-CD1 4.35Å; Q321-F343 HydrophobicContact CG-CE1 4.16Å; V322-F343 HydrophobicContact CG2-CB 3.49Å; V322-F343 VanDerWaalsContact CG2-CB 3.49Å; V322-F343 HydrophobicContact CG2-CD1 3.67Å; V322-F343 HydrophobicContact CG2-CG 3.7Å; S325-F343 VanDerWaalsContact OG-CZ 3.32Å; S325-F343 WeakPolarHBondContact OG-CZ 3.13Å; P335-F343 HydrophobicContact CB-CE2 4.33Å; P335-F343 HydrophobicContact CG-CE2 4.28Å; P335-F343 HydrophobicContact CG-CZ 4.42Å; R339-F343 HydrophobicContact CG-CE2 4.39Å; R339-F343 VanDerWaalsContact O-CD2 3.3Å; R339-F343 WeakPolarHBondContact O-CD2 3.24Å; I340-F343 WeakPolarHBondContact O-CD2 3.11Å; I340-F343 PolarHBondContact O-N 3.36Å; I340-F343 VanDerWaalsContact O-N 3.1Å; F343-W345 PolarHBondContact O-N 3.36Å; F343-F346 HydrophobicContact CB-CD2 4.22Å; F343-F346 PolarHBondContact O-N 2.54Å; F343-T347 PolarHBondContact O-N 3.47Å; F343-T347 VanDerWaalsContact O-N 3.15Å; F343-T347 PolarHBondContact O-OG1 2.92Å
344	P	93	Very high	80.7	Confident	62 Å²	62	58.5 Å²	58.5	40%	0.403	32%	0.32	S	S	.	.	H	α-helix	trans	-51.8	-30.1	179	-29	36.1	0	0	0	114.5	F346 T347 S348	P344-F346 VanDerWaalsContact C-N 3.3Å; P344-F346 PolarHBondContact O-N 3.24Å; P344-T347 WeakPolarHBondContact CA-OG1 3.18Å; P344-T347 PolarHBondContact O-N 3.2Å; P344-S348 VanDerWaalsContact O-CB 3.3Å; P344-S348 WeakPolarHBondContact O-CB 3.03Å; P344-S348 PolarHBondContact O-N 3.4Å; P344-S348 PolarHBondContact O-OG 3.13Å
345	W	93.9	Very high	78.7	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.008	35%	0.347	C	S	.	.	H	α-helix	trans	-60.8	-37.4	176.3	-168.4	68	0	0	0	112.8	E190 A193 R194 L282 V286 A318 C319 V322 F343	E190-W345 HydrophobicContact CB-CZ2 4.1Å; E190-W345 HydrophobicContact CG-CZ2 4.32Å; E190-W345 WeakPolarHBondContact O-CZ2 3.38Å; E190-W345 PolarHBondContact OE2-NE1 2.79Å; A193-W345 HydrophobicContact CB-CH2 4.38Å; R194-W345 VanDerWaalsContact CA-CH2 3.42Å; R194-W345 HydrophobicContact CB-CE3 4.32Å; R194-W345 HydrophobicContact CB-CH2 3.49Å; R194-W345 VanDerWaalsContact CB-CH2 3.49Å; R194-W345 HydrophobicContact CB-CZ2 3.8Å; R194-W345 HydrophobicContact CB-CZ3 3.78Å; R194-W345 WeakPolarHBondContact CD-O 3.06Å; R194-W345 HydrophobicContact CG-CD2 4.28Å; R194-W345 HydrophobicContact CG-CE3 3.9Å; R194-W345 HydrophobicContact CG-CH2 3.99Å; R194-W345 HydrophobicContact CG-CZ2 4.34Å; R194-W345 HydrophobicContact CG-CZ3 3.76Å; R194-W345 PolarHBondContact NE-O 2.8Å; L282-W345 HydrophobicContact CD1-CH2 3.6Å; L282-W345 HydrophobicContact CD1-CZ3 3.86Å; L282-W345 HydrophobicContact CD2-CZ3 4.3Å; V286-W345 HydrophobicContact CG1-CZ2 4.42Å; A318-W345 HydrophobicContact CB-CB 4.02Å; A318-W345 HydrophobicContact CB-CG 4.48Å; C319-W345 HydrophobicContact CB-CD2 4.38Å; C319-W345 HydrophobicContact CB-CG 4.24Å; V322-W345 HydrophobicContact CG2-CB 3.87Å; F343-W345 PolarHBondContact O-N 3.36Å
346	F	89.4	Confident	76.5	Confident	9 Å²	9	66.4 Å²	66.4	4%	0.039	35%	0.348	C	S	.	.	H	α-helix	trans	-85.5	-31.8	176.5	-60.4	-76.5	0	0	0	113.1	R194 F197 L198 L201 V322 I340 F343 P344 I351	R194-F346 HydrophobicContact CG-CD1 3.66Å; R194-F346 HydrophobicContact CG-CE1 4.06Å; F197-F346 HydrophobicContact CD1-CE1 4.11Å; F197-F346 AromaticContact CD1-CZ 3.76Å; F197-F346 HydrophobicContact CD1-CZ 3.76Å; F197-F346 HydrophobicContact CE1-CZ 4.21Å; L198-F346 HydrophobicContact CD1-CD1 4.03Å; L198-F346 HydrophobicContact CD2-CB 4.48Å; L198-F346 HydrophobicContact CD2-CD1 3.44Å; L198-F346 VanDerWaalsContact CD2-CD1 3.44Å; L198-F346 HydrophobicContact CD2-CE1 3.85Å; L198-F346 HydrophobicContact CD2-CG 4.12Å; L198-F346 HydrophobicContact CG-CD1 3.6Å; L198-F346 HydrophobicContact CG-CE1 3.85Å; L201-F346 HydrophobicContact CD1-CE1 4.13Å; L201-F346 HydrophobicContact CD1-CE2 4.38Å; L201-F346 HydrophobicContact CD1-CZ 3.77Å; V322-F346 HydrophobicContact CG1-CE2 4.03Å; V322-F346 HydrophobicContact CG1-CZ 4.46Å; V322-F346 HydrophobicContact CG2-CE2 4.17Å; I340-F346 HydrophobicContact CG2-CE2 3.72Å; I340-F346 HydrophobicContact CG2-CZ 4.15Å; I340-F346 WeakPolarHBondContact O-CD2 3.26Å; I340-F346 VanDerWaalsContact O-CE2 3.24Å; I340-F346 WeakPolarHBondContact O-CE2 3.23Å; F343-F346 HydrophobicContact CB-CD2 4.22Å; F343-F346 PolarHBondContact O-N 2.54Å; P344-F346 VanDerWaalsContact C-N 3.3Å; P344-F346 PolarHBondContact O-N 3.24Å; F346-I351 WeakPolarHBondContact O-CD1 3.45Å
347	T	82.5	Confident	74.2	Confident	65 Å²	65	68.1 Å²	68.1	40%	0.399	35%	0.351	S	S	.	.	H	α-helix	trans	-90.6	-9.1	-175.4	61.4	0	0	0	0	114.4	F343 P344 H353	F343-T347 PolarHBondContact O-N 3.47Å; F343-T347 VanDerWaalsContact O-N 3.15Å; F343-T347 PolarHBondContact O-OG1 2.92Å; P344-T347 WeakPolarHBondContact CA-OG1 3.18Å; P344-T347 PolarHBondContact O-N 3.2Å; T347-H353 PolarHBondContact O-CE1 2.88Å; T347-H353 VanDerWaalsContact O-CE1 3.31Å; T347-H353 PolarHBondContact O-NE2 3.5Å
348	S	74.4	Confident	72.1	Confident	54 Å²	54	71.3 Å²	71.3	38%	0.378	37%	0.367	S	S	.	.	S	Bend	trans	-61.7	138.2	175.5	-70.4	0	0	0	0	112.2	P344 T350	P344-S348 VanDerWaalsContact O-CB 3.3Å; P344-S348 WeakPolarHBondContact O-CB 3.03Å; P344-S348 PolarHBondContact O-N 3.4Å; P344-S348 PolarHBondContact O-OG 3.13Å; S348-T350 PolarHBondContact O-N 3.2Å
349	S	56.7	Low	70.2	Confident	113 Å²	113	67 Å²	67	79%	0.79	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	32.7	-164.5	58.7	0	0	0	0	116.9
350	T	56.4	Low	67.9	Low	95 Å²	95	62.9 Å²	62.9	58%	0.583	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-5.1	175.9	50.6	0	0	0	0	113.6	R194 S348	R194-T350 PolarHBondContact NH1-OG1 2.73Å; S348-T350 PolarHBondContact O-N 3.2Å
351	I	54.4	Low	65.4	Low	21 Å²	21	66.8 Å²	66.8	11%	0.108	36%	0.357	C	S	.	.	S	Bend	trans	-100.3	142.9	168.5	-36.6	174.3	0	0	0	108.3	R194 L198 F346 H353	R194-I351 HydrophobicContact CG-CD1 3.92Å; L198-I351 HydrophobicContact CD1-CD1 4.18Å; F346-I351 WeakPolarHBondContact O-CD1 3.45Å; I351-H353 PolarHBondContact O-N 2.76Å
352	P	49.8	Very low	63.2	Low	94 Å²	94	68.4 Å²	68.4	61%	0.61	37%	0.371	S	S	*	.			trans	-56.3	103	157.1	-21.6	33.4	0	0	0	109	N354 R355	P352-N354 PolarHBondContact O-N 3.29Å; P352-R355 PolarHBondContact O-N 3.01Å
353	H	49.3	Very low	61	Low	104 Å²	104	65.1 Å²	65.1	48%	0.481	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-16.6	-171.5	-109.3	-83.2	0	0	0	114.4	T347 I351	T347-H353 PolarHBondContact O-CE1 2.88Å; T347-H353 VanDerWaalsContact O-CE1 3.31Å; T347-H353 PolarHBondContact O-NE2 3.5Å; I351-H353 PolarHBondContact O-N 2.76Å
354	N	50.3	Low	58.5	Low	98 Å²	98	67.4 Å²	67.4	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-76	-24.3	176.4	-108.1	44	0	0	0	114.5	P352 Y356 H357 D358	P352-N354 PolarHBondContact O-N 3.29Å; N354-Y356 PolarHBondContact O-N 3.22Å; N354-H357 PolarHBondContact O-N 2.83Å; N354-D358 VanDerWaalsContact CB-OD2 3.23Å; N354-D358 WeakPolarHBondContact CB-OD2 3.39Å; N354-D358 VanDerWaalsContact CG-OD2 3.31Å; N354-D358 PolarHBondContact ND2-OD1 3.5Å; N354-D358 PolarHBondContact ND2-OD2 2.93Å; N354-D358 WeakPolarHBondContact O-CA 3.06Å; N354-D358 WeakPolarHBondContact O-CB 3.39Å; N354-D358 PolarHBondContact O-N 2.8Å
355	R	54.1	Low	55.7	Low	151 Å²	151	68.9 Å²	68.9	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-65.6	-38.4	-171.8	-88.7	-165.8	178.8	-162.5	-0.1	115.4	P352 K359	P352-R355 PolarHBondContact O-N 3.01Å; R355-K359 WeakPolarHBondContact O-CB 3.45Å; R355-K359 VanDerWaalsContact O-CG 3.23Å; R355-K359 WeakPolarHBondContact O-CG 3.46Å; R355-K359 PolarHBondContact O-N 3.41Å
356	Y	51.2	Low	53.2	Low	34 Å²	34	71.6 Å²	71.6	13%	0.133	39%	0.394	C	S	.	.	H	α-helix	trans	-78.3	-41.9	176	-173.8	-111	0	0	0	111.5	L198 S341 N354 K359 L360	L198-Y356 HydrophobicContact CB-CD2 3.96Å; L198-Y356 HydrophobicContact CB-CE2 4.46Å; L198-Y356 HydrophobicContact CD2-CD1 4.33Å; L198-Y356 HydrophobicContact CD2-CD2 3.59Å; L198-Y356 HydrophobicContact CD2-CE2 3.89Å; L198-Y356 HydrophobicContact CD2-CG 3.8Å; L198-Y356 HydrophobicContact CG-CD2 4.28Å; S341-Y356 WeakPolarHBondContact CB-OH 3.14Å; S341-Y356 WeakPolarHBondContact OG-CE1 3.42Å; S341-Y356 PolarHBondContact OG-OH 3.23Å; N354-Y356 PolarHBondContact O-N 3.22Å; Y356-K359 PolarHBondContact O-N 2.15Å; Y356-L360 HydrophobicContact CE1-CD1 4.29Å; Y356-L360 HydrophobicContact CE2-CD1 4.32Å; Y356-L360 VanDerWaalsContact O-CB 3.24Å; Y356-L360 WeakPolarHBondContact O-CB 3.45Å; Y356-L360 PolarHBondContact O-N 3.31Å
357	H	49.2	Very low	50.7	Low	111 Å²	111	73 Å²	73	51%	0.514	40%	0.402	S	S	.	.	H	α-helix	trans	-67	-42.3	176.3	-93.4	-59.1	0	0	0	112.6	N354 L360 I361	N354-H357 PolarHBondContact O-N 2.83Å; H357-L360 PolarHBondContact O-N 2.75Å; H357-I361 HydrophobicContact CB-CD1 4.46Å; H357-I361 WeakPolarHBondContact O-CA 3.13Å; H357-I361 WeakPolarHBondContact O-CB 3.26Å; H357-I361 WeakPolarHBondContact O-CD1 3.38Å; H357-I361 WeakPolarHBondContact O-CG1 3.38Å; H357-I361 PolarHBondContact O-N 2.92Å
358	D	48.2	Very low	48.2	Very low	74 Å²	74	71.3 Å²	71.3	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-67.6	-33.7	174.2	-65.9	-12.4	0	0	0	112.1	N354 A362	N354-D358 VanDerWaalsContact CB-OD2 3.23Å; N354-D358 WeakPolarHBondContact CB-OD2 3.39Å; N354-D358 VanDerWaalsContact CG-OD2 3.31Å; N354-D358 PolarHBondContact ND2-OD1 3.5Å; N354-D358 PolarHBondContact ND2-OD2 2.93Å; N354-D358 WeakPolarHBondContact O-CA 3.06Å; N354-D358 WeakPolarHBondContact O-CB 3.39Å; N354-D358 PolarHBondContact O-N 2.8Å; D358-A362 WeakPolarHBondContact O-CA 3.31Å; D358-A362 WeakPolarHBondContact O-CB 3.45Å; D358-A362 PolarHBondContact O-N 3.27Å
359	K	51.7	Low	46.2	Very low	52 Å²	52	72.8 Å²	72.8	23%	0.226	40%	0.396	C	S	.	.	H	α-helix	trans	-72	-42.7	171.6	-79.6	-173.3	177.4	-164.4	0	111.8	D199 R355 Y356 I361 A362 N363	D199-K359 IonicContact OD1-NZ 2.68Å; D199-K359 PolarHBondContact OD1-NZ 3.36Å; D199-K359 IonicContact OD2-NZ 3.77Å; D199-K359 PolarHBondContact OD2-NZ 3.43Å; R355-K359 WeakPolarHBondContact O-CB 3.45Å; R355-K359 VanDerWaalsContact O-CG 3.23Å; R355-K359 WeakPolarHBondContact O-CG 3.46Å; R355-K359 PolarHBondContact O-N 3.41Å; Y356-K359 PolarHBondContact O-N 2.15Å; K359-I361 VanDerWaalsContact C-N 3.35Å; K359-A362 PolarHBondContact O-N 3.1Å; K359-N363 VanDerWaalsContact O-CB 3.23Å; K359-N363 WeakPolarHBondContact O-CB 3.21Å; K359-N363 PolarHBondContact O-N 2.85Å; K359-N363 PolarHBondContact O-ND2 3.29Å; K359-N363 VanDerWaalsContact O-ND2 3.13Å
360	L	47.4	Very low	45	Very low	47 Å²	47	67.5 Å²	67.5	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-65.6	-41.6	177	-152.1	93.1	0	0	0	110.3	Y356 H357 V364	Y356-L360 HydrophobicContact CE1-CD1 4.29Å; Y356-L360 HydrophobicContact CE2-CD1 4.32Å; Y356-L360 VanDerWaalsContact O-CB 3.24Å; Y356-L360 WeakPolarHBondContact O-CB 3.45Å; Y356-L360 PolarHBondContact O-N 3.31Å; H357-L360 PolarHBondContact O-N 2.75Å; L360-V364 WeakPolarHBondContact O-CB 3.3Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.38Å
361	I	43.7	Very low	43.8	Very low	82 Å²	82	66.6 Å²	66.6	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-67.5	-43.7	173	-69.2	164.8	0	0	0	110	H357 K359 V364 M365	H357-I361 HydrophobicContact CB-CD1 4.46Å; H357-I361 WeakPolarHBondContact O-CA 3.13Å; H357-I361 WeakPolarHBondContact O-CB 3.26Å; H357-I361 WeakPolarHBondContact O-CD1 3.38Å; H357-I361 WeakPolarHBondContact O-CG1 3.38Å; H357-I361 PolarHBondContact O-N 2.92Å; K359-I361 VanDerWaalsContact C-N 3.35Å; I361-V364 CarbonylContact O-C 3.53Å; I361-V364 PolarHBondContact O-N 3.29Å; I361-M365 HydrophobicContact CG2-CE 4.16Å; I361-M365 HydrophobicContact CG2-CG 3.69Å; I361-M365 WeakPolarHBondContact O-CA 3.4Å; I361-M365 WeakPolarHBondContact O-CB 3.43Å; I361-M365 WeakPolarHBondContact O-CG 3.5Å; I361-M365 PolarHBondContact O-N 3.01Å
362	A	44.2	Very low	42.6	Very low	50 Å²	50	71.7 Å²	71.7	41%	0.413	38%	0.379	S	S	.	.	H	α-helix	trans	-64.5	-42.4	177.6	0	0	0	0	0	111.4	D358 K359 M365 S366	D358-A362 WeakPolarHBondContact O-CA 3.31Å; D358-A362 WeakPolarHBondContact O-CB 3.45Å; D358-A362 PolarHBondContact O-N 3.27Å; K359-A362 PolarHBondContact O-N 3.1Å; A362-M365 CarbonylContact O-C 3.54Å; A362-M365 PolarHBondContact O-N 2.83Å; A362-S366 WeakPolarHBondContact O-CB 3.32Å; A362-S366 PolarHBondContact O-N 2.87Å; A362-S366 PolarHBondContact O-OG 3.49Å
363	N	47.7	Very low	41.9	Very low	24 Å²	24	72.7 Å²	72.7	13%	0.128	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-45	173.7	-66.9	-27.6	0	0	0	110.5	H150 S151 S202 K359 M365 S366 N367	H150-N363 PolarHBondContact NE2-ND2 3.11Å; S151-N363 PolarHBondContact OG-OD1 2.88Å; S202-N363 PolarHBondContact OG-ND2 3.4Å; K359-N363 VanDerWaalsContact O-CB 3.23Å; K359-N363 WeakPolarHBondContact O-CB 3.21Å; K359-N363 PolarHBondContact O-N 2.85Å; K359-N363 PolarHBondContact O-ND2 3.29Å; K359-N363 VanDerWaalsContact O-ND2 3.13Å; N363-M365 VanDerWaalsContact C-N 3.28Å; N363-M365 PolarHBondContact O-N 2.81Å; N363-S366 PolarHBondContact O-N 2.74Å; N363-N367 WeakPolarHBondContact O-CB 3.5Å; N363-N367 PolarHBondContact O-N 2.75Å; N363-N367 PolarHBondContact O-ND2 3.36Å; N363-N367 PolarHBondContact O-OD1 3.08Å; N363-N367 VanDerWaalsContact O-OD1 3.09Å
364	V	41.9	Very low	41.1	Very low	73 Å²	73	71.8 Å²	71.8	44%	0.442	37%	0.373	S	S	.	.	H	α-helix	trans	-66.7	-26	174.4	168.5	0	0	0	0	112.2	L360 I361 N367 S368	L360-V364 WeakPolarHBondContact O-CB 3.3Å; L360-V364 WeakPolarHBondContact O-CG2 3.48Å; L360-V364 PolarHBondContact O-N 3.38Å; I361-V364 CarbonylContact O-C 3.53Å; I361-V364 PolarHBondContact O-N 3.29Å; V364-N367 CarbonylContact O-C 3.58Å; V364-S368 WeakPolarHBondContact O-CA 3.15Å; V364-S368 WeakPolarHBondContact O-CB 3.24Å; V364-S368 PolarHBondContact O-N 2.87Å; V364-S368 PolarHBondContact O-OG 3.48Å
365	M	34.3	Very low	40.2	Very low	93 Å²	93	72.3 Å²	72.3	46%	0.458	38%	0.38	S	S	.	.	H	α-helix	trans	-88.1	-30.6	178.4	-74.6	-73.4	-172.1	0	0	111.9	I361 A362 N363 N367 S368 L369	I361-M365 HydrophobicContact CG2-CE 4.16Å; I361-M365 HydrophobicContact CG2-CG 3.69Å; I361-M365 WeakPolarHBondContact O-CA 3.4Å; I361-M365 WeakPolarHBondContact O-CB 3.43Å; I361-M365 WeakPolarHBondContact O-CG 3.5Å; I361-M365 PolarHBondContact O-N 3.01Å; A362-M365 CarbonylContact O-C 3.54Å; A362-M365 PolarHBondContact O-N 2.83Å; N363-M365 VanDerWaalsContact C-N 3.28Å; N363-M365 PolarHBondContact O-N 2.81Å; M365-N367 VanDerWaalsContact C-N 3.31Å; M365-S368 PolarHBondContact O-N 3.46Å; M365-L369 WeakPolarHBondContact O-CB 3.36Å; M365-L369 WeakPolarHBondContact O-CD1 3.49Å; M365-L369 WeakPolarHBondContact O-CG 3.49Å; M365-L369 PolarHBondContact O-N 3.31Å
366	S	40.1	Very low	39	Very low	59 Å²	59	73.5 Å²	73.5	41%	0.413	40%	0.398	S	S	.	.	H	α-helix	trans	-58.5	-49.9	160.3	-70.4	0	0	0	0	108.5	A362 N363 S368 A370	A362-S366 WeakPolarHBondContact O-CB 3.32Å; A362-S366 PolarHBondContact O-N 2.87Å; A362-S366 PolarHBondContact O-OG 3.49Å; N363-S366 PolarHBondContact O-N 2.74Å; S366-S368 VanDerWaalsContact C-N 3.34Å; S366-S368 PolarHBondContact O-N 3.01Å; S366-A370 WeakPolarHBondContact O-CB 3.47Å; S366-A370 PolarHBondContact O-N 3.13Å; S366-A370 VanDerWaalsContact O-N 3.1Å
367	N	38.2	Very low	38	Very low	39 Å²	39	80.2 Å²	80.2	21%	0.209	43%	0.428	C	S	.	.	H	α-helix	trans	-66.1	-31.3	176.8	-59.9	-2.1	0	0	0	112.9	N363 V364 M365 A370 T371 N438	N363-N367 WeakPolarHBondContact O-CB 3.5Å; N363-N367 PolarHBondContact O-N 2.75Å; N363-N367 PolarHBondContact O-ND2 3.36Å; N363-N367 PolarHBondContact O-OD1 3.08Å; N363-N367 VanDerWaalsContact O-OD1 3.09Å; V364-N367 CarbonylContact O-C 3.58Å; M365-N367 VanDerWaalsContact C-N 3.31Å; N367-A370 CarbonylContact O-C 3.43Å; N367-A370 WeakPolarHBondContact O-CB 3.25Å; N367-T371 WeakPolarHBondContact O-CB 3.41Å; N367-T371 PolarHBondContact O-N 2.96Å; N367-T371 PolarHBondContact O-OG1 3.36Å; N367-N438 PolarHBondContact OD1-ND2 3.3Å
368	S	30.3	Very low	37.1	Very low	30 Å²	30	81.2 Å²	81.2	21%	0.21	44%	0.444	C	S	.	.	H	α-helix	trans	-95.7	-22.5	-175.3	-63.1	0	0	0	0	113.9	V364 M365 S366 T371 M372	V364-S368 WeakPolarHBondContact O-CA 3.15Å; V364-S368 WeakPolarHBondContact O-CB 3.24Å; V364-S368 PolarHBondContact O-N 2.87Å; V364-S368 PolarHBondContact O-OG 3.48Å; M365-S368 PolarHBondContact O-N 3.46Å; S366-S368 VanDerWaalsContact C-N 3.34Å; S366-S368 PolarHBondContact O-N 3.01Å; S368-T371 PolarHBondContact O-N 3.35Å; S368-M372 WeakPolarHBondContact O-CA 3.26Å; S368-M372 WeakPolarHBondContact O-CB 3.42Å; S368-M372 WeakPolarHBondContact O-CG 3.31Å; S368-M372 PolarHBondContact O-N 2.79Å
369	L	31.9	Very low	36.2	Very low	85 Å²	85	83.4 Å²	83.4	45%	0.445	46%	0.46	S	S	.	.	H	α-helix	trans	-64.9	-38	158	-80.1	157.6	0	0	0	108.8	M365 T371 V445	M365-L369 WeakPolarHBondContact O-CB 3.36Å; M365-L369 WeakPolarHBondContact O-CD1 3.49Å; M365-L369 WeakPolarHBondContact O-CG 3.49Å; M365-L369 PolarHBondContact O-N 3.31Å; L369-T371 VanDerWaalsContact C-N 3.34Å; L369-T371 PolarHBondContact O-N 2.72Å; L369-V445 WeakPolarHBondContact O-CG1 3.43Å
370	A	31.5	Very low	35.1	Very low	2 Å²	2	86.6 Å²	86.6	2%	0.017	49%	0.486	C	S	.	.	H	α-helix	trans	-73.8	-14.5	173.4	0	0	0	0	0	114.9	S366 N367 A441 E442 V445	S366-A370 WeakPolarHBondContact O-CB 3.47Å; S366-A370 PolarHBondContact O-N 3.13Å; S366-A370 VanDerWaalsContact O-N 3.1Å; N367-A370 CarbonylContact O-C 3.43Å; N367-A370 WeakPolarHBondContact O-CB 3.25Å; A370-A441 HydrophobicContact CB-CB 3.57Å; A370-E442 HydrophobicContact CB-CG 4.2Å; A370-V445 WeakPolarHBondContact O-CG2 3.46Å
371	T	31.2	Very low	34.5	Very low	75 Å²	75	90.9 Å²	90.9	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-119.4	-29.7	-177	-54.2	0	0	0	0	115	N367 S368 L369 H373 L374	N367-T371 WeakPolarHBondContact O-CB 3.41Å; N367-T371 PolarHBondContact O-N 2.96Å; N367-T371 PolarHBondContact O-OG1 3.36Å; S368-T371 PolarHBondContact O-N 3.35Å; L369-T371 VanDerWaalsContact C-N 3.34Å; L369-T371 PolarHBondContact O-N 2.72Å; T371-H373 VanDerWaalsContact C-N 3.3Å; T371-H373 PolarHBondContact O-N 2.86Å; T371-L374 WeakPolarHBondContact O-CB 3.42Å; T371-L374 PolarHBondContact O-N 2.87Å
372	M	29.6	Very low	33.7	Very low	129 Å²	129	95.7 Å²	95.7	64%	0.635	54%	0.535	S	S	*	.	H	α-helix	trans	-74.3	-18.9	178.7	-71.2	-159.7	-65.7	0	0	113.5	S368 L374	S368-M372 WeakPolarHBondContact O-CA 3.26Å; S368-M372 WeakPolarHBondContact O-CB 3.42Å; S368-M372 WeakPolarHBondContact O-CG 3.31Å; S368-M372 PolarHBondContact O-N 2.79Å; M372-L374 PolarHBondContact O-N 3Å
373	H	34.8	Very low	33	Very low	115 Å²	115	99.2 Å²	99.2	53%	0.532	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.7	9.7	171.9	-73.3	-42.4	0	0	0	113.3	T371 V445	T371-H373 VanDerWaalsContact C-N 3.3Å; T371-H373 PolarHBondContact O-N 2.86Å; H373-V445 HydrophobicContact CB-CB 4.18Å; H373-V445 HydrophobicContact CB-CG1 3.7Å; H373-V445 HydrophobicContact CB-CG2 3.61Å; H373-V445 VanDerWaalsContact CD2-CG1 3.45Å; H373-V445 WeakPolarHBondContact CD2-CG1 3.37Å
374	L	31.6	Very low	32	Very low	84 Å²	84	103.4 Å²	103.4	44%	0.44	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.1	4	-178.6	-90.6	163.6	0	0	0	115.8	T371 M372 K444	T371-L374 WeakPolarHBondContact O-CB 3.42Å; T371-L374 PolarHBondContact O-N 2.87Å; M372-L374 PolarHBondContact O-N 3Å; L374-K444 HydrophobicContact CD1-CB 3.97Å; L374-K444 HydrophobicContact CD1-CD 4.04Å; L374-K444 HydrophobicContact CD2-CB 4.08Å; L374-K444 HydrophobicContact CD2-CD 4.13Å; L374-K444 HydrophobicContact CD2-CG 4.46Å; L374-K444 HydrophobicContact CG-CB 4.26Å
375	T	31	Very low	31.4	Very low	110 Å²	110	108.5 Å²	108.5	68%	0.675	60%	0.602	S	S	*	*			trans	-124.7	103.9	173.6	62.4	0	0	0	0	112.8	K377	T375-K377 PolarHBondContact O-N 3.26Å
376	N	30.4	Very low	31	Very low	176 Å²	176	112 Å²	112	94%	0.941	62%	0.617	S	S	*	*			trans	-79.6	60.9	175.8	-117.2	-14.8	0	0	0	111.1
377	K	29.5	Very low	30.5	Very low	175 Å²	175	118.1 Å²	118.1	76%	0.761	64%	0.639	S	S	*	*			trans	-138	115.8	169.9	-75.8	-168.1	176.4	-178	0	110.3	T375 V379	T375-K377 PolarHBondContact O-N 3.26Å; K377-V379 PolarHBondContact O-N 3.24Å
378	P	29.1	Very low	30	Very low	132 Å²	132	122.8 Å²	122.8	86%	0.857	67%	0.669	S	S	*	*			trans	-70.9	118.5	176	28.9	-32.6	0	0	0	109.8
379	V	31.2	Very low	29.8	Very low	119 Å²	119	129.3 Å²	129.3	72%	0.721	70%	0.701	S	S	*	*			trans	-92.3	120.9	168.2	179.6	0	0	0	0	108	K377 T381	K377-V379 PolarHBondContact O-N 3.24Å; V379-T381 PolarHBondContact O-N 2.94Å; V379-T381 VanDerWaalsContact O-N 3.17Å
380	P	28.4	Very low	29.5	Very low	119 Å²	119	131 Å²	131	77%	0.773	72%	0.719	S	S	*	*			trans	-82	94.9	-177.4	31.7	-33.6	0	0	0	111.3	Q382	P380-Q382 VanDerWaalsContact C-N 3.35Å; P380-Q382 PolarHBondContact O-N 3.25Å
381	T	33.7	Very low	29.4	Very low	138 Å²	138	136.3 Å²	136.3	85%	0.847	75%	0.754	S	S	*	*			trans	-79.9	79	170.3	20	0	0	0	0	111.8	V379	V379-T381 PolarHBondContact O-N 2.94Å; V379-T381 VanDerWaalsContact O-N 3.17Å
382	Q	26.6	Very low	29.3	Very low	182 Å²	182	139.2 Å²	139.2	85%	0.85	78%	0.776	S	S	*	*			trans	-81.3	115.3	147.6	-71.5	-172.6	3.9	0	0	108.3	P380	P380-Q382 VanDerWaalsContact C-N 3.35Å; P380-Q382 PolarHBondContact O-N 3.25Å
383	T	30.8	Very low	29.3	Very low	125 Å²	125	136.5 Å²	136.5	77%	0.767	78%	0.781	S	S	*	*			trans	174.8	99.7	135.4	-70.1	0	0	0	0	110
384	T	25.8	Very low	28.9	Very low	112 Å²	112	134.9 Å²	134.9	69%	0.687	79%	0.788	S	S	*	*			trans	39.9	100.8	133.5	-41.8	0	0	0	0	120.1
385	L	29.5	Very low	28.6	Very low	180 Å²	180	138.4 Å²	138.4	94%	0.942	81%	0.807	S	S	*	*				-133.2	102.1	128.1	-91.9	173.4	0	0	0	108.5
386	Q	25.2	Very low	28.6	Very low	166 Å²	166	139.2 Å²	139.2	78%	0.776	81%	0.812	S	S	*	*			trans	-81.8	170.1	167.5	-76.4	-179.4	-31.9	0	0	110.4
387	Q	29.3	Very low	28.4	Very low	188 Å²	188	137.9 Å²	137.9	88%	0.879	81%	0.805	S	S	*	*			trans	86.1	120.9	178.9	-52.7	176.3	2.5	0	0	113
388	T	28.4	Very low	28.3	Very low	137 Å²	137	136.2 Å²	136.2	84%	0.84	80%	0.803	S	S	*	*			cis	-141.9	138.2	4.4	45.2	0	0	0	0	112.5
389	L	25.3	Very low	28.1	Very low	166 Å²	166	136.6 Å²	136.6	87%	0.869	80%	0.797	S	S	*	*			trans	-92.1	150.5	168.8	-83.2	157.9	0	0	0	111.3
390	S	26.5	Very low	27.9	Very low	120 Å²	120	137.4 Å²	137.4	84%	0.839	80%	0.797	S	S	*	*			trans	-149.4	106	151.7	57.8	0	0	0	0	109.8
391	P	28.8	Very low	27.7	Very low	115 Å²	115	140.9 Å²	140.9	75%	0.747	80%	0.8	S	S	*	*			trans	-110.8	140.7	-179.4	36.3	-28.6	0	0	0	113.8
392	C	29.4	Very low	27.5	Very low	135 Å²	135	139.3 Å²	139.3	91%	0.912	80%	0.795	S	S	*	*			trans	-148.9	153.3	154.8	62.5	0	0	0	0	107.4
393	G	29.2	Very low	27.6	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	79%	0.786	S	S	*	*			cis	172.8	90.3	-2	0	0	0	0	0	110.5
394	A	27	Very low	27.4	Very low	82 Å²	82	136.5 Å²	136.5	68%	0.678	79%	0.785	S	S	*	*			trans	36.6	141.1	141.2	0	0	0	0	0	123.8
395	N	26.5	Very low	27.6	Very low	158 Å²	158	142.4 Å²	142.4	85%	0.845	80%	0.796	S	S	*	*			trans	77.9	144	159.5	-45.4	-36.9	0	0	0	115.6
396	T	30.8	Very low	27.4	Very low	127 Å²	127	141.1 Å²	141.1	78%	0.779	79%	0.79	S	S	*	*			cis	-144.6	137.9	6.6	45.9	0	0	0	0	109.6
397	N	25.9	Very low	27.5	Very low	148 Å²	148	141.2 Å²	141.2	79%	0.791	80%	0.795	S	S	*	*				67.6	134.8	80.5	-121.9	1.7	0	0	0	117.4
398	I	27.4	Very low	27.4	Very low	140 Å²	140	138.6 Å²	138.6	72%	0.718	79%	0.792	S	S	*	*			trans	101.5	101	150	-65.3	165	0	0	0	122
399	L	24.6	Very low	27.1	Very low	139 Å²	139	139.5 Å²	139.5	73%	0.728	79%	0.787	S	S	*	*				62	125.5	129.4	-76.8	155.9	0	0	0	126
400	N	25.9	Very low	27.1	Very low	136 Å²	136	136.9 Å²	136.9	73%	0.727	78%	0.779	S	S	*	*			trans	45.9	129.7	132	-74.3	-3.3	0	0	0	120.6
401	K	25.7	Very low	27	Very low	193 Å²	193	136.8 Å²	136.8	84%	0.839	77%	0.774	S	S	*	*				173.7	165.7	69.4	-129.6	170	-174.6	-176.3	0	111.7
402	S	28.7	Very low	26.9	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	78%	0.778	S	S	*	*			trans	73.3	144.4	159.1	-119.3	0	0	0	0	117.9
403	T	28.2	Very low	26.6	Very low	109 Å²	109	141.1 Å²	141.1	67%	0.669	77%	0.771	S	S	*	*			cis	-168	148.1	-19.7	11.7	0	0	0	0	107
404	D	27.1	Very low	26.4	Very low	138 Å²	138	144.7 Å²	144.7	74%	0.738	77%	0.773	S	S	*	*			trans	40.7	123.9	158.7	-53.5	-26.5	0	0	0	120.8
405	Y	29.1	Very low	26.3	Very low	237 Å²	237	150.3 Å²	150.3	93%	0.929	78%	0.782	S	S	*	*				-165.6	131.7	115.8	-97.2	-63.7	0	0	0	110.8
406	D	25.9	Very low	26.4	Very low	153 Å²	153	150.8 Å²	150.8	82%	0.818	78%	0.778	S	S	*	*			trans	-66.2	145.7	179.1	-64.4	-73.9	0	0	0	113.6
407	L	27.5	Very low	26.3	Very low	168 Å²	168	148.4 Å²	148.4	88%	0.88	77%	0.766	S	S	*	*			trans	-164.8	88.6	147.8	-107	156.4	0	0	0	113.7
408	V	27.2	Very low	26.6	Very low	132 Å²	132	146.6 Å²	146.6	80%	0.8	77%	0.765	S	S	*	*			trans	37.8	111.8	144	-169.3	0	0	0	0	119.3
409	Q	22.9	Very low	26.8	Very low	157 Å²	157	142.5 Å²	142.5	73%	0.734	75%	0.748	S	S	*	*			trans	-68.2	145.8	167.8	-63.6	-177.8	-21.1	0	0	113.4	T411	Q409-T411 PolarHBondContact O-N 3.28Å
410	P	25.3	Very low	27	Very low	110 Å²	110	143.3 Å²	143.3	71%	0.714	75%	0.754	S	S	*	*			trans	-81	97.9	155.8	32.2	-29	0	0	0	109.8	F412	P410-F412 PolarHBondContact O-N 3.26Å
411	T	23.5	Very low	27.2	Very low	119 Å²	119	139.9 Å²	139.9	73%	0.73	74%	0.739	S	S	*	*			trans	-66.5	92.4	169.2	34.5	0	0	0	0	110.9	Q409 I413	Q409-T411 PolarHBondContact O-N 3.28Å; T411-I413 PolarHBondContact O-N 3.36Å
412	F	26	Very low	27.3	Very low	191 Å²	191	135.9 Å²	135.9	84%	0.838	74%	0.736	S	S	*	*			trans	-78.1	114.3	166	-97.5	-91.5	0	0	0	110.2	P410 L414	P410-F412 PolarHBondContact O-N 3.26Å; F412-L414 PolarHBondContact O-N 2.78Å; F412-L414 VanDerWaalsContact O-N 3.11Å
413	I	23.8	Very low	27.3	Very low	149 Å²	149	135.5 Å²	135.5	76%	0.764	73%	0.733	S	S	*	*			trans	-66.8	109.1	172.3	-62.4	173.7	0	0	0	107.9	T411 K415	T411-I413 PolarHBondContact O-N 3.36Å; I413-K415 PolarHBondContact O-N 3.4Å
414	L	25.2	Very low	27.2	Very low	147 Å²	147	140.4 Å²	140.4	77%	0.77	75%	0.745	S	S	*	*			trans	-59.6	99.8	165.1	-78.5	164.7	0	0	0	108.7	F412 H416	F412-L414 PolarHBondContact O-N 2.78Å; F412-L414 VanDerWaalsContact O-N 3.11Å; L414-H416 VanDerWaalsContact C-N 3.3Å; L414-H416 PolarHBondContact O-N 3.26Å
415	K	25.4	Very low	27.2	Very low	200 Å²	200	142.6 Å²	142.6	87%	0.87	75%	0.748	S	S	*	*			trans	-67.4	97.8	157.8	-83	-169.1	173.3	-173.3	0	106.9	I413 C417	I413-K415 PolarHBondContact O-N 3.4Å; K415-C417 PolarHBondContact O-N 3.4Å
416	H	28.3	Very low	27	Very low	168 Å²	168	136.7 Å²	136.7	78%	0.778	74%	0.741	S	S	*	*			trans	-48.5	125.3	173.8	-87.7	-92.7	0	0	0	110.2	L414 S418	L414-H416 VanDerWaalsContact C-N 3.3Å; L414-H416 PolarHBondContact O-N 3.26Å; H416-S418 PolarHBondContact O-N 3.29Å
417	C	29	Very low	27	Very low	78 Å²	78	140.5 Å²	140.5	53%	0.527	75%	0.745	S	S	.	*			trans	-65.6	120.5	165.7	-176.5	0	0	0	0	107.7	K415 C419	K415-C417 PolarHBondContact O-N 3.4Å; C417-C419 PolarHBondContact O-N 2.89Å
418	S	31.6	Very low	26.9	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	74%	0.739	S	S	*	*			trans	-71.8	28	-178.8	-52.7	0	0	0	0	114.3	H416	H416-S418 PolarHBondContact O-N 3.29Å
419	C	31.9	Very low	26.9	Very low	53 Å²	53	140.6 Å²	140.6	36%	0.358	74%	0.741	S	S	.	*			trans	-82.7	121.5	169.9	84.3	0	0	0	0	109.2	C417 C421 C462	C417-C419 PolarHBondContact O-N 2.89Å; C419-C421 HydrophobicContact CB-CB 4.37Å; C419-C421 WeakPolarHBondContact CB-SG 3.42Å; C419-C421 PolarHBondContact O-N 2.98Å; C419-C421 WeakPolarHBondContact SG-CB 3.4Å; C419-C421 CovalentContact SG-SG 2.06Å; C419-C421 PolarHBondContact SG-SG 3.39Å; C419-C462 VanDerWaalsContact SG-SG 3.66Å
420	D	28.5	Very low	27.2	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	74%	0.743	S	S	*	*			trans	-74.8	74.1	172.6	-163.6	2.1	0	0	0	109.4	S422	D420-S422 VanDerWaalsContact C-N 3.28Å; D420-S422 PolarHBondContact O-N 3.37Å
421	C	31.4	Very low	27.3	Very low	63 Å²	63	142.9 Å²	142.9	43%	0.426	75%	0.752	S	S	.	*			trans	-93.7	26	-166.6	-79.6	0	0	0	0	112.5	C419	C419-C421 HydrophobicContact CB-CB 4.37Å; C419-C421 WeakPolarHBondContact CB-SG 3.42Å; C419-C421 PolarHBondContact O-N 2.98Å; C419-C421 WeakPolarHBondContact SG-CB 3.4Å; C419-C421 CovalentContact SG-SG 2.06Å; C419-C421 PolarHBondContact SG-SG 3.39Å
422	S	26.1	Very low	27.5	Very low	110 Å²	110	144.4 Å²	144.4	77%	0.769	76%	0.755	S	S	*	*			trans	-104.5	71	-175.3	-60.6	0	0	0	0	112.9	D420	D420-S422 VanDerWaalsContact C-N 3.28Å; D420-S422 PolarHBondContact O-N 3.37Å
423	S	30.1	Very low	27.6	Very low	96 Å²	96	144.7 Å²	144.7	67%	0.671	76%	0.759	S	S	*	*			trans	-144.6	133.2	167	48.5	0	0	0	0	113.5
424	K	25.6	Very low	27.8	Very low	212 Å²	212	143.1 Å²	143.1	92%	0.922	76%	0.761	S	S	*	*			trans	-66.4	137.1	179.1	-61.2	169.8	178.8	174.9	0	110.1
425	F	27.4	Very low	28	Very low	185 Å²	185	142.3 Å²	142.3	81%	0.811	77%	0.765	S	S	*	*			trans	-127	118	167.9	-103.2	-90	0	0	0	111.3
426	S	24.4	Very low	28.3	Very low	112 Å²	112	134.7 Å²	134.7	78%	0.783	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-89.3	138.2	165.5	54.2	0	0	0	0	109.8
427	W	26.5	Very low	28.7	Very low	233 Å²	233	129.5 Å²	129.5	88%	0.883	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-78.8	124.4	177.4	-62.5	86.2	0	0	0	111.3
428	S	25.7	Very low	29.6	Very low	110 Å²	110	126.4 Å²	126.4	77%	0.769	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-80.9	135.4	154.4	52.7	0	0	0	0	108.6
429	K	26.4	Very low	30.3	Very low	192 Å²	192	121.5 Å²	121.5	84%	0.835	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-69.6	136.5	162.4	-69.3	173.1	177.1	174	0	108
430	D	28.1	Very low	30.6	Very low	147 Å²	147	120.7 Å²	120.7	79%	0.786	67%	0.665	S	S	*	*			trans	154.8	97.1	139.9	-75.1	-15.7	0	0	0	108.5
431	D	28.4	Very low	31	Very low	169 Å²	169	113.5 Å²	113.5	90%	0.904	63%	0.627	S	S	*	*			trans	170.5	97.8	151.8	-92.5	-21	0	0	0	108.3
432	L	27	Very low	31.6	Very low	150 Å²	150	115.2 Å²	115.2	79%	0.785	63%	0.629	S	S	*	*			trans	-146.9	87.3	-172	-169.1	104.8	0	0	0	111.4
433	Q	27.8	Very low	32.5	Very low	198 Å²	198	111.1 Å²	111.1	93%	0.925	60%	0.598	S	S	*	*			trans	-161.1	86.1	172.7	-113.6	159.5	47.5	0	0	114.4
434	S	28.4	Very low	32.8	Very low	115 Å²	115	112.5 Å²	112.5	80%	0.804	59%	0.592	S	S	*	*			trans	163.5	122.6	143.8	59	0	0	0	0	109.8
435	P	30.4	Very low	33.5	Very low	130 Å²	130	103.5 Å²	103.5	84%	0.844	56%	0.555	S	S	*	*			trans	-99.2	127.4	-174.1	35.1	-30.3	0	0	0	113.9
436	G	30.9	Very low	34.1	Very low	41 Å²	41	98 Å²	98	42%	0.423	55%	0.55	S	S	.	*			trans	-133	118.2	158.2	0	0	0	0	0	109.6
437	P	38.1	Very low	35.9	Very low	59 Å²	59	99.1 Å²	99.1	38%	0.383	54%	0.541	S	S	.	.			trans	-89.3	132.6	173.2	33.5	-28.9	0	0	0	109.7	A441	P437-A441 HydrophobicContact CB-CB 3.96Å
438	N	47.7	Very low	38.3	Very low	13 Å²	13	89.8 Å²	89.8	7%	0.07	51%	0.508	C	S	.	.	S	Bend		-150	-32.3	72.2	-138.7	-4.7	0	0	0	114.3	H149 N367 A440 A441 E442	H149-N438 HydrophobicContact CB-CB 3.58Å; H149-N438 VanDerWaalsContact CD2-CB 3.45Å; H149-N438 WeakPolarHBondContact CD2-CB 3.49Å; H149-N438 PolarHBondContact CD2-N 3.42Å; N367-N438 PolarHBondContact OD1-ND2 3.3Å; N438-A440 PolarHBondContact O-N 2.89Å; N438-A441 WeakPolarHBondContact O-CA 3.31Å; N438-A441 WeakPolarHBondContact O-CB 3.4Å; N438-A441 PolarHBondContact O-N 3.11Å; N438-E442 PolarHBondContact O-N 2.71Å
439	L	46	Very low	41	Very low	7 Å²	7	87.9 Å²	87.9	4%	0.037	49%	0.489	C	S	.	.	H	α-helix	trans	-61.4	-46.7	173.2	-168.8	69.4	0	0	0	110.2	H149 A441 E442 M443 C473 L483	H149-L439 PolarHBondContact NE2-N 2.84Å; L439-A441 PolarHBondContact O-N 2.81Å; L439-A441 VanDerWaalsContact O-N 3.1Å; L439-E442 PolarHBondContact O-N 3.42Å; L439-M443 HydrophobicContact CG-CG 4.42Å; L439-M443 HydrophobicContact CG-SD 4.33Å; L439-M443 VanDerWaalsContact O-CB 3.23Å; L439-M443 WeakPolarHBondContact O-CB 3.09Å; L439-M443 WeakPolarHBondContact O-CG 3.48Å; L439-M443 PolarHBondContact O-N 3.36Å; L439-C473 HydrophobicContact CD2-CB 4.24Å; L439-L483 HydrophobicContact CD1-CD2 4.47Å
440	A	38.3	Very low	43.9	Very low	35 Å²	35	82.7 Å²	82.7	29%	0.289	47%	0.468	S	S	.	.	H	α-helix	trans	-60.4	-20.7	174.2	0	0	0	0	0	113.8	N438 K444	N438-A440 PolarHBondContact O-N 2.89Å; A440-K444 WeakPolarHBondContact O-CB 3.11Å; A440-K444 WeakPolarHBondContact O-CD 3.39Å; A440-K444 WeakPolarHBondContact O-CG 3.45Å; A440-K444 PolarHBondContact O-N 3.03Å
441	A	37.1	Very low	46.7	Very low	7 Å²	7	79.1 Å²	79.1	6%	0.058	45%	0.448	C	S	.	.	H	α-helix	trans	-87	-47.6	178.2	0	0	0	0	0	111.1	A370 P437 N438 L439 M443 K444 V445	A370-A441 HydrophobicContact CB-CB 3.57Å; P437-A441 HydrophobicContact CB-CB 3.96Å; N438-A441 WeakPolarHBondContact O-CA 3.31Å; N438-A441 WeakPolarHBondContact O-CB 3.4Å; N438-A441 PolarHBondContact O-N 3.11Å; L439-A441 PolarHBondContact O-N 2.81Å; L439-A441 VanDerWaalsContact O-N 3.1Å; A441-M443 PolarHBondContact O-N 3.36Å; A441-K444 PolarHBondContact O-N 3.46Å; A441-V445 VanDerWaalsContact O-CG2 3.28Å; A441-V445 WeakPolarHBondContact O-CG2 3.37Å; A441-V445 PolarHBondContact O-N 3.05Å
442	E	42.3	Very low	49.6	Very low	99 Å²	99	71.1 Å²	71.1	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-57.5	-36.9	170.2	-69.7	-171.7	153.1	0	0	111.7	A370 N438 L439 V445 G446	A370-E442 HydrophobicContact CB-CG 4.2Å; N438-E442 PolarHBondContact O-N 2.71Å; L439-E442 PolarHBondContact O-N 3.42Å; E442-V445 PolarHBondContact O-N 3.07Å; E442-G446 PolarHBondContact O-N 3.5Å
443	M	45.4	Very low	52.5	Low	23 Å²	23	64 Å²	64	11%	0.113	37%	0.368	C	S	.	.	H	α-helix	trans	-74.3	-30.9	178.4	-70.9	-155.4	69.6	0	0	114.6	L439 A441 V445 L448 L470 L471	L439-M443 HydrophobicContact CG-CG 4.42Å; L439-M443 HydrophobicContact CG-SD 4.33Å; L439-M443 VanDerWaalsContact O-CB 3.23Å; L439-M443 WeakPolarHBondContact O-CB 3.09Å; L439-M443 WeakPolarHBondContact O-CG 3.48Å; L439-M443 PolarHBondContact O-N 3.36Å; A441-M443 PolarHBondContact O-N 3.36Å; M443-V445 PolarHBondContact O-N 2.85Å; M443-L448 HydrophobicContact CE-CD1 4.08Å; M443-L448 HydrophobicContact CE-CD2 4.04Å; M443-L448 HydrophobicContact CE-CG 4.42Å; M443-L448 HydrophobicContact CG-CD2 4.19Å; M443-L448 HydrophobicContact SD-CD2 4.48Å; M443-L470 VanDerWaalsContact CE-C 3.45Å; M443-L470 HydrophobicContact CE-CB 3.57Å; M443-L470 HydrophobicContact SD-CB 3.77Å; M443-L471 VanDerWaalsContact CE-CA 3.5Å; M443-L471 HydrophobicContact CE-CB 4.18Å; M443-L471 HydrophobicContact CE-CD2 3.76Å; M443-L471 HydrophobicContact CE-CG 3.69Å; M443-L471 VanDerWaalsContact CE-N 3.32Å
444	K	37.9	Very low	55.4	Low	126 Å²	126	60.2 Å²	60.2	55%	0.548	35%	0.352	S	S	.	.	H	α-helix	trans	-69.1	-10.6	169.8	-85.4	171.4	-178.1	175.1	0	113.3	L374 A440 A441	L374-K444 HydrophobicContact CD1-CB 3.97Å; L374-K444 HydrophobicContact CD1-CD 4.04Å; L374-K444 HydrophobicContact CD2-CB 4.08Å; L374-K444 HydrophobicContact CD2-CD 4.13Å; L374-K444 HydrophobicContact CD2-CG 4.46Å; L374-K444 HydrophobicContact CG-CB 4.26Å; A440-K444 WeakPolarHBondContact O-CB 3.11Å; A440-K444 WeakPolarHBondContact O-CD 3.39Å; A440-K444 WeakPolarHBondContact O-CG 3.45Å; A440-K444 PolarHBondContact O-N 3.03Å; A441-K444 PolarHBondContact O-N 3.46Å
445	V	39.9	Very low	58.4	Low	23 Å²	23	56.6 Å²	56.6	14%	0.139	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-2.5	-171.6	166.5	0	0	0	0	113.4	L369 A370 H373 A441 E442 M443 K447	L369-V445 WeakPolarHBondContact O-CG1 3.43Å; A370-V445 WeakPolarHBondContact O-CG2 3.46Å; H373-V445 HydrophobicContact CB-CB 4.18Å; H373-V445 HydrophobicContact CB-CG1 3.7Å; H373-V445 HydrophobicContact CB-CG2 3.61Å; H373-V445 VanDerWaalsContact CD2-CG1 3.45Å; H373-V445 WeakPolarHBondContact CD2-CG1 3.37Å; A441-V445 VanDerWaalsContact O-CG2 3.28Å; A441-V445 WeakPolarHBondContact O-CG2 3.37Å; A441-V445 PolarHBondContact O-N 3.05Å; E442-V445 PolarHBondContact O-N 3.07Å; M443-V445 PolarHBondContact O-N 2.85Å; V445-K447 VanDerWaalsContact C-N 3.35Å; V445-K447 PolarHBondContact O-N 2.82Å
446	G	39.8	Very low	61.4	Low	69 Å²	69	50.4 Å²	50.4	71%	0.711	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	21.9	166.9	0	0	0	0	0	115.5	E442	E442-G446 PolarHBondContact O-N 3.5Å
447	K	60.9	Low	64.4	Low	136 Å²	136	52 Å²	52	59%	0.591	28%	0.279	S	S	*	.			trans	-107.9	45	175.5	-69	-176.5	179	173.4	0	112.6	V445	V445-K447 VanDerWaalsContact C-N 3.35Å; V445-K447 PolarHBondContact O-N 2.82Å
448	L	77.1	Confident	67	Low	37 Å²	37	53.7 Å²	53.7	19%	0.194	29%	0.293	C	S	.	.			trans	-60.1	140.1	165.2	-72.6	-179.8	0	0	0	109.3	M443 E450 I453 L467 L470 Y482	M443-L448 HydrophobicContact CE-CD1 4.08Å; M443-L448 HydrophobicContact CE-CD2 4.04Å; M443-L448 HydrophobicContact CE-CG 4.42Å; M443-L448 HydrophobicContact CG-CD2 4.19Å; M443-L448 HydrophobicContact SD-CD2 4.48Å; L448-E450 PolarHBondContact O-N 3.39Å; L448-I453 HydrophobicContact CB-CD1 3.97Å; L448-I453 HydrophobicContact CD1-CD1 4.17Å; L448-L467 HydrophobicContact CD1-CD2 3.51Å; L448-L470 HydrophobicContact CD1-CD1 4.29Å; L448-L470 HydrophobicContact CD2-CD1 4.09Å; L448-Y482 HydrophobicContact CD2-CE2 4.5Å
449	N	83.2	Confident	69.1	Low	69 Å²	69	57.5 Å²	57.5	37%	0.369	31%	0.307	S	S	.	.			trans	-77.5	94.8	-178.6	-172.1	-32.8	0	0	0	109.2	L451 V452 I453 Y482	N449-L451 PolarHBondContact O-N 3.38Å; N449-L451 WeakPolarHBondContact OD1-CB 3.24Å; N449-L451 PolarHBondContact OD1-N 2.71Å; N449-V452 HydrophobicContact CB-CB 4.12Å; N449-V452 HydrophobicContact CB-CG2 3.92Å; N449-V452 WeakPolarHBondContact O-CA 3.13Å; N449-V452 WeakPolarHBondContact O-CB 3.38Å; N449-V452 PolarHBondContact O-N 2.7Å; N449-V452 PolarHBondContact OD1-N 2.84Å; N449-I453 PolarHBondContact O-N 2.84Å; N449-Y482 HydrophobicContact CB-CE2 4.47Å; N449-Y482 PolarHBondContact N-OH 3.3Å
450	E	87.5	Confident	71.2	Confident	83 Å²	83	59.9 Å²	59.9	39%	0.388	33%	0.333	S	S	.	.	H	α-helix	trans	-58.2	-31.9	-179.4	-74	-62.2	159	0	0	113.1	L448 V452 I453 M454 R463	L448-E450 PolarHBondContact O-N 3.39Å; E450-V452 VanDerWaalsContact C-N 3.33Å; E450-V452 PolarHBondContact O-N 3.29Å; E450-I453 PolarHBondContact O-N 3.36Å; E450-M454 WeakPolarHBondContact O-CB 3.4Å; E450-M454 VanDerWaalsContact O-CG 3.27Å; E450-M454 WeakPolarHBondContact O-CG 3.45Å; E450-M454 PolarHBondContact O-N 2.79Å; E450-R463 IonicContact OE1-CZ 2.92Å; E450-R463 IonicContact OE1-NH2 3.87Å; E450-R463 PolarHBondContact OE1-NH2 3.11Å; E450-R463 IonicContact OE2-CZ 3.98Å; E450-R463 VanDerWaalsContact OE2-CZ 3.22Å; E450-R463 IonicContact OE2-NH1 2.76Å; E450-R463 PolarHBondContact OE2-NH1 3.36Å; E450-R463 IonicContact OE2-NH2 3.91Å; E450-R463 PolarHBondContact OE2-NH2 3.49Å
451	L	86.5	Confident	73.8	Confident	72 Å²	72	59.3 Å²	59.3	38%	0.377	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-40.6	173.1	176.7	63.5	0	0	0	111.2	N449 I455 L489	N449-L451 PolarHBondContact O-N 3.38Å; N449-L451 WeakPolarHBondContact OD1-CB 3.24Å; N449-L451 PolarHBondContact OD1-N 2.71Å; L451-I455 HydrophobicContact CD1-CD1 4.23Å; L451-I455 HydrophobicContact CD1-CG1 4.48Å; L451-I455 HydrophobicContact CG-CD1 4.08Å; L451-I455 WeakPolarHBondContact O-CD1 3.21Å; L451-I455 WeakPolarHBondContact O-CG1 2.97Å; L451-I455 PolarHBondContact O-N 3.35Å; L451-L489 HydrophobicContact CD2-CD1 4.28Å
452	V	88.9	Confident	76.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-43.6	173.6	174.9	0	0	0	0	110.9	N449 E450 I455 M456 Y482 L485 L489	N449-V452 HydrophobicContact CB-CB 4.12Å; N449-V452 HydrophobicContact CB-CG2 3.92Å; N449-V452 WeakPolarHBondContact O-CA 3.13Å; N449-V452 WeakPolarHBondContact O-CB 3.38Å; N449-V452 PolarHBondContact O-N 2.7Å; N449-V452 PolarHBondContact OD1-N 2.84Å; E450-V452 VanDerWaalsContact C-N 3.33Å; E450-V452 PolarHBondContact O-N 3.29Å; V452-I455 PolarHBondContact O-N 3.11Å; V452-M456 HydrophobicContact CG1-CG 4.47Å; V452-M456 HydrophobicContact CG1-SD 4.1Å; V452-M456 VanDerWaalsContact O-CG 3.31Å; V452-M456 WeakPolarHBondContact O-CG 3.33Å; V452-M456 PolarHBondContact O-N 2.86Å; V452-Y482 HydrophobicContact CB-CD2 4.11Å; V452-Y482 HydrophobicContact CB-CE2 4.01Å; V452-Y482 HydrophobicContact CG1-CD2 3.41Å; V452-Y482 VanDerWaalsContact CG1-CD2 3.41Å; V452-Y482 HydrophobicContact CG1-CE2 3.83Å; V452-Y482 HydrophobicContact CG1-CG 4.05Å; V452-L485 HydrophobicContact CG1-CB 3.67Å; V452-L485 HydrophobicContact CG1-CD1 4.03Å; V452-L485 HydrophobicContact CG2-CB 4.37Å; V452-L489 HydrophobicContact CG2-CD1 3.53Å
453	I	89.4	Confident	79	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-45.7	178.8	-58.2	172.6	0	0	0	110.4	L448 N449 E450 I455 M456 E457 R463 I466 L467 Y482	L448-I453 HydrophobicContact CB-CD1 3.97Å; L448-I453 HydrophobicContact CD1-CD1 4.17Å; N449-I453 PolarHBondContact O-N 2.84Å; E450-I453 PolarHBondContact O-N 3.36Å; I453-I455 VanDerWaalsContact C-N 3.31Å; I453-I455 PolarHBondContact O-N 3.27Å; I453-M456 CarbonylContact O-C 3.58Å; I453-M456 WeakPolarHBondContact O-CA 3.5Å; I453-M456 WeakPolarHBondContact O-CB 3.38Å; I453-M456 PolarHBondContact O-N 3.22Å; I453-E457 HydrophobicContact CG2-CG 4.37Å; I453-E457 WeakPolarHBondContact O-CG 3.45Å; I453-E457 PolarHBondContact O-N 3.48Å; I453-R463 HydrophobicContact CG2-CG 4.09Å; I453-R463 VanDerWaalsContact CG2-NH1 3.33Å; I453-I466 HydrophobicContact CG2-CD1 4.32Å; I453-L467 HydrophobicContact CD1-CD2 3.98Å; I453-Y482 HydrophobicContact CG1-CD2 4.34Å; I453-Y482 HydrophobicContact CG1-CE2 4.1Å
454	M	88.8	Confident	81.2	Confident	119 Å²	119	60.2 Å²	60.2	59%	0.586	33%	0.329	S	S	*	.	H	α-helix	trans	-58.9	-40.2	174.9	-72.9	175.8	66.1	0	0	112.4	E450 E457 S458	E450-M454 WeakPolarHBondContact O-CB 3.4Å; E450-M454 VanDerWaalsContact O-CG 3.27Å; E450-M454 WeakPolarHBondContact O-CG 3.45Å; E450-M454 PolarHBondContact O-N 2.79Å; M454-E457 PolarHBondContact O-N 3.41Å; M454-S458 PolarHBondContact O-N 3.07Å
455	I	90.3	Very high	83.8	Confident	39 Å²	39	59.6 Å²	59.6	20%	0.2	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-45.7	173.2	-69.5	162.6	0	0	0	109.8	L451 V452 I453 E457 S458 Y459 L485 L489	L451-I455 HydrophobicContact CD1-CD1 4.23Å; L451-I455 HydrophobicContact CD1-CG1 4.48Å; L451-I455 HydrophobicContact CG-CD1 4.08Å; L451-I455 WeakPolarHBondContact O-CD1 3.21Å; L451-I455 WeakPolarHBondContact O-CG1 2.97Å; L451-I455 PolarHBondContact O-N 3.35Å; V452-I455 PolarHBondContact O-N 3.11Å; I453-I455 VanDerWaalsContact C-N 3.31Å; I453-I455 PolarHBondContact O-N 3.27Å; I455-E457 PolarHBondContact O-N 3.2Å; I455-S458 WeakPolarHBondContact O-CB 3.36Å; I455-S458 PolarHBondContact O-N 2.92Å; I455-S458 VanDerWaalsContact O-N 3.14Å; I455-S458 PolarHBondContact O-OG 3.16Å; I455-Y459 HydrophobicContact CG2-CD2 4.02Å; I455-Y459 HydrophobicContact CG2-CE2 3.81Å; I455-Y459 VanDerWaalsContact O-CD2 3.27Å; I455-Y459 WeakPolarHBondContact O-CD2 3.28Å; I455-Y459 PolarHBondContact O-N 3.38Å; I455-L485 HydrophobicContact CB-CD1 4.37Å; I455-L485 HydrophobicContact CG2-CD1 3.82Å; I455-L485 HydrophobicContact CG2-CD2 3.93Å; I455-L489 HydrophobicContact CD1-CD1 4.48Å; I455-L489 HydrophobicContact CD1-CD2 4.46Å
456	M	93.3	Very high	86.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-41.4	176.8	-66.8	172.8	72.8	0	0	112.6	V452 I453 S458 Y459 G460 M461 I466 L478 T481 Y482 L485	V452-M456 HydrophobicContact CG1-CG 4.47Å; V452-M456 HydrophobicContact CG1-SD 4.1Å; V452-M456 VanDerWaalsContact O-CG 3.31Å; V452-M456 WeakPolarHBondContact O-CG 3.33Å; V452-M456 PolarHBondContact O-N 2.86Å; I453-M456 CarbonylContact O-C 3.58Å; I453-M456 WeakPolarHBondContact O-CA 3.5Å; I453-M456 WeakPolarHBondContact O-CB 3.38Å; I453-M456 PolarHBondContact O-N 3.22Å; M456-S458 VanDerWaalsContact C-N 3.28Å; M456-S458 PolarHBondContact O-N 3.23Å; M456-Y459 PolarHBondContact O-N 2.7Å; M456-Y459 VanDerWaalsContact O-N 3.08Å; M456-G460 PolarHBondContact O-N 2.91Å; M456-M461 HydrophobicContact CB-CB 4.36Å; M456-M461 HydrophobicContact CB-CE 3.7Å; M456-M461 HydrophobicContact CB-SD 4.2Å; M456-M461 HydrophobicContact CE-CE 4.41Å; M456-M461 HydrophobicContact CE-SD 3.69Å; M456-M461 HydrophobicContact CG-CE 3.9Å; M456-M461 HydrophobicContact CG-SD 4.38Å; M456-M461 WeakPolarHBondContact O-CB 3.36Å; M456-M461 PolarHBondContact O-N 3.16Å; M456-M461 VanDerWaalsContact O-N 3.15Å; M456-I466 HydrophobicContact CB-CD1 3.57Å; M456-I466 HydrophobicContact CE-CB 4.48Å; M456-I466 HydrophobicContact CE-CD1 3.94Å; M456-I466 HydrophobicContact CE-CG1 3.8Å; M456-I466 HydrophobicContact CE-CG2 3.91Å; M456-I466 HydrophobicContact SD-CD1 4.29Å; M456-I466 HydrophobicContact SD-CG2 4.11Å; M456-L478 HydrophobicContact CE-CB 4.44Å; M456-L478 HydrophobicContact CE-CD2 4.49Å; M456-L478 VanDerWaalsContact CE-O 3.26Å; M456-L478 WeakPolarHBondContact CE-O 3.04Å; M456-T481 HydrophobicContact CE-CG2 4.28Å; M456-T481 HydrophobicContact CG-CG2 4.27Å; M456-Y482 HydrophobicContact SD-CD2 4.04Å; M456-Y482 HydrophobicContact SD-CG 4.37Å; M456-L485 HydrophobicContact CG-CD1 3.46Å; M456-L485 VanDerWaalsContact CG-CD1 3.46Å; M456-L485 HydrophobicContact SD-CD1 4.42Å
457	E	94.5	Very high	88.6	Confident	74 Å²	74	57.5 Å²	57.5	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-59.8	-38.4	173.6	-69.7	-178.7	84.4	0	0	111.1	I453 M454 I455 Y459 G460 R463 I466	I453-E457 HydrophobicContact CG2-CG 4.37Å; I453-E457 WeakPolarHBondContact O-CG 3.45Å; I453-E457 PolarHBondContact O-N 3.48Å; M454-E457 PolarHBondContact O-N 3.41Å; I455-E457 PolarHBondContact O-N 3.2Å; E457-Y459 VanDerWaalsContact C-N 3.27Å; E457-Y459 PolarHBondContact O-N 2.74Å; E457-G460 WeakPolarHBondContact O-CA 3.42Å; E457-G460 PolarHBondContact O-N 3.19Å; E457-R463 HydrophobicContact CG-CB 4.11Å; E457-R463 WeakPolarHBondContact OE1-CB 3.41Å; E457-R463 WeakPolarHBondContact OE2-CD 3.37Å; E457-R463 IonicContact OE2-CZ 3.22Å; E457-R463 IonicContact OE2-NH1 2.82Å; E457-R463 PolarHBondContact OE2-NH1 3.08Å; E457-I466 HydrophobicContact CG-CD1 4.49Å
458	S	92.5	Very high	89.9	Confident	95 Å²	95	56.8 Å²	56.8	66%	0.664	30%	0.297	S	S	*	.	H	α-helix	trans	-66.9	-23.4	175	81.2	0	0	0	0	114.3	M454 I455 M456 G460	M454-S458 PolarHBondContact O-N 3.07Å; I455-S458 WeakPolarHBondContact O-CB 3.36Å; I455-S458 PolarHBondContact O-N 2.92Å; I455-S458 VanDerWaalsContact O-N 3.14Å; I455-S458 PolarHBondContact O-OG 3.16Å; M456-S458 VanDerWaalsContact C-N 3.28Å; M456-S458 PolarHBondContact O-N 3.23Å; S458-G460 VanDerWaalsContact C-N 3.25Å
459	Y	90.9	Very high	90.4	Very high	94 Å²	94	55.8 Å²	55.8	37%	0.369	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	5	169.1	-78.7	-76.3	0	0	0	113.2	I115 I455 M456 E457 M461 M524	I115-Y459 HydrophobicContact CG2-CD1 3.95Å; I115-Y459 HydrophobicContact CG2-CD2 3.9Å; I115-Y459 HydrophobicContact CG2-CE1 3.99Å; I115-Y459 HydrophobicContact CG2-CE2 3.95Å; I115-Y459 HydrophobicContact CG2-CG 3.91Å; I115-Y459 PolarHBondContact O-OH 3.18Å; I455-Y459 HydrophobicContact CG2-CD2 4.02Å; I455-Y459 HydrophobicContact CG2-CE2 3.81Å; I455-Y459 VanDerWaalsContact O-CD2 3.27Å; I455-Y459 WeakPolarHBondContact O-CD2 3.28Å; I455-Y459 PolarHBondContact O-N 3.38Å; M456-Y459 PolarHBondContact O-N 2.7Å; M456-Y459 VanDerWaalsContact O-N 3.08Å; E457-Y459 VanDerWaalsContact C-N 3.27Å; E457-Y459 PolarHBondContact O-N 2.74Å; Y459-M461 HydrophobicContact CG-CE 4.41Å; Y459-M524 WeakPolarHBondContact OH-CE 3.48Å; Y459-M524 PolarHBondContact OH-SD 3.24Å; Y459-M524 VanDerWaalsContact OH-SD 3.35Å
460	G	91.5	Very high	90.6	Very high	56 Å²	56	52.5 Å²	52.5	58%	0.577	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	7.3	177.6	0	0	0	0	0	115.2	M456 E457 S458	M456-G460 PolarHBondContact O-N 2.91Å; E457-G460 WeakPolarHBondContact O-CA 3.42Å; E457-G460 PolarHBondContact O-N 3.19Å; S458-G460 VanDerWaalsContact C-N 3.25Å
461	M	93.2	Very high	90.6	Very high	24 Å²	24	53.3 Å²	53.3	12%	0.118	28%	0.282	C	S	.	.			trans	-77.4	131.7	177	-70	171.2	-91.7	0	0	111.1	I115 M456 Y459 R463 I466 L478 T481	I115-M461 HydrophobicContact CD1-CE 4.33Å; I115-M461 HydrophobicContact CG2-CE 4.49Å; M456-M461 HydrophobicContact CB-CB 4.36Å; M456-M461 HydrophobicContact CB-CE 3.7Å; M456-M461 HydrophobicContact CB-SD 4.2Å; M456-M461 HydrophobicContact CE-CE 4.41Å; M456-M461 HydrophobicContact CE-SD 3.69Å; M456-M461 HydrophobicContact CG-CE 3.9Å; M456-M461 HydrophobicContact CG-SD 4.38Å; M456-M461 WeakPolarHBondContact O-CB 3.36Å; M456-M461 PolarHBondContact O-N 3.16Å; M456-M461 VanDerWaalsContact O-N 3.15Å; Y459-M461 HydrophobicContact CG-CE 4.41Å; M461-R463 PolarHBondContact O-N 3.2Å; M461-I466 HydrophobicContact CB-CD1 3.82Å; M461-I466 HydrophobicContact CB-CG1 4.14Å; M461-L478 HydrophobicContact CB-CD2 4.07Å; M461-L478 HydrophobicContact CG-CD2 3.77Å; M461-L478 HydrophobicContact SD-CD2 3.64Å; M461-T481 HydrophobicContact CE-CG2 3.77Å; M461-T481 HydrophobicContact SD-CG2 4.1Å
462	C	94.5	Very high	90.5	Very high	16 Å²	16	59.5 Å²	59.5	11%	0.108	30%	0.3	C	S	.	.			trans	-71.5	119.6	-177.5	176	0	0	0	0	111.8	C419 T464 Q465 I466	C419-C462 VanDerWaalsContact SG-SG 3.66Å; C462-T464 VanDerWaalsContact C-N 3.28Å; C462-T464 PolarHBondContact O-N 3.43Å; C462-Q465 HydrophobicContact CB-CB 4.16Å; C462-Q465 HydrophobicContact CB-CG 3.97Å; C462-Q465 WeakPolarHBondContact O-CA 3.44Å; C462-Q465 WeakPolarHBondContact O-CB 3.32Å; C462-Q465 PolarHBondContact O-N 2.94Å; C462-I466 WeakPolarHBondContact O-CG1 3.35Å; C462-I466 PolarHBondContact O-N 3.05Å
463	R	92.6	Very high	90.2	Very high	77 Å²	77	61.3 Å²	61.3	29%	0.291	31%	0.313	S	S	.	.	H	α-helix	trans	-46.3	-46.7	176.7	-166	176.7	174.1	84.7	8.9	114	E450 I453 E457 M461 Q465 I466 L467	E450-R463 IonicContact OE1-CZ 2.92Å; E450-R463 IonicContact OE1-NH2 3.87Å; E450-R463 PolarHBondContact OE1-NH2 3.11Å; E450-R463 IonicContact OE2-CZ 3.98Å; E450-R463 VanDerWaalsContact OE2-CZ 3.22Å; E450-R463 IonicContact OE2-NH1 2.76Å; E450-R463 PolarHBondContact OE2-NH1 3.36Å; E450-R463 IonicContact OE2-NH2 3.91Å; E450-R463 PolarHBondContact OE2-NH2 3.49Å; I453-R463 HydrophobicContact CG2-CG 4.09Å; I453-R463 VanDerWaalsContact CG2-NH1 3.33Å; E457-R463 HydrophobicContact CG-CB 4.11Å; E457-R463 WeakPolarHBondContact OE1-CB 3.41Å; E457-R463 WeakPolarHBondContact OE2-CD 3.37Å; E457-R463 IonicContact OE2-CZ 3.22Å; E457-R463 IonicContact OE2-NH1 2.82Å; E457-R463 PolarHBondContact OE2-NH1 3.08Å; M461-R463 PolarHBondContact O-N 3.2Å; R463-Q465 VanDerWaalsContact C-N 3.27Å; R463-Q465 PolarHBondContact O-N 3.34Å; R463-I466 PolarHBondContact O-N 2.84Å; R463-L467 HydrophobicContact CG-CD1 4.12Å; R463-L467 HydrophobicContact CG-CG 4.45Å; R463-L467 WeakPolarHBondContact O-CB 3.42Å; R463-L467 WeakPolarHBondContact O-CG 3.36Å; R463-L467 PolarHBondContact O-N 3.09Å
464	T	91.8	Very high	90.1	Very high	54 Å²	54	63.6 Å²	63.6	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-33.4	178.8	-53.9	0	0	0	0	112.6	C462 K468	C462-T464 VanDerWaalsContact C-N 3.28Å; C462-T464 PolarHBondContact O-N 3.43Å; T464-K468 HydrophobicContact CG2-CD 4.33Å; T464-K468 WeakPolarHBondContact O-CB 3.48Å; T464-K468 WeakPolarHBondContact O-CD 2.93Å; T464-K468 WeakPolarHBondContact O-CG 3.37Å; T464-K468 PolarHBondContact O-N 2.86Å
465	Q	93	Very high	90.3	Very high	114 Å²	114	58.2 Å²	58.2	53%	0.533	30%	0.304	S	S	.	.	H	α-helix	trans	-76.6	-44.3	174.9	-65.4	177.5	-19.6	0	0	111	C462 R463 L467 K468 S469 L478	C462-Q465 HydrophobicContact CB-CB 4.16Å; C462-Q465 HydrophobicContact CB-CG 3.97Å; C462-Q465 WeakPolarHBondContact O-CA 3.44Å; C462-Q465 WeakPolarHBondContact O-CB 3.32Å; C462-Q465 PolarHBondContact O-N 2.94Å; R463-Q465 VanDerWaalsContact C-N 3.27Å; R463-Q465 PolarHBondContact O-N 3.34Å; Q465-L467 PolarHBondContact O-N 2.92Å; Q465-K468 PolarHBondContact O-N 2.94Å; Q465-K468 VanDerWaalsContact O-N 3.16Å; Q465-S469 PolarHBondContact O-N 3.15Å; Q465-S469 PolarHBondContact O-OG 3.45Å; Q465-L478 HydrophobicContact CB-CD1 3.73Å
466	I	89.2	Confident	90.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-53	-54.3	175.5	-61.9	167.8	0	0	0	109.9	I453 M456 E457 M461 C462 R463 K468 S469 L470 L478	I453-I466 HydrophobicContact CG2-CD1 4.32Å; M456-I466 HydrophobicContact CB-CD1 3.57Å; M456-I466 HydrophobicContact CE-CB 4.48Å; M456-I466 HydrophobicContact CE-CD1 3.94Å; M456-I466 HydrophobicContact CE-CG1 3.8Å; M456-I466 HydrophobicContact CE-CG2 3.91Å; M456-I466 HydrophobicContact SD-CD1 4.29Å; M456-I466 HydrophobicContact SD-CG2 4.11Å; E457-I466 HydrophobicContact CG-CD1 4.49Å; M461-I466 HydrophobicContact CB-CD1 3.82Å; M461-I466 HydrophobicContact CB-CG1 4.14Å; C462-I466 WeakPolarHBondContact O-CG1 3.35Å; C462-I466 PolarHBondContact O-N 3.05Å; R463-I466 PolarHBondContact O-N 2.84Å; I466-K468 VanDerWaalsContact C-N 3.34Å; I466-K468 PolarHBondContact O-N 3.48Å; I466-S469 PolarHBondContact O-N 2.86Å; I466-L470 HydrophobicContact CG2-CD1 3.74Å; I466-L470 HydrophobicContact CG2-CG 4.33Å; I466-L470 WeakPolarHBondContact O-CB 3.3Å; I466-L470 VanDerWaalsContact O-CG 3.27Å; I466-L470 WeakPolarHBondContact O-CG 3.46Å; I466-L470 PolarHBondContact O-N 2.9Å; I466-L478 HydrophobicContact CG1-CD2 4.31Å
467	L	90.5	Very high	90.5	Very high	48 Å²	48	60.5 Å²	60.5	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-40.6	-179.9	-66.5	175.5	0	0	0	112.1	L448 I453 R463 Q465 L471	L448-L467 HydrophobicContact CD1-CD2 3.51Å; I453-L467 HydrophobicContact CD1-CD2 3.98Å; R463-L467 HydrophobicContact CG-CD1 4.12Å; R463-L467 HydrophobicContact CG-CG 4.45Å; R463-L467 WeakPolarHBondContact O-CB 3.42Å; R463-L467 WeakPolarHBondContact O-CG 3.36Å; R463-L467 PolarHBondContact O-N 3.09Å; Q465-L467 PolarHBondContact O-N 2.92Å; L467-L471 WeakPolarHBondContact O-CB 3.48Å; L467-L471 WeakPolarHBondContact O-CD1 3.29Å; L467-L471 WeakPolarHBondContact O-CG 3.27Å; L467-L471 PolarHBondContact O-N 2.82Å
468	K	88.2	Confident	90.5	Very high	120 Å²	120	57.2 Å²	57.2	52%	0.522	30%	0.3	S	S	.	.	H	α-helix	trans	-66	-41.9	176.9	-79.3	173.7	-178.4	178.3	0	113	T464 Q465 I466 R472	T464-K468 HydrophobicContact CG2-CD 4.33Å; T464-K468 WeakPolarHBondContact O-CB 3.48Å; T464-K468 WeakPolarHBondContact O-CD 2.93Å; T464-K468 WeakPolarHBondContact O-CG 3.37Å; T464-K468 PolarHBondContact O-N 2.86Å; Q465-K468 PolarHBondContact O-N 2.94Å; Q465-K468 VanDerWaalsContact O-N 3.16Å; I466-K468 VanDerWaalsContact C-N 3.34Å; I466-K468 PolarHBondContact O-N 3.48Å; K468-R472 WeakPolarHBondContact O-CB 3.4Å; K468-R472 VanDerWaalsContact O-CG 3.31Å; K468-R472 WeakPolarHBondContact O-CG 3.24Å; K468-R472 PolarHBondContact O-N 3.17Å
469	S	88.5	Confident	90.5	Very high	17 Å²	17	52.7 Å²	52.7	12%	0.119	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-42.8	179	-72.2	0	0	0	0	111.7	Q465 I466 R472 C473 A474 D476	Q465-S469 PolarHBondContact O-N 3.15Å; Q465-S469 PolarHBondContact O-OG 3.45Å; I466-S469 PolarHBondContact O-N 2.86Å; S469-R472 PolarHBondContact O-N 3.46Å; S469-C473 PolarHBondContact O-N 3.03Å; S469-A474 VanDerWaalsContact O-CB 3.28Å; S469-A474 WeakPolarHBondContact O-CB 3.23Å; S469-A474 PolarHBondContact O-N 2.93Å; S469-D476 WeakPolarHBondContact CB-OD1 3.33Å; S469-D476 WeakPolarHBondContact CB-OD2 3.48Å; S469-D476 PolarHBondContact OG-OD2 3.41Å
470	L	88	Confident	90.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-53	172.6	-66.6	174.6	0	0	0	110.6	M443 L448 I466 R472 C473 T479 Y482	M443-L470 VanDerWaalsContact CE-C 3.45Å; M443-L470 HydrophobicContact CE-CB 3.57Å; M443-L470 HydrophobicContact SD-CB 3.77Å; L448-L470 HydrophobicContact CD1-CD1 4.29Å; L448-L470 HydrophobicContact CD2-CD1 4.09Å; I466-L470 HydrophobicContact CG2-CD1 3.74Å; I466-L470 HydrophobicContact CG2-CG 4.33Å; I466-L470 WeakPolarHBondContact O-CB 3.3Å; I466-L470 VanDerWaalsContact O-CG 3.27Å; I466-L470 WeakPolarHBondContact O-CG 3.46Å; I466-L470 PolarHBondContact O-N 2.9Å; L470-R472 PolarHBondContact O-N 3.26Å; L470-C473 WeakPolarHBondContact O-CA 3.39Å; L470-C473 PolarHBondContact O-N 3.01Å; L470-T479 HydrophobicContact CD2-CG2 4.26Å; L470-Y482 HydrophobicContact CD1-CD1 4.36Å; L470-Y482 HydrophobicContact CD1-CD2 3.82Å; L470-Y482 HydrophobicContact CD1-CE2 4.09Å; L470-Y482 HydrophobicContact CD1-CG 3.98Å; L470-Y482 HydrophobicContact CD2-CD1 3.73Å; L470-Y482 HydrophobicContact CD2-CD2 4.49Å; L470-Y482 HydrophobicContact CD2-CE1 4.37Å; L470-Y482 HydrophobicContact CD2-CG 3.81Å
471	L	85.8	Confident	90.8	Very high	100 Å²	100	45.6 Å²	45.6	52%	0.524	22%	0.223	S	C	.	.	H	α-helix	trans	-59.6	-24.4	-176.1	-81.8	165.1	0	0	0	114.1	M443 L467	M443-L471 VanDerWaalsContact CE-CA 3.5Å; M443-L471 HydrophobicContact CE-CB 4.18Å; M443-L471 HydrophobicContact CE-CD2 3.76Å; M443-L471 HydrophobicContact CE-CG 3.69Å; M443-L471 VanDerWaalsContact CE-N 3.32Å; L467-L471 WeakPolarHBondContact O-CB 3.48Å; L467-L471 WeakPolarHBondContact O-CD1 3.29Å; L467-L471 WeakPolarHBondContact O-CG 3.27Å; L467-L471 PolarHBondContact O-N 2.82Å
472	R	85.3	Confident	90.8	Very high	202 Å²	202	45.7 Å²	45.7	76%	0.762	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.2	176.8	-69.3	174.4	174.8	-167.5	-5.3	113.3	K468 S469 L470 A474	K468-R472 WeakPolarHBondContact O-CB 3.4Å; K468-R472 VanDerWaalsContact O-CG 3.31Å; K468-R472 WeakPolarHBondContact O-CG 3.24Å; K468-R472 PolarHBondContact O-N 3.17Å; S469-R472 PolarHBondContact O-N 3.46Å; L470-R472 PolarHBondContact O-N 3.26Å; R472-A474 VanDerWaalsContact C-N 3.29Å; R472-A474 PolarHBondContact O-N 2.79Å
473	C	83.4	Confident	90.6	Very high	39 Å²	39	46.9 Å²	46.9	26%	0.264	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.4	55.2	-168.3	-56.5	0	0	0	0	110.5	L439 S469 L470 Y475	L439-C473 HydrophobicContact CD2-CB 4.24Å; S469-C473 PolarHBondContact O-N 3.03Å; L470-C473 WeakPolarHBondContact O-CA 3.39Å; L470-C473 PolarHBondContact O-N 3.01Å; C473-Y475 VanDerWaalsContact C-N 3.33Å; C473-Y475 HydrophobicContact CB-CE2 4.17Å; C473-Y475 WeakPolarHBondContact O-CD2 3.44Å; C473-Y475 PolarHBondContact O-N 2.87Å
474	A	87.1	Confident	90.6	Very high	47 Å²	47	43.2 Å²	43.2	39%	0.388	21%	0.214	S	C	.	.			trans	-72.5	-20.1	-164	0	0	0	0	0	115	S469 R472 D476	S469-A474 VanDerWaalsContact O-CB 3.28Å; S469-A474 WeakPolarHBondContact O-CB 3.23Å; S469-A474 PolarHBondContact O-N 2.93Å; R472-A474 VanDerWaalsContact C-N 3.29Å; R472-A474 PolarHBondContact O-N 2.79Å; A474-D476 HydrophobicContact CB-CB 4.23Å; A474-D476 PolarHBondContact O-N 3.17Å
475	Y	92.3	Very high	90.5	Very high	6 Å²	6	40.9 Å²	40.9	2%	0.024	20%	0.199	C	C	.	.			trans	47.5	39.6	-170.9	-66.6	-95.3	0	0	0	112.6	K146 H149 L156 Q158 V159 C473	K146-Y475 HydrophobicContact CB-CD2 4.25Å; K146-Y475 HydrophobicContact CB-CE1 4.49Å; K146-Y475 HydrophobicContact CB-CE2 3.64Å; K146-Y475 HydrophobicContact CD-CD2 4Å; K146-Y475 HydrophobicContact CD-CE2 4.21Å; K146-Y475 HydrophobicContact CG-CD1 4.35Å; K146-Y475 HydrophobicContact CG-CD2 3.62Å; K146-Y475 HydrophobicContact CG-CE1 4.23Å; K146-Y475 HydrophobicContact CG-CE2 3.55Å; K146-Y475 HydrophobicContact CG-CG 4.08Å; K146-Y475 PolarHBondContact O-OH 2.99Å; H149-Y475 PolarHBondContact CE1-OH 2.86Å; L156-Y475 HydrophobicContact CB-CD1 4.48Å; L156-Y475 HydrophobicContact CB-CE1 4.27Å; L156-Y475 HydrophobicContact CD2-CD1 3.85Å; L156-Y475 HydrophobicContact CD2-CE1 4.06Å; L156-Y475 HydrophobicContact CD2-CG 4.46Å; L156-Y475 HydrophobicContact CG-CD1 3.92Å; L156-Y475 HydrophobicContact CG-CE1 4.17Å; Q158-Y475 CarbonylContact C-O 3.54Å; Q158-Y475 WeakPolarHBondContact CA-O 3.37Å; Q158-Y475 WeakPolarHBondContact CG-O 3.45Å; V159-Y475 PolarHBondContact N-O 3.02Å; C473-Y475 VanDerWaalsContact C-N 3.33Å; C473-Y475 HydrophobicContact CB-CE2 4.17Å; C473-Y475 WeakPolarHBondContact O-CD2 3.44Å; C473-Y475 PolarHBondContact O-N 2.87Å
476	D	93.3	Very high	90	Very high	28 Å²	28	36.8 Å²	36.8	15%	0.15	19%	0.187	C	C	.	.	S	Bend	trans	-97.2	-178.7	174.9	70.7	-14.1	0	0	0	111.4	S469 A474 L478 T479 A480	S469-D476 WeakPolarHBondContact CB-OD1 3.33Å; S469-D476 WeakPolarHBondContact CB-OD2 3.48Å; S469-D476 PolarHBondContact OG-OD2 3.41Å; A474-D476 HydrophobicContact CB-CB 4.23Å; A474-D476 PolarHBondContact O-N 3.17Å; D476-L478 PolarHBondContact O-N 3.02Å; D476-L478 PolarHBondContact OD1-N 3.11Å; D476-T479 PolarHBondContact O-N 3.32Å; D476-T479 VanDerWaalsContact OD1-CB 3.31Å; D476-T479 WeakPolarHBondContact OD1-CB 3.23Å; D476-T479 PolarHBondContact OD1-N 2.93Å; D476-T479 PolarHBondContact OD1-OG1 3.42Å; D476-A480 WeakPolarHBondContact O-CB 3.3Å; D476-A480 PolarHBondContact O-N 2.94Å
477	H	94.2	Very high	89.6	Confident	60 Å²	60	37.7 Å²	37.7	28%	0.278	19%	0.192	S	C	.	.	H	α-helix	trans	-60	-29.4	-178.6	71.7	-76.2	0	0	0	113.6	T481	H477-T481 VanDerWaalsContact O-CB 3.25Å; H477-T481 WeakPolarHBondContact O-CB 3.48Å; H477-T481 PolarHBondContact O-N 3.39Å; H477-T481 PolarHBondContact O-OG1 3.03Å
478	L	94.2	Very high	89.2	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-72.1	-48.2	175.6	-61.5	179.5	0	0	0	110.7	M456 M461 Q465 I466 D476 A480 T481 Y482	M456-L478 HydrophobicContact CE-CB 4.44Å; M456-L478 HydrophobicContact CE-CD2 4.49Å; M456-L478 VanDerWaalsContact CE-O 3.26Å; M456-L478 WeakPolarHBondContact CE-O 3.04Å; M461-L478 HydrophobicContact CB-CD2 4.07Å; M461-L478 HydrophobicContact CG-CD2 3.77Å; M461-L478 HydrophobicContact SD-CD2 3.64Å; Q465-L478 HydrophobicContact CB-CD1 3.73Å; I466-L478 HydrophobicContact CG1-CD2 4.31Å; D476-L478 PolarHBondContact O-N 3.02Å; D476-L478 PolarHBondContact OD1-N 3.11Å; L478-A480 VanDerWaalsContact C-N 3.35Å; L478-A480 PolarHBondContact O-N 3Å; L478-T481 PolarHBondContact O-N 3.18Å; L478-Y482 WeakPolarHBondContact O-CB 3.46Å; L478-Y482 PolarHBondContact O-N 3.24Å
479	T	92.4	Very high	88.7	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.7	-48.1	175	-51.3	0	0	0	0	110.7	L470 D476 T481 Y482 L483	L470-T479 HydrophobicContact CD2-CG2 4.26Å; D476-T479 PolarHBondContact O-N 3.32Å; D476-T479 VanDerWaalsContact OD1-CB 3.31Å; D476-T479 WeakPolarHBondContact OD1-CB 3.23Å; D476-T479 PolarHBondContact OD1-N 2.93Å; D476-T479 PolarHBondContact OD1-OG1 3.42Å; T479-T481 PolarHBondContact O-N 3.02Å; T479-Y482 PolarHBondContact O-N 3.46Å; T479-L483 HydrophobicContact CG2-CD1 4.11Å; T479-L483 WeakPolarHBondContact O-CG 3.32Å; T479-L483 PolarHBondContact O-N 2.92Å
480	A	93.9	Very high	88	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62	-42.8	178.4	0	0	0	0	0	112.4	Y157 Q158 D476 L478 L483 L484	Y157-A480 WeakPolarHBondContact O-CA 3.33Å; Y157-A480 WeakPolarHBondContact O-CB 3.24Å; Q158-A480 HydrophobicContact CB-CB 3.79Å; Q158-A480 HydrophobicContact CG-CB 4.08Å; D476-A480 WeakPolarHBondContact O-CB 3.3Å; D476-A480 PolarHBondContact O-N 2.94Å; L478-A480 VanDerWaalsContact C-N 3.35Å; L478-A480 PolarHBondContact O-N 3Å; A480-L483 PolarHBondContact O-N 3.41Å; A480-L484 VanDerWaalsContact O-CB 3.29Å; A480-L484 WeakPolarHBondContact O-CB 3.45Å; A480-L484 WeakPolarHBondContact O-CD1 3.09Å; A480-L484 WeakPolarHBondContact O-CG 3.49Å; A480-L484 PolarHBondContact O-N 2.97Å
481	T	94.9	Very high	87.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.4	-40.8	178.6	-59.9	0	0	0	0	111.8	H113 I115 T116 M456 M461 H477 L478 T479 L485	H113-T481 PolarHBondContact CE1-OG1 2.65Å; H113-T481 VanDerWaalsContact CE1-OG1 3.28Å; I115-T481 HydrophobicContact CB-CG2 4.48Å; I115-T481 HydrophobicContact CD1-CG2 4.17Å; I115-T481 HydrophobicContact CG2-CG2 4.03Å; T116-T481 HydrophobicContact CG2-CG2 4.49Å; M456-T481 HydrophobicContact CE-CG2 4.28Å; M456-T481 HydrophobicContact CG-CG2 4.27Å; M461-T481 HydrophobicContact CE-CG2 3.77Å; M461-T481 HydrophobicContact SD-CG2 4.1Å; H477-T481 VanDerWaalsContact O-CB 3.25Å; H477-T481 WeakPolarHBondContact O-CB 3.48Å; H477-T481 PolarHBondContact O-N 3.39Å; H477-T481 PolarHBondContact O-OG1 3.03Å; L478-T481 PolarHBondContact O-N 3.18Å; T479-T481 PolarHBondContact O-N 3.02Å; T481-L485 HydrophobicContact CG2-CD1 4.02Å; T481-L485 HydrophobicContact CG2-CG 4.4Å; T481-L485 WeakPolarHBondContact O-CB 3.14Å; T481-L485 WeakPolarHBondContact O-CG 3.25Å; T481-L485 PolarHBondContact O-N 3.08Å
482	Y	93.4	Very high	86.1	Confident	27 Å²	27	45.2 Å²	45.2	11%	0.106	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-52	173.9	176.8	-91.6	0	0	0	111.5	L448 N449 V452 I453 M456 L470 L478 T479 L484 L485 G486	L448-Y482 HydrophobicContact CD2-CE2 4.5Å; N449-Y482 HydrophobicContact CB-CE2 4.47Å; N449-Y482 PolarHBondContact N-OH 3.3Å; V452-Y482 HydrophobicContact CB-CD2 4.11Å; V452-Y482 HydrophobicContact CB-CE2 4.01Å; V452-Y482 HydrophobicContact CG1-CD2 3.41Å; V452-Y482 VanDerWaalsContact CG1-CD2 3.41Å; V452-Y482 HydrophobicContact CG1-CE2 3.83Å; V452-Y482 HydrophobicContact CG1-CG 4.05Å; I453-Y482 HydrophobicContact CG1-CD2 4.34Å; I453-Y482 HydrophobicContact CG1-CE2 4.1Å; M456-Y482 HydrophobicContact SD-CD2 4.04Å; M456-Y482 HydrophobicContact SD-CG 4.37Å; L470-Y482 HydrophobicContact CD1-CD1 4.36Å; L470-Y482 HydrophobicContact CD1-CD2 3.82Å; L470-Y482 HydrophobicContact CD1-CE2 4.09Å; L470-Y482 HydrophobicContact CD1-CG 3.98Å; L470-Y482 HydrophobicContact CD2-CD1 3.73Å; L470-Y482 HydrophobicContact CD2-CD2 4.49Å; L470-Y482 HydrophobicContact CD2-CE1 4.37Å; L470-Y482 HydrophobicContact CD2-CG 3.81Å; L478-Y482 WeakPolarHBondContact O-CB 3.46Å; L478-Y482 PolarHBondContact O-N 3.24Å; T479-Y482 PolarHBondContact O-N 3.46Å; Y482-L484 PolarHBondContact O-N 3.43Å; Y482-L485 PolarHBondContact O-N 2.84Å; Y482-G486 PolarHBondContact O-N 3.11Å
483	L	91.1	Very high	84.4	Confident	40 Å²	40	41.9 Å²	41.9	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-44	-179.6	-67.6	171.8	0	0	0	112	Y157 L439 T479 A480 G486 E487	Y157-L483 HydrophobicContact CD1-CB 3.77Å; Y157-L483 HydrophobicContact CD1-CD1 4.12Å; Y157-L483 HydrophobicContact CE1-CB 4.15Å; L439-L483 HydrophobicContact CD1-CD2 4.47Å; T479-L483 HydrophobicContact CG2-CD1 4.11Å; T479-L483 WeakPolarHBondContact O-CG 3.32Å; T479-L483 PolarHBondContact O-N 2.92Å; A480-L483 PolarHBondContact O-N 3.41Å; L483-G486 PolarHBondContact O-N 3.07Å; L483-E487 PolarHBondContact O-N 2.84Å
484	L	92.2	Very high	82.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-36.6	178.1	-70.2	168.9	0	0	0	112.3	Y94 H113 T116 I118 V120 Y157 A480 Y482 G486 E487 K488	Y94-L484 HydrophobicContact CE1-CD1 4.32Å; H113-L484 HydrophobicContact CB-CD1 3.96Å; T116-L484 HydrophobicContact CG2-CB 3.85Å; I118-L484 HydrophobicContact CB-CD2 4.31Å; I118-L484 HydrophobicContact CD1-CB 4.49Å; I118-L484 WeakPolarHBondContact CD1-O 3.44Å; I118-L484 HydrophobicContact CG2-CD2 3.79Å; V120-L484 HydrophobicContact CG1-CD1 4.26Å; V120-L484 HydrophobicContact CG1-CD2 3.84Å; Y157-L484 HydrophobicContact CD1-CD2 4.35Å; Y157-L484 HydrophobicContact CD1-CG 4.41Å; Y157-L484 HydrophobicContact CD2-CD2 3.76Å; Y157-L484 HydrophobicContact CD2-CG 4.34Å; Y157-L484 HydrophobicContact CE1-CD2 4.23Å; Y157-L484 HydrophobicContact CE2-CD2 3.6Å; Y157-L484 HydrophobicContact CG-CD2 4.14Å; Y157-L484 HydrophobicContact CG-CG 4.26Å; A480-L484 VanDerWaalsContact O-CB 3.29Å; A480-L484 WeakPolarHBondContact O-CB 3.45Å; A480-L484 WeakPolarHBondContact O-CD1 3.09Å; A480-L484 WeakPolarHBondContact O-CG 3.49Å; A480-L484 PolarHBondContact O-N 2.97Å; Y482-L484 PolarHBondContact O-N 3.43Å; L484-G486 VanDerWaalsContact C-N 3.34Å; L484-E487 PolarHBondContact O-N 3.18Å; L484-K488 PolarHBondContact O-N 3.04Å
485	L	89.4	Confident	79.4	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-39.7	172.3	-79.2	171.8	0	0	0	111.5	T116 V452 I455 M456 T481 Y482 K488 L489	T116-L485 HydrophobicContact CG2-CD2 3.73Å; T116-L485 HydrophobicContact CG2-CG 3.66Å; V452-L485 HydrophobicContact CG1-CB 3.67Å; V452-L485 HydrophobicContact CG1-CD1 4.03Å; V452-L485 HydrophobicContact CG2-CB 4.37Å; I455-L485 HydrophobicContact CB-CD1 4.37Å; I455-L485 HydrophobicContact CG2-CD1 3.82Å; I455-L485 HydrophobicContact CG2-CD2 3.93Å; M456-L485 HydrophobicContact CG-CD1 3.46Å; M456-L485 VanDerWaalsContact CG-CD1 3.46Å; M456-L485 HydrophobicContact SD-CD1 4.42Å; T481-L485 HydrophobicContact CG2-CD1 4.02Å; T481-L485 HydrophobicContact CG2-CG 4.4Å; T481-L485 WeakPolarHBondContact O-CB 3.14Å; T481-L485 WeakPolarHBondContact O-CG 3.25Å; T481-L485 PolarHBondContact O-N 3.08Å; Y482-L485 PolarHBondContact O-N 2.84Å; L485-K488 WeakPolarHBondContact O-CB 3.43Å; L485-K488 PolarHBondContact O-N 2.77Å; L485-K488 VanDerWaalsContact O-N 3.15Å; L485-L489 WeakPolarHBondContact O-CG 3.47Å; L485-L489 PolarHBondContact O-N 3.42Å
486	G	83.7	Confident	76.5	Confident	28 Å²	28	56.1 Å²	56.1	29%	0.289	28%	0.283	S	S	.	.	H	α-helix	trans	-56.5	-48.6	172.4	0	0	0	0	0	112.6	Y482 L483 L484 K488 L489 R490	Y482-G486 PolarHBondContact O-N 3.11Å; L483-G486 PolarHBondContact O-N 3.07Å; L484-G486 VanDerWaalsContact C-N 3.34Å; G486-K488 VanDerWaalsContact C-N 3.33Å; G486-K488 PolarHBondContact O-N 2.91Å; G486-L489 PolarHBondContact O-N 3.35Å; G486-R490 PolarHBondContact O-N 3.1Å
487	E	80.8	Confident	73.3	Confident	20 Å²	20	60.4 Å²	60.4	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-61.5	-38.9	173.4	-72.9	-59.7	149.9	0	0	112.6	I118 K155 L483 L484 L489 R490 L491	I118-E487 HydrophobicContact CD1-CB 4.22Å; K155-E487 IonicContact NZ-OE1 3.12Å; K155-E487 PolarHBondContact NZ-OE1 2.96Å; L483-E487 PolarHBondContact O-N 2.84Å; L484-E487 PolarHBondContact O-N 3.18Å; E487-L489 PolarHBondContact O-N 2.68Å; E487-R490 PolarHBondContact O-N 2.71Å; E487-R490 IonicContact OE1-NE 2.73Å; E487-R490 IonicContact OE2-CZ 2.66Å; E487-R490 IonicContact OE2-NE 3.83Å; E487-R490 PolarHBondContact OE2-NE 3.11Å; E487-R490 IonicContact OE2-NH2 3.69Å; E487-R490 PolarHBondContact OE2-NH2 3.35Å; E487-L491 WeakPolarHBondContact O-CB 3.48Å; E487-L491 VanDerWaalsContact O-CG 3.3Å; E487-L491 WeakPolarHBondContact O-CG 3.34Å; E487-L491 PolarHBondContact O-N 3.27Å
488	K	81.9	Confident	70	Confident	39 Å²	39	64 Å²	64	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-45.3	176.9	-163.1	173.2	-177	173.7	0	111.8	T116 I118 L484 L485 G486 L491 H492	T116-K488 WeakPolarHBondContact O-CD 3.37Å; T116-K488 WeakPolarHBondContact O-CE 3.31Å; T116-K488 PolarHBondContact O-NZ 3.49Å; I118-K488 HydrophobicContact CD1-CB 3.77Å; I118-K488 HydrophobicContact CD1-CG 4.41Å; L484-K488 PolarHBondContact O-N 3.04Å; L485-K488 WeakPolarHBondContact O-CB 3.43Å; L485-K488 PolarHBondContact O-N 2.77Å; L485-K488 VanDerWaalsContact O-N 3.15Å; G486-K488 VanDerWaalsContact C-N 3.33Å; G486-K488 PolarHBondContact O-N 2.91Å; K488-L491 PolarHBondContact O-N 3.01Å; K488-H492 PolarHBondContact O-CD2 3.45Å; K488-H492 PolarHBondContact O-N 2.98Å; K488-H492 VanDerWaalsContact O-N 3.1Å
489	L	78	Confident	66.7	Low	46 Å²	46	68.1 Å²	68.1	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-64.7	-41.5	177.8	-68	176	0	0	0	111.3	L451 V452 I455 L485 G486 E487 L491 H492 N493	L451-L489 HydrophobicContact CD2-CD1 4.28Å; V452-L489 HydrophobicContact CG2-CD1 3.53Å; I455-L489 HydrophobicContact CD1-CD1 4.48Å; I455-L489 HydrophobicContact CD1-CD2 4.46Å; L485-L489 WeakPolarHBondContact O-CG 3.47Å; L485-L489 PolarHBondContact O-N 3.42Å; G486-L489 PolarHBondContact O-N 3.35Å; E487-L489 PolarHBondContact O-N 2.68Å; L489-L491 PolarHBondContact O-N 3.45Å; L489-H492 PolarHBondContact O-N 3.01Å; L489-N493 PolarHBondContact O-N 3.22Å
490	R	72.3	Confident	63.6	Low	140 Å²	140	74 Å²	74	53%	0.528	40%	0.403	S	S	.	.	H	α-helix	trans	-59.2	-46.1	174.9	-170.5	-173.1	66.5	77.9	-0.8	112	G486 E487 H492 N493	G486-R490 PolarHBondContact O-N 3.1Å; E487-R490 PolarHBondContact O-N 2.71Å; E487-R490 IonicContact OE1-NE 2.73Å; E487-R490 IonicContact OE2-CZ 2.66Å; E487-R490 IonicContact OE2-NE 3.83Å; E487-R490 PolarHBondContact OE2-NE 3.11Å; E487-R490 IonicContact OE2-NH2 3.69Å; E487-R490 PolarHBondContact OE2-NH2 3.35Å; R490-H492 VanDerWaalsContact C-N 3.31Å; R490-H492 PolarHBondContact O-N 3.49Å; R490-N493 PolarHBondContact O-N 3.19Å
491	L	69	Low	60.4	Low	109 Å²	109	78 Å²	78	57%	0.571	43%	0.428	S	S	*	.	H	α-helix	trans	-67.5	-27.9	179	-70.6	170.5	0	0	0	113.4	E487 K488 L489 N493	E487-L491 WeakPolarHBondContact O-CB 3.48Å; E487-L491 VanDerWaalsContact O-CG 3.3Å; E487-L491 WeakPolarHBondContact O-CG 3.34Å; E487-L491 PolarHBondContact O-N 3.27Å; K488-L491 PolarHBondContact O-N 3.01Å; L489-L491 PolarHBondContact O-N 3.45Å; L491-N493 VanDerWaalsContact C-N 3.33Å
492	H	64.5	Low	57	Low	109 Å²	109	83.1 Å²	83.1	51%	0.505	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.1	178.7	-88.8	-80.9	0	0	0	114.7	K488 L489 R490 L494	K488-H492 PolarHBondContact O-CD2 3.45Å; K488-H492 PolarHBondContact O-N 2.98Å; K488-H492 VanDerWaalsContact O-N 3.1Å; L489-H492 PolarHBondContact O-N 3.01Å; R490-H492 VanDerWaalsContact C-N 3.31Å; R490-H492 PolarHBondContact O-N 3.49Å; H492-L494 VanDerWaalsContact C-N 3.31Å; H492-L494 PolarHBondContact O-N 2.77Å
493	N	50.6	Low	53.8	Low	132 Å²	132	88.9 Å²	88.9	71%	0.706	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	40.8	164.5	-137.8	37.4	0	0	0	115.2	L489 R490 L491 N495	L489-N493 PolarHBondContact O-N 3.22Å; R490-N493 PolarHBondContact O-N 3.19Å; L491-N493 VanDerWaalsContact C-N 3.33Å; N493-N495 PolarHBondContact O-N 3.41Å; N493-N495 VanDerWaalsContact O-N 3.11Å
494	L	37	Very low	50.8	Low	120 Å²	120	91.2 Å²	91.2	63%	0.628	51%	0.508	S	S	*	.			trans	-67.8	104.3	162.9	-78.1	170.8	0	0	0	108.5	H492 I496	H492-L494 VanDerWaalsContact C-N 3.31Å; H492-L494 PolarHBondContact O-N 2.77Å; L494-I496 HydrophobicContact CB-CG1 4.45Å; L494-I496 PolarHBondContact O-N 3.08Å
495	N	28.6	Very low	47.6	Very low	141 Å²	141	99.9 Å²	99.9	75%	0.754	55%	0.554	S	S	*	*			trans	-61	89	162.2	-80	-6.9	0	0	0	108.9	N493	N493-N495 PolarHBondContact O-N 3.41Å; N493-N495 VanDerWaalsContact O-N 3.11Å
496	I	31.5	Very low	44.6	Very low	130 Å²	130	104.1 Å²	104.1	67%	0.667	59%	0.585	S	S	*	*			trans	-95.8	95.4	157.9	-57.4	-179.4	0	0	0	105.5	L494 S498	L494-I496 HydrophobicContact CB-CG1 4.45Å; L494-I496 PolarHBondContact O-N 3.08Å; I496-S498 PolarHBondContact O-N 3.26Å
497	D	25.5	Very low	41.8	Very low	117 Å²	117	106.2 Å²	106.2	63%	0.626	61%	0.606	S	S	*	*			trans	-52.1	140	170.8	-79.1	-46.5	0	0	0	109.8	S499	D497-S499 PolarHBondContact O-N 3.4Å
498	S	25.8	Very low	39.2	Very low	136 Å²	136	109 Å²	109	95%	0.951	62%	0.62	S	S	*	*	S	Bend	trans	-76.1	37.5	-174.9	50.4	0	0	0	0	113.4	I496	I496-S498 PolarHBondContact O-N 3.26Å
499	S	24.7	Very low	36.5	Very low	91 Å²	91	114.5 Å²	114.5	64%	0.636	65%	0.65	S	S	*	*			trans	-142.8	34.7	-163	65	0	0	0	0	116.6	D497	D497-S499 PolarHBondContact O-N 3.4Å
500	T	26.6	Very low	34.1	Very low	125 Å²	125	119.3 Å²	119.3	77%	0.767	68%	0.675	S	S	*	*			trans	-165.4	135.3	166.5	23.2	0	0	0	0	109.1
501	T	26.8	Very low	32	Very low	83 Å²	83	117.9 Å²	117.9	51%	0.509	68%	0.684	S	S	.	*			cis	-144.3	158.5	-3.9	39.1	0	0	0	0	108.7	I503	T501-I503 PolarHBondContact O-N 3.08Å
502	P	23.1	Very low	30.1	Very low	108 Å²	108	119.6 Å²	119.6	70%	0.701	69%	0.693	S	S	*	*			trans	-75.7	119.2	176.8	30.3	-32.8	0	0	0	110.9	T504 I508	P502-T504 PolarHBondContact O-N 3.25Å; P502-I508 WeakPolarHBondContact O-CD1 3.35Å
503	I	27.7	Very low	28.5	Very low	148 Å²	148	120.5 Å²	120.5	76%	0.759	71%	0.711	S	S	*	*			trans	-70.4	102.4	173.5	-59.3	176.4	0	0	0	109.1	T501 I508	T501-I503 PolarHBondContact O-N 3.08Å; I503-I508 HydrophobicContact CG1-CD1 4.48Å
504	T	27	Very low	27.5	Very low	88 Å²	88	120.8 Å²	120.8	54%	0.54	71%	0.712	S	S	.	*			trans	-73.9	159.5	159.8	49.1	0	0	0	0	109.9	P502 S506	P502-T504 PolarHBondContact O-N 3.25Å; T504-S506 PolarHBondContact O-N 2.69Å
505	D	25.4	Very low	27.2	Very low	182 Å²	182	124 Å²	124	97%	0.973	72%	0.723	S	S	*	*	S	Bend	trans	-63	17.3	-170	-108	-25	0	0	0	116.7
506	S	26.1	Very low	27.2	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	72%	0.719	S	S	*	*	S	Bend	trans	-154.3	88.5	-179.8	58.6	0	0	0	0	111.3	T504	T504-S506 PolarHBondContact O-N 2.69Å
507	G	24.5	Very low	26.9	Very low	71 Å²	71	122.5 Å²	122.5	73%	0.732	73%	0.727	S	S	*	*			trans	47.7	112.6	158.3	0	0	0	0	0	119.1
508	I	27.4	Very low	27	Very low	78 Å²	78	122.7 Å²	122.7	40%	0.4	73%	0.733	S	S	.	*			trans	-105.1	133.3	173.8	-64	-168.5	0	0	0	112.7	P502 I503	P502-I508 WeakPolarHBondContact O-CD1 3.35Å; I503-I508 HydrophobicContact CG1-CD1 4.48Å
509	I	24.5	Very low	27	Very low	155 Å²	155	121.1 Å²	121.1	80%	0.795	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-86.3	134.5	-179.6	-62	163	0	0	0	109.1
510	I	28.3	Very low	27.1	Very low	148 Å²	148	122.2 Å²	122.2	76%	0.759	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-86.5	134.7	172.2	-58	178.2	0	0	0	108.9
511	P	28.4	Very low	27	Very low	110 Å²	110	127.5 Å²	127.5	71%	0.714	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-75.3	140.9	-179.7	-4.2	19.9	0	0	0	112.4
512	N	28.4	Very low	27.1	Very low	144 Å²	144	128.1 Å²	128.1	77%	0.77	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71.3	145	172.5	-75	-8.1	0	0	0	111.9
513	C	31.6	Very low	27.5	Very low	129 Å²	129	128.2 Å²	128.2	87%	0.872	74%	0.737	S	S	*	*			trans	-125.7	105.9	160.3	-65.8	0	0	0	0	108.7
514	D	29.2	Very low	27.7	Very low	138 Å²	138	127.2 Å²	127.2	74%	0.738	73%	0.731	S	S	*	*			trans	-77.1	123.5	177.7	-66	-59.3	0	0	0	111.2
515	H	30	Very low	27.8	Very low	187 Å²	187	126.5 Å²	126.5	87%	0.866	73%	0.734	S	S	*	*			trans	-158	124.1	143.3	-107.6	-66.1	0	0	0	110.2
516	P	27.8	Very low	28	Very low	103 Å²	103	123.2 Å²	123.2	67%	0.669	72%	0.722	S	S	*	*			trans	-82.5	162.1	177	33.4	-34.6	0	0	0	111.9
517	T	26.8	Very low	28.3	Very low	136 Å²	136	125.2 Å²	125.2	83%	0.834	72%	0.721	S	S	*	*			trans	87.2	133.8	175.5	75.4	0	0	0	0	117.4
518	T	27.3	Very low	28.5	Very low	122 Å²	122	130.2 Å²	130.2	75%	0.748	73%	0.725	S	S	*	*	S	Bend	trans	90	81.6	174.2	-30.1	0	0	0	0	117.8
519	S	25.4	Very low	28.7	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	74%	0.739	S	S	*	*			trans	25.4	100.6	150.5	61.8	0	0	0	0	120.8
520	C	26.8	Very low	28.8	Very low	114 Å²	114	131.9 Å²	131.9	77%	0.77	74%	0.738	S	S	*	*			trans	-104.3	5.2	154.1	-74.7	0	0	0	0	114	S522	C520-S522 PolarHBondContact O-N 3.49Å; C520-S522 VanDerWaalsContact O-N 3.08Å
521	Y	25.2	Very low	28.9	Very low	236 Å²	236	134.9 Å²	134.9	93%	0.925	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	80.6	171.8	-87	-85.9	0	0	0	111.5
522	S	28.4	Very low	28.8	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.5	-12.1	165.8	-152.6	0	0	0	0	115.8	C520 M524	C520-S522 PolarHBondContact O-N 3.49Å; C520-S522 VanDerWaalsContact O-N 3.08Å; S522-M524 VanDerWaalsContact C-N 3.26Å; S522-M524 PolarHBondContact O-N 3.19Å
523	I	31.1	Very low	29.1	Very low	111 Å²	111	135.9 Å²	135.9	57%	0.569	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-8.3	-163.8	-63.1	176.4	0	0	0	114.7
524	M	31.6	Very low	29.1	Very low	126 Å²	126	135.1 Å²	135.1	62%	0.621	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.4	22.2	-174.2	-68.9	-164.8	164.9	0	0	117	Y459 S522	Y459-M524 WeakPolarHBondContact OH-CE 3.48Å; Y459-M524 PolarHBondContact OH-SD 3.24Å; Y459-M524 VanDerWaalsContact OH-SD 3.35Å; S522-M524 VanDerWaalsContact C-N 3.26Å; S522-M524 PolarHBondContact O-N 3.19Å
525	A	30.2	Very low	29.3	Very low	73 Å²	73	132.2 Å²	132.2	60%	0.603	74%	0.735	S	S	*	*			trans	-107.9	134.1	173	0	0	0	0	0	112.2	E527	A525-E527 PolarHBondContact O-N 3.22Å
526	P	29.7	Very low	29.4	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	73%	0.73	S	S	*	*			trans	-82.7	97.8	171.4	32.1	-31	0	0	0	110.6	H528	P526-H528 PolarHBondContact O-N 3.33Å
527	E	32.5	Very low	29.6	Very low	138 Å²	138	130.7 Å²	130.7	65%	0.645	74%	0.736	S	S	*	*			trans	-71	99.5	172.4	-75.9	-148.2	-175.9	0	0	111.8	A525 K529	A525-E527 PolarHBondContact O-N 3.22Å; E527-K529 PolarHBondContact O-N 2.83Å; E527-K529 IonicContact OE1-NZ 2.94Å; E527-K529 WeakPolarHBondContact OE2-CE 3.38Å; E527-K529 IonicContact OE2-NZ 2.82Å; E527-K529 PolarHBondContact OE2-NZ 3.26Å
528	H	28.3	Very low	29.8	Very low	175 Å²	175	130.1 Å²	130.1	81%	0.81	73%	0.732	S	S	*	*			trans	-73.6	110.2	157	-83.7	-115.9	0	0	0	109.5	P526	P526-H528 PolarHBondContact O-N 3.33Å
529	K	31.2	Very low	30	Very low	160 Å²	160	132.7 Å²	132.7	70%	0.696	74%	0.738	S	S	*	*			trans	-131.3	105.2	162	-80.2	178.8	-176.7	139.3	0	111.1	E527	E527-K529 PolarHBondContact O-N 2.83Å; E527-K529 IonicContact OE1-NZ 2.94Å; E527-K529 WeakPolarHBondContact OE2-CE 3.38Å; E527-K529 IonicContact OE2-NZ 2.82Å; E527-K529 PolarHBondContact OE2-NZ 3.26Å
530	S	26.2	Very low	30.4	Very low	109 Å²	109	136 Å²	136	76%	0.762	74%	0.744	S	S	*	*			trans	-72.9	133.4	169.3	51.6	0	0	0	0	111.3
531	F	31	Very low	30.8	Very low	211 Å²	211	135.2 Å²	135.2	93%	0.925	74%	0.737	S	S	*	*			trans	-144.3	133.3	155.3	-98.3	-77.3	0	0	0	110.4
532	N	26.7	Very low	31.1	Very low	140 Å²	140	131 Å²	131	75%	0.749	73%	0.731	S	S	*	*			trans	-135.2	154.7	-170.3	-144.6	3	0	0	0	109.7
533	T	34.9	Very low	31.4	Very low	134 Å²	134	131.6 Å²	131.6	82%	0.822	74%	0.735	S	S	*	*			trans	67.4	151.2	175.1	76.3	0	0	0	0	116.7
534	S	30.1	Very low	31.5	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	75%	0.747	S	S	*	*			cis	-160.8	158.1	-26.5	-162.7	0	0	0	0	107.9
535	P	35	Very low	31.7	Very low	77 Å²	77	132.4 Å²	132.4	50%	0.5	75%	0.754	S	S	.	*			trans	-101.2	153	-175.3	37.9	-31.7	0	0	0	114.7
536	D	31.2	Very low	31.9	Very low	143 Å²	143	134.1 Å²	134.1	77%	0.765	76%	0.762	S	S	*	*			trans	156.8	128.6	130.9	-81.1	-17.1	0	0	0	113.1
537	S	32.4	Very low	32.3	Very low	115 Å²	115	134.7 Å²	134.7	80%	0.804	77%	0.765	S	S	*	*			trans	157.3	109.3	136.2	-73.4	0	0	0	0	115.6
538	V	30.4	Very low	32.4	Very low	123 Å²	123	137 Å²	137	75%	0.745	78%	0.776	S	S	*	*			trans	14.8	125	139.9	-154.4	0	0	0	0	120.6
539	M	30.8	Very low	33.2	Very low	176 Å²	176	133.4 Å²	133.4	87%	0.867	77%	0.769	S	S	*	*				166.5	134.1	117.4	-86.8	-63.4	176.5	0	0	113.1
540	M	34.8	Very low	33.3	Very low	173 Å²	173	134.1 Å²	134.1	85%	0.852	78%	0.779	S	S	*	*			trans	-119.1	162.3	166.2	-92.1	-86.3	166.2	0	0	106
541	P	35.8	Very low	33.6	Very low	97 Å²	97	134.1 Å²	134.1	63%	0.63	78%	0.779	S	S	*	*				-163	-173.7	58.2	44.2	-21.2	0	0	0	119.5
542	N	31.7	Very low	33.8	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	78%	0.776	S	S	*	*			trans	71.1	148.4	154.7	-62.2	-19.4	0	0	0	118.6
543	S	33	Very low	34	Very low	106 Å²	106	128.4 Å²	128.4	74%	0.741	78%	0.776	S	S	*	*			cis	-166.2	137	1.9	31.6	0	0	0	0	113.8
544	V	33.9	Very low	33.9	Very low	135 Å²	135	128.4 Å²	128.4	82%	0.818	78%	0.776	S	S	*	*				22.7	148.4	125.4	175.8	0	0	0	0	119.5
545	P	35.1	Very low	33.9	Very low	120 Å²	120	127.5 Å²	127.5	78%	0.779	77%	0.77	S	S	*	*			cis	-138.1	179.7	19.4	23.2	3.9	0	0	0	119.5
546	S	35.6	Very low	33.7	Very low	108 Å²	108	133 Å²	133	76%	0.755	79%	0.789	S	S	*	*			trans	-90	177.4	165.2	-44.9	0	0	0	0	113.8
547	P	38.8	Very low	33.9	Very low	125 Å²	125	131.6 Å²	131.6	81%	0.812	79%	0.787	S	S	*	*				-152.1	127.1	114.8	35.6	-17.1	0	0	0	118.3
548	Q	34	Very low	33.9	Very low	186 Å²	186	134.2 Å²	134.2	87%	0.869	79%	0.787	S	S	*	*				50.9	170.7	111.6	-105.3	-153	-1.3	0	0	124.3
549	P	44.1	Very low	34.2	Very low	101 Å²	101	134.1 Å²	134.1	66%	0.656	79%	0.789	S	S	*	*				-133.4	-163.9	-121.4	45	-24.6	0	0	0	115.5
550	L	34.2	Very low	34.1	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	78%	0.783	S	S	*	*			trans	-140	156.6	164.2	-100.4	167.4	0	0	0	112.9
551	S	32.8	Very low	34.1	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	79%	0.787	S	S	*	*			trans	-137.4	160.9	-158.5	55.3	0	0	0	0	114.8
552	S	34.6	Very low	33.8	Very low	123 Å²	123	136 Å²	136	86%	0.86	79%	0.793	S	S	*	*			trans	-152.6	-174.8	162.3	30.8	0	0	0	0	109.4
553	S	30.8	Very low	33.9	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	79%	0.794	S	S	*	*			trans	-157.2	-167.9	-150.1	53.2	0	0	0	0	113.8
554	V	32.6	Very low	33.5	Very low	133 Å²	133	135.6 Å²	135.6	81%	0.806	80%	0.795	S	S	*	*			trans	82.1	132.8	170.2	-173.9	0	0	0	0	115.6
555	S	31.1	Very low	33.4	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	79%	0.792	S	S	*	*				173	113.6	-51.9	51.8	0	0	0	0	108.9
556	Q	31.1	Very low	33.1	Very low	192 Å²	192	138.9 Å²	138.9	90%	0.897	80%	0.798	S	S	*	*			trans	61.8	168.6	140.2	-76.6	-160.1	-7.9	0	0	121.5
557	P	34.9	Very low	32.7	Very low	113 Å²	113	138.6 Å²	138.6	73%	0.734	80%	0.796	S	S	*	*			cis	-128.9	178.2	0.6	36.1	-17	0	0	0	117
558	Q	32.3	Very low	32.3	Very low	170 Å²	170	140.5 Å²	140.5	79%	0.794	80%	0.797	S	S	*	*			trans	-100.4	173.5	167.4	-82.7	-110.6	-45.9	0	0	111.9
559	P	36	Very low	32.1	Very low	121 Å²	121	136.8 Å²	136.8	79%	0.786	79%	0.789	S	S	*	*				-135.8	156.7	127.4	37.5	-26.8	0	0	0	116.1
560	N	29.7	Very low	31.4	Very low	141 Å²	141	136.6 Å²	136.6	75%	0.754	79%	0.79	S	S	*	*			trans	-67.7	162.5	-176	-55.8	-51.5	0	0	0	115
561	Y	34.9	Very low	31.5	Very low	237 Å²	237	133.8 Å²	133.8	93%	0.929	78%	0.78	S	S	*	*				-152.6	159.4	118.3	-100.8	-68.8	0	0	0	112.1
562	S	27.9	Very low	31.5	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	78%	0.778	S	S	*	*			trans	-123.1	142.1	-158.6	54.2	0	0	0	0	114.1
563	A	34	Very low	31.4	Very low	99 Å²	99	134.3 Å²	134.3	82%	0.818	76%	0.762	S	S	*	*			trans	-176.7	133.3	137.2	0	0	0	0	0	111.5
564	I	25.8	Very low	31.7	Very low	149 Å²	149	130 Å²	130	76%	0.764	73%	0.73	S	S	*	*			trans	-126.1	125.2	173.8	-63.3	169.2	0	0	0	108.7	K566	I564-K566 HydrophobicContact CG2-CG 4.28Å
565	P	31.6	Very low	31.6	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	72%	0.721	S	S	*	*			trans	-85.9	120.1	156.1	-1.3	20.7	0	0	0	109.3	S567	P565-S567 PolarHBondContact O-N 2.94Å
566	K	27.9	Very low	31.6	Very low	204 Å²	204	127.3 Å²	127.3	89%	0.887	72%	0.718	S	S	*	*			trans	-82.3	103	174.2	-69.1	178	179.8	176.3	0	109.7	I564	I564-K566 HydrophobicContact CG2-CG 4.28Å
567	S	28.2	Very low	31.7	Very low	103 Å²	103	120.8 Å²	120.8	72%	0.72	69%	0.688	S	S	*	*			trans	-158.8	91.1	161	58.7	0	0	0	0	110.5	P565	P565-S567 PolarHBondContact O-N 2.94Å
568	I	29.3	Very low	31.4	Very low	164 Å²	164	122.4 Å²	122.4	84%	0.841	69%	0.691	S	S	*	*			trans	-94.8	114.2	168.5	-60.7	173.4	0	0	0	106.8
569	P	30.5	Very low	31.1	Very low	108 Å²	108	119.6 Å²	119.6	70%	0.701	69%	0.69	S	S	*	*			trans	-64.6	135.9	167.8	-14.3	29.1	0	0	0	108.8	V571	P569-V571 PolarHBondContact O-N 2.88Å; P569-V571 VanDerWaalsContact O-N 3.08Å
570	S	28.5	Very low	30.7	Very low	97 Å²	97	119.1 Å²	119.1	68%	0.678	68%	0.678	S	S	*	*			trans	-60.8	111.9	173.3	47.6	0	0	0	0	110.2	F572	S570-F572 PolarHBondContact O-N 3.45Å
571	V	37.9	Very low	30.6	Very low	115 Å²	115	119 Å²	119	70%	0.697	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-69.5	117	166.7	-179.7	0	0	0	0	107	P569	P569-V571 PolarHBondContact O-N 2.88Å; P569-V571 VanDerWaalsContact O-N 3.08Å
572	F	32.4	Very low	30.3	Very low	163 Å²	163	113.9 Å²	113.9	72%	0.715	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-67.4	132.2	175.2	-89.1	-94	0	0	0	109.8	S570	S570-F572 PolarHBondContact O-N 3.45Å
573	P	32.9	Very low	30.4	Very low	81 Å²	81	113 Å²	113	53%	0.526	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-70.7	149.4	174.8	28.1	-33.3	0	0	0	111.6	S575 S576	P573-S575 WeakPolarHBondContact CG-OG 3.4Å; P573-S575 PolarHBondContact O-N 2.86Å; P573-S576 PolarHBondContact O-N 2.87Å
574	L	36.7	Very low	30.1	Very low	17 Å²	17	112.8 Å²	112.8	9%	0.089	64%	0.635	C	S	.	*	G	3₁₀ helix	trans	-55.6	-13.8	175.7	-71.6	169	0	0	0	114.2	F179 I182 A183 G288 S576 I577	F179-L574 HydrophobicContact CE2-CD2 4.26Å; F179-L574 HydrophobicContact CZ-CD2 4.24Å; I182-L574 HydrophobicContact CB-CD1 4.49Å; I182-L574 HydrophobicContact CG2-CD1 3.78Å; A183-L574 HydrophobicContact CB-CB 3.8Å; A183-L574 HydrophobicContact CB-CD1 4.15Å; G288-L574 WeakPolarHBondContact O-CD1 3.22Å; G288-L574 WeakPolarHBondContact O-CG 3.38Å; L574-S576 PolarHBondContact O-N 2.85Å; L574-I577 HydrophobicContact CD2-CD1 3.58Å; L574-I577 PolarHBondContact O-N 3.41Å; L574-I577 VanDerWaalsContact O-N 3.08Å
575	S	30.6	Very low	30.1	Very low	87 Å²	87	108.7 Å²	108.7	61%	0.608	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-60.7	-5.5	176.6	58	0	0	0	0	115.4	P573	P573-S575 WeakPolarHBondContact CG-OG 3.4Å; P573-S575 PolarHBondContact O-N 2.86Å
576	S	30.4	Very low	30.1	Very low	87 Å²	87	105.4 Å²	105.4	61%	0.608	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-97.1	1.8	174.1	-64.9	0	0	0	0	114.5	P573 L574	P573-S576 PolarHBondContact O-N 2.87Å; L574-S576 PolarHBondContact O-N 2.85Å
577	I	33.6	Very low	30.1	Very low	55 Å²	55	99.8 Å²	99.8	28%	0.282	58%	0.58	S	S	.	*			trans	-89.6	2.9	-173.9	-60.5	-173.6	0	0	0	113.5	F179 L290 L574 S579	F179-I577 HydrophobicContact CZ-CB 4.17Å; F179-I577 HydrophobicContact CZ-CD1 4.41Å; F179-I577 HydrophobicContact CZ-CG2 3.95Å; L290-I577 HydrophobicContact CD1-CD1 4.45Å; L574-I577 HydrophobicContact CD2-CD1 3.58Å; L574-I577 PolarHBondContact O-N 3.41Å; L574-I577 VanDerWaalsContact O-N 3.08Å; I577-S579 PolarHBondContact O-N 3.37Å
578	N	27.8	Very low	30.2	Very low	147 Å²	147	97.6 Å²	97.6	79%	0.786	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	62.4	172.7	-75.9	-17.2	0	0	0	113.1
579	S	27	Very low	30	Very low	110 Å²	110	92.9 Å²	92.9	77%	0.769	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.4	12.3	167.2	-118.1	0	0	0	0	115.9	I577	I577-S579 PolarHBondContact O-N 3.37Å
580	M	27	Very low	29.8	Very low	112 Å²	112	92.2 Å²	92.2	55%	0.552	54%	0.544	S	S	*	.			trans	-121.7	37.4	177.3	-70.2	-163.4	177.6	0	0	114.3	Q295 M582	Q295-M580 VanDerWaalsContact O-CE 3.31Å; Q295-M580 WeakPolarHBondContact O-CE 3.14Å; M580-M582 PolarHBondContact O-N 2.8Å
581	N	27.6	Very low	29.7	Very low	137 Å²	137	92 Å²	92	73%	0.733	54%	0.542	S	S	*	.			trans	-70.4	81.3	152.8	-92.1	41.6	0	0	0	109	D583	N581-D583 PolarHBondContact ND2-OD2 3.4Å; N581-D583 PolarHBondContact O-N 2.96Å
582	M	28	Very low	29	Very low	131 Å²	131	91.3 Å²	91.3	65%	0.645	54%	0.543	S	S	*	.			trans	-74	66.8	150.8	-81.2	-76.7	-97.6	0	0	108	M580 L584	M580-M582 PolarHBondContact O-N 2.8Å; M582-L584 HydrophobicContact CB-CG 4.44Å; M582-L584 HydrophobicContact CE-CD1 4.29Å; M582-L584 HydrophobicContact CE-CD2 3.84Å; M582-L584 HydrophobicContact CE-CG 4.06Å; M582-L584 PolarHBondContact O-N 2.93Å; M582-L584 HydrophobicContact SD-CD2 4.33Å; M582-L584 HydrophobicContact SD-CG 4.36Å
583	D	30.8	Very low	28.8	Very low	88 Å²	88	92.7 Å²	92.7	47%	0.471	55%	0.553	S	S	.	*			trans	-67	68.9	155	-72.9	-51.7	0	0	0	107	I104 N581	I104-D583 HydrophobicContact CD1-CB 3.72Å; I104-D583 WeakPolarHBondContact CD1-O 3.3Å; I104-D583 HydrophobicContact CG1-CB 4.31Å; N581-D583 PolarHBondContact ND2-OD2 3.4Å; N581-D583 PolarHBondContact O-N 2.96Å
584	L	27.4	Very low	28.5	Very low	95 Å²	95	96.5 Å²	96.5	50%	0.497	56%	0.564	S	S	.	*			trans	-54.1	128.9	175.9	-85.7	165.2	0	0	0	107	M582 L586	M582-L584 HydrophobicContact CB-CG 4.44Å; M582-L584 HydrophobicContact CE-CD1 4.29Å; M582-L584 HydrophobicContact CE-CD2 3.84Å; M582-L584 HydrophobicContact CE-CG 4.06Å; M582-L584 PolarHBondContact O-N 2.93Å; M582-L584 HydrophobicContact SD-CD2 4.33Å; M582-L584 HydrophobicContact SD-CG 4.36Å; L584-L586 PolarHBondContact O-N 3.43Å
585	P	26.1	Very low	28	Very low	62 Å²	62	103.6 Å²	103.6	40%	0.403	60%	0.597	S	S	.	*			trans	-57.1	136.5	179	26.6	-34.6	0	0	0	107.4	S587 S588	P585-S587 PolarHBondContact O-N 3.41Å; P585-S588 PolarHBondContact O-N 3.15Å
586	L	31.6	Very low	27.8	Very low	51 Å²	51	107.7 Å²	107.7	27%	0.267	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	11.7	-177.4	-73.1	163.4	0	0	0	113.5	N134 K137 F237 L584	N134-L586 HydrophobicContact CB-CB 4.25Å; N134-L586 HydrophobicContact CB-CD1 4.37Å; N134-L586 VanDerWaalsContact ND2-C 3.31Å; N134-L586 WeakPolarHBondContact ND2-CB 3.22Å; N134-L586 PolarHBondContact ND2-O 2.81Å; N134-L586 WeakPolarHBondContact OD1-CB 3.41Å; N134-L586 PolarHBondContact OD1-O 3.31Å; K137-L586 HydrophobicContact CD-CD2 4.18Å; K137-L586 PolarHBondContact NZ-O 2.92Å; F237-L586 HydrophobicContact CE1-CD2 4.4Å; L584-L586 PolarHBondContact O-N 3.43Å
587	S	28.8	Very low	27.7	Very low	85 Å²	85	109.1 Å²	109.1	59%	0.594	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	3.1	-178.7	60.6	0	0	0	0	115.6	P585	P585-S587 PolarHBondContact O-N 3.41Å
588	S	28.4	Very low	27.4	Very low	57 Å²	57	116.4 Å²	116.4	40%	0.399	65%	0.645	S	S	.	*	S	Bend	trans	-114.1	-13.3	-178.8	59.2	0	0	0	0	116	P585 S590	P585-S588 PolarHBondContact O-N 3.15Å; S588-S590 VanDerWaalsContact C-N 3.28Å; S588-S590 PolarHBondContact O-N 2.91Å; S588-S590 VanDerWaalsContact O-N 3.15Å
589	C	27.1	Very low	27.3	Very low	66 Å²	66	113.7 Å²	113.7	45%	0.446	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.2	47.4	-178.4	-65.1	0	0	0	0	113.3
590	S	25.1	Very low	27.4	Very low	94 Å²	94	114.5 Å²	114.5	66%	0.657	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.2	35.5	170.4	60.3	0	0	0	0	114	S588	S588-S590 VanDerWaalsContact C-N 3.28Å; S588-S590 PolarHBondContact O-N 2.91Å; S588-S590 VanDerWaalsContact O-N 3.15Å
591	S	25.9	Very low	27.4	Very low	91 Å²	91	116.9 Å²	116.9	64%	0.636	65%	0.653	S	S	*	*	S	Bend	trans	-162.3	120.5	168.3	48.6	0	0	0	0	109.9
592	S	24.6	Very low	27.5	Very low	102 Å²	102	117.5 Å²	117.5	71%	0.713	66%	0.656	S	S	*	*			trans	15.9	102.3	164.6	-47.9	0	0	0	0	117.8	E594	S592-E594 PolarHBondContact O-N 2.88Å
593	M	27.4	Very low	27.7	Very low	191 Å²	191	118 Å²	118	94%	0.941	66%	0.661	S	S	*	*			trans	-80.8	86.6	147.6	-169.4	162.6	175.6	0	0	106.1
594	E	27.5	Very low	27.6	Very low	161 Å²	161	120.3 Å²	120.3	75%	0.752	67%	0.673	S	S	*	*			trans	-56.3	140.9	-178.1	-70.3	179.4	137.4	0	0	110.8	S592 L596	S592-E594 PolarHBondContact O-N 2.88Å; E594-L596 PolarHBondContact O-N 3Å; E594-L596 VanDerWaalsContact O-N 3.08Å
595	Q	25.8	Very low	27.7	Very low	167 Å²	167	125.2 Å²	125.2	78%	0.78	69%	0.686	S	S	*	*			trans	-61.9	110.6	163.6	-66.8	167.7	-77.9	0	0	107.2	D597	Q595-D597 PolarHBondContact O-N 2.64Å
596	L	26.2	Very low	28	Very low	173 Å²	173	131 Å²	131	91%	0.906	71%	0.706	S	S	*	*			trans	-72.7	68.7	155.2	-72.6	173.1	0	0	0	108.1	E594	E594-L596 PolarHBondContact O-N 3Å; E594-L596 VanDerWaalsContact O-N 3.08Å
597	D	27.5	Very low	28	Very low	117 Å²	117	132 Å²	132	63%	0.626	72%	0.721	S	S	*	*			trans	-71.8	124.9	152.9	-93.9	-26.9	0	0	0	106.9	Q595 S599	Q595-D597 PolarHBondContact O-N 2.64Å; D597-S599 PolarHBondContact O-N 3.4Å
598	E	27.5	Very low	28.1	Very low	207 Å²	207	135 Å²	135	97%	0.967	73%	0.73	S	S	*	*			trans	-68.3	75.9	170.4	-70.6	-179.3	129.9	0	0	109.5
599	S	27.3	Very low	28.2	Very low	91 Å²	91	139.2 Å²	139.2	64%	0.636	75%	0.754	S	S	*	*			trans	-85.8	143.3	176	59.7	0	0	0	0	111.5	D597	D597-S599 PolarHBondContact O-N 3.4Å
600	T	27.3	Very low	28.2	Very low	127 Å²	127	141.1 Å²	141.1	78%	0.779	77%	0.768	S	S	*	*			trans	61.5	83	163.1	54.3	0	0	0	0	117.7
601	N	28	Very low	28.5	Very low	162 Å²	162	144.8 Å²	144.8	87%	0.866	78%	0.779	S	S	*	*			trans	-146.9	91.4	131.8	-108.6	-35.5	0	0	0	110.6
602	N	30.1	Very low	28.6	Very low	149 Å²	149	147 Å²	147	80%	0.797	78%	0.784	S	S	*	*	S	Bend	trans	-173.4	122.3	143.9	-99.3	-44.6	0	0	0	113.3
603	L	31.2	Very low	29.1	Very low	141 Å²	141	149.8 Å²	149.8	74%	0.738	79%	0.79	S	S	*	*			trans	70.8	91.7	146	-60.6	162.6	0	0	0	119.7
604	N	28.3	Very low	29.1	Very low	137 Å²	137	145 Å²	145	73%	0.733	78%	0.775	S	S	*	*				23.9	124.6	120.9	-54	-23.6	0	0	0	118.6
605	Y	30.7	Very low	29.3	Very low	198 Å²	198	143.4 Å²	143.4	78%	0.776	77%	0.772	S	S	*	*				-178.1	136.1	113.5	-115.3	-127.8	0	0	0	113.1
606	F	31.8	Very low	29.8	Very low	184 Å²	184	144.4 Å²	144.4	81%	0.807	78%	0.776	S	S	*	*			trans	54.3	129.3	171.1	-61.9	-63.8	0	0	0	118.4
607	A	32	Very low	30	Very low	72 Å²	72	144.4 Å²	144.4	60%	0.595	77%	0.769	S	S	*	*			cis	123.4	129.9	14.2	0	0	0	0	0	110
608	D	30.7	Very low	30.2	Very low	147 Å²	147	145.4 Å²	145.4	79%	0.786	77%	0.774	S	S	*	*			trans	55.4	113.5	153.9	-50.7	-25.7	0	0	0	118.9
609	T	31.6	Very low	30.3	Very low	146 Å²	146	140.8 Å²	140.8	90%	0.896	77%	0.765	S	S	*	*				-171.4	158.7	62.4	12.3	0	0	0	0	112
610	S	26.1	Very low	30.5	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	77%	0.772	S	S	*	*			trans	-90.2	163.5	175.9	51.5	0	0	0	0	113.6
611	I	32.3	Very low	30.5	Very low	171 Å²	171	141.2 Å²	141.2	88%	0.877	77%	0.768	S	S	*	*			trans	-165.9	139.1	134.8	-96.8	149.1	0	0	0	109.2
612	D	27.9	Very low	30.5	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	77%	0.765	S	S	*	*			trans	-102.5	160.3	-176.2	-166	4	0	0	0	110.6
613	N	34	Very low	30.6	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	77%	0.769	S	S	*	*			trans	167	155.3	146.6	-91.1	-53.1	0	0	0	114.1
614	S	28.7	Very low	30.5	Very low	90 Å²	90	142.4 Å²	142.4	63%	0.629	77%	0.766	S	S	*	*			trans	-104.4	178.1	-162.2	61.5	0	0	0	0	116.1
615	D	30.6	Very low	30.7	Very low	128 Å²	128	141.7 Å²	141.7	68%	0.684	76%	0.762	S	S	*	*			trans	63	116.1	154.4	-56	-54.6	0	0	0	120
616	H	35.6	Very low	30.6	Very low	188 Å²	188	140.6 Å²	140.6	87%	0.87	76%	0.761	S	S	*	*				-177.4	173.6	100	-105	-76.7	0	0	0	114.4
617	K	30.8	Very low	30.6	Very low	174 Å²	174	138 Å²	138	76%	0.757	76%	0.761	S	S	*	*			trans	-93.3	160.7	-165.5	-73.9	177.5	170.3	-179.1	0	115.9
618	D	31.6	Very low	30.6	Very low	137 Å²	137	143.3 Å²	143.3	73%	0.733	77%	0.773	S	S	*	*			trans	70.2	121.6	139.1	-66	-24.1	0	0	0	122.7
619	S	29.5	Very low	30.6	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	77%	0.767	S	S	*	*			trans	96.7	150.3	134.2	-60.6	0	0	0	0	123.3
620	V	31.3	Very low	30.7	Very low	128 Å²	128	140.3 Å²	140.3	78%	0.776	76%	0.759	S	S	*	*			trans	97.7	95.2	153.8	-163.2	0	0	0	0	120.5
621	S	28.8	Very low	31	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	76%	0.756	S	S	*	*				44.6	126.8	125.5	-50	0	0	0	0	125.6
622	Q	27.9	Very low	31	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	75%	0.749	S	S	*	*				50.3	119.5	128.6	-60.2	-178.8	-1	0	0	122.4
623	I	31.2	Very low	30.9	Very low	174 Å²	174	138.9 Å²	138.9	89%	0.892	75%	0.749	S	S	*	*			trans	-140.8	155.1	142.5	-62.9	-170.9	0	0	0	109.4
624	I	30.1	Very low	30.8	Very low	132 Å²	132	137.4 Å²	137.4	68%	0.677	75%	0.745	S	S	*	*			trans	-124.2	174	-165.5	-66.8	170.3	0	0	0	111.3
625	D	32.8	Very low	30.8	Very low	122 Å²	122	140.2 Å²	140.2	65%	0.652	75%	0.753	S	S	*	*			trans	86.3	153.8	163.4	-74.7	-33.2	0	0	0	118.8
626	K	28.6	Very low	30.8	Very low	174 Å²	174	139.3 Å²	139.3	76%	0.757	76%	0.757	S	S	*	*			cis	-177.9	163	-33.2	-115.4	-167.8	-158.4	103.4	0	108.8
627	T	31.4	Very low	30.5	Very low	129 Å²	129	134.3 Å²	134.3	79%	0.791	75%	0.748	S	S	*	*			trans	119.2	122.5	168.3	62	0	0	0	0	113.1
628	E	31.3	Very low	30.3	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	76%	0.756	S	S	*	*				60.6	135.5	57.9	-65.6	-174.6	174.7	0	0	113.3
629	S	31	Very low	30.2	Very low	94 Å²	94	134.3 Å²	134.3	66%	0.657	76%	0.758	S	S	*	*			cis	-169.1	176.9	-3.8	49.9	0	0	0	0	110.1
630	N	34.2	Very low	30	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	76%	0.76	S	S	*	*			trans	73.6	154.8	166.2	-60.2	8.4	0	0	0	117.9
631	D	32.6	Very low	29.7	Very low	128 Å²	128	133.4 Å²	133.4	68%	0.684	76%	0.757	S	S	*	*			cis	-157.4	153.6	-3.2	-116.6	-33.5	0	0	0	113.8
632	L	30.7	Very low	29.7	Very low	140 Å²	140	136.7 Å²	136.7	73%	0.733	77%	0.766	S	S	*	*			trans	24.8	113.6	148	-66.4	163.4	0	0	0	125.8
633	T	27.4	Very low	29.5	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	77%	0.766	S	S	*	*				41.7	144.4	120.8	63.4	0	0	0	0	126.3
634	V	31.3	Very low	29.3	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	76%	0.763	S	S	*	*			trans	123.4	118.1	139.5	-176.8	0	0	0	0	118.5
635	D	27.8	Very low	29	Very low	148 Å²	148	133 Å²	133	79%	0.791	76%	0.762	S	S	*	*			trans	28	138.8	151.2	-63	-37	0	0	0	126.5
636	S	31.2	Very low	28.7	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	78%	0.775	S	S	*	*				128.3	123.4	118.7	90.3	0	0	0	0	118.8
637	A	29.5	Very low	28.4	Very low	82 Å²	82	135.1 Å²	135.1	68%	0.678	77%	0.77	S	S	*	*				60.7	122.3	127.5	0	0	0	0	0	123.5
638	Y	25.8	Very low	28.3	Very low	236 Å²	236	135.9 Å²	135.9	93%	0.925	77%	0.769	S	S	*	*			trans	56.7	118.7	138.7	-79.4	-93.8	0	0	0	121.3
639	G	29.3	Very low	28.1	Very low	76 Å²	76	133.6 Å²	133.6	78%	0.784	76%	0.763	S	S	*	*			trans	-164.6	130.7	160.8	0	0	0	0	0	111.7
640	V	25.8	Very low	27.9	Very low	135 Å²	135	134.1 Å²	134.1	82%	0.818	77%	0.767	S	S	*	*			trans	-120.2	138.9	-170.3	165.1	0	0	0	0	111.6
641	A	25.8	Very low	27.5	Very low	85 Å²	85	132 Å²	132	70%	0.702	77%	0.768	S	S	*	*			trans	61.4	135.6	159.8	0	0	0	0	0	120
642	L	28.2	Very low	27.2	Very low	167 Å²	167	130.8 Å²	130.8	87%	0.874	77%	0.77	S	S	*	*				-164.4	158.5	106.5	-102	163.7	0	0	0	111.9
643	Q	23.4	Very low	27.2	Very low	171 Å²	171	130.7 Å²	130.7	80%	0.799	77%	0.77	S	S	*	*			trans	-86.6	156.6	-173	-61.2	158.5	-75	0	0	112.5
644	S	26.4	Very low	27.1	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	78%	0.776	S	S	*	*			trans	-141.5	119.9	138.2	67.1	0	0	0	0	110.7
645	T	23.9	Very low	26.9	Very low	108 Å²	108	137.2 Å²	137.2	66%	0.663	78%	0.777	S	S	*	*			trans	-92.1	140	173.1	43.9	0	0	0	0	110.8
646	Y	26.6	Very low	26.7	Very low	235 Å²	235	136.8 Å²	136.8	92%	0.922	77%	0.773	S	S	*	*			trans	-128.4	133.9	152.1	-100.2	-86.3	0	0	0	110.3
647	V	23.7	Very low	26.4	Very low	107 Å²	107	138.4 Å²	138.4	65%	0.648	77%	0.773	S	S	*	*			trans	-127.8	135.8	-177.4	171.2	0	0	0	0	107.4
648	N	28.9	Very low	26.3	Very low	145 Å²	145	142.7 Å²	142.7	78%	0.775	78%	0.779	S	S	*	*			trans	-169.8	122.6	151.1	-90.4	-28.8	0	0	0	105.7
649	N	26.1	Very low	26.2	Very low	135 Å²	135	136 Å²	136	72%	0.722	77%	0.767	S	S	*	*				51.4	129.4	67.5	-67.7	-19.6	0	0	0	112.2
650	S	27.7	Very low	26.1	Very low	106 Å²	106	143.9 Å²	143.9	74%	0.741	77%	0.774	S	S	*	*			cis	-173.3	150.3	-0.1	46.1	0	0	0	0	109.5
651	A	25.3	Very low	26.1	Very low	91 Å²	91	148.2 Å²	148.2	75%	0.752	78%	0.776	S	S	*	*			trans	37.7	131.9	151.3	0	0	0	0	0	121.5
652	S	27	Very low	26.2	Very low	104 Å²	104	150.1 Å²	150.1	73%	0.727	78%	0.781	S	S	*	*				176.1	156.7	103.3	-71.8	0	0	0	0	113.2
653	D	30	Very low	26.2	Very low	138 Å²	138	149.3 Å²	149.3	74%	0.738	78%	0.776	S	S	*	*			trans	56.9	113.5	160.2	-54.7	-36.9	0	0	0	119.9
654	R	25	Very low	26.3	Very low	227 Å²	227	150.1 Å²	150.1	86%	0.857	78%	0.78	S	S	*	*				65	110.8	63.6	-68.8	-174.6	168.8	-161.3	-0.5	114.4
655	I	27.6	Very low	26.5	Very low	155 Å²	155	151.7 Å²	151.7	80%	0.795	78%	0.779	S	S	*	*				-173.1	114.8	110.9	-90.2	151.2	0	0	0	112.1
656	I	24.2	Very low	26.6	Very low	139 Å²	139	152.9 Å²	152.9	71%	0.713	78%	0.777	S	S	*	*			trans	23.7	122.1	133	-26	177.2	0	0	0	121.1
657	L	25.2	Very low	26.6	Very low	144 Å²	144	149.9 Å²	149.9	75%	0.754	78%	0.776	S	S	*	*				148.7	144.3	121.4	-75.5	172.4	0	0	0	108.3
658	Q	26.4	Very low	26.6	Very low	172 Å²	172	153.2 Å²	153.2	80%	0.804	78%	0.777	S	S	*	*			cis	-151.2	170.2	10.3	-142.6	157.1	10.3	0	0	111.2
659	S	24.2	Very low	26.5	Very low	96 Å²	96	154.3 Å²	154.3	67%	0.671	78%	0.781	S	S	*	*			trans	-90.5	147.6	-164.4	54	0	0	0	0	116.7
660	Y	27.3	Very low	26.5	Very low	242 Å²	242	153.2 Å²	153.2	95%	0.949	78%	0.779	S	S	*	*			trans	-138.7	130.1	139.6	-100.4	-86.6	0	0	0	110.5
661	R	25.3	Very low	26.5	Very low	226 Å²	226	153.9 Å²	153.9	85%	0.853	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-103.3	146.2	172.6	-69.7	-171.8	-178.9	-157.5	2.7	109.7
662	P	28.1	Very low	26.6	Very low	125 Å²	125	153.5 Å²	153.5	81%	0.812	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71.5	139.6	156.7	29.7	-28.2	0	0	0	109.7
663	I	28.1	Very low	26.7	Very low	149 Å²	149	152.5 Å²	152.5	76%	0.764	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90.3	120	172.6	-67	170.5	0	0	0	107.6
664	E	25.8	Very low	26.6	Very low	188 Å²	188	153.1 Å²	153.1	88%	0.879	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-85.5	130	159.9	-63.7	179	146	0	0	107.7
665	D	29.9	Very low	26.9	Very low	154 Å²	154	145.9 Å²	145.9	82%	0.824	80%	0.8	S	S	*	*			trans	-132.4	129.1	167.4	-110.2	-35.8	0	0	0	110.3
666	E	25.5	Very low	26.9	Very low	133 Å²	133	146.5 Å²	146.5	62%	0.621	81%	0.805	S	S	*	*			trans	-72.2	143.1	-179.4	-70.5	-170.4	130.3	0	0	111.8	R668	E666-R668 IonicContact OE1-CZ 3.24Å; E666-R668 VanDerWaalsContact OE1-CZ 3.24Å; E666-R668 IonicContact OE1-NE 2.73Å; E666-R668 PolarHBondContact OE1-NE 3.41Å; E666-R668 IonicContact OE1-NH2 2.8Å; E666-R668 PolarHBondContact OE1-NH2 2.9Å; E666-R668 IonicContact OE2-CZ 3.38Å; E666-R668 IonicContact OE2-NE 3.78Å; E666-R668 PolarHBondContact OE2-NE 3.15Å; E666-R668 IonicContact OE2-NH2 3.42Å; E666-R668 PolarHBondContact OE2-NH2 2.91Å
667	L	26.9	Very low	27.1	Very low	172 Å²	172	146.7 Å²	146.7	90%	0.901	81%	0.812	S	S	*	*			trans	-120.7	85.2	152.3	-101.9	167.2	0	0	0	110.4
668	R	23.9	Very low	27.2	Very low	177 Å²	177	145.5 Å²	145.5	67%	0.668	81%	0.811	S	S	*	*			trans	-73.2	131.9	166	-66.6	-178.7	-177.3	-176.3	5.6	109.9	E666 V670	E666-R668 IonicContact OE1-CZ 3.24Å; E666-R668 VanDerWaalsContact OE1-CZ 3.24Å; E666-R668 IonicContact OE1-NE 2.73Å; E666-R668 PolarHBondContact OE1-NE 3.41Å; E666-R668 IonicContact OE1-NH2 2.8Å; E666-R668 PolarHBondContact OE1-NH2 2.9Å; E666-R668 IonicContact OE2-CZ 3.38Å; E666-R668 IonicContact OE2-NE 3.78Å; E666-R668 PolarHBondContact OE2-NE 3.15Å; E666-R668 IonicContact OE2-NH2 3.42Å; E666-R668 PolarHBondContact OE2-NH2 2.91Å; R668-V670 HydrophobicContact CB-CG2 4.36Å
669	I	27.8	Very low	27.2	Very low	167 Å²	167	144.3 Å²	144.3	86%	0.856	82%	0.815	S	S	*	*			trans	-115.3	120.5	156.2	-60.6	-179.3	0	0	0	107.2
670	V	24.6	Very low	27.3	Very low	113 Å²	113	142.9 Å²	142.9	69%	0.685	82%	0.815	S	S	*	*			trans	-117.3	154.9	-176.3	174.2	0	0	0	0	109.5	R668	R668-V670 HydrophobicContact CB-CG2 4.36Å
671	S	28.3	Very low	27.2	Very low	120 Å²	120	137.4 Å²	137.4	84%	0.839	81%	0.812	S	S	*	*			trans	93.3	128	176.9	-40.4	0	0	0	0	113.2
672	G	27.2	Very low	27.3	Very low	82 Å²	82	136.7 Å²	136.7	85%	0.845	81%	0.81	S	S	*	*			cis	152.8	137.4	-0	0	0	0	0	0	109.2
673	G	29.3	Very low	27.3	Very low	83 Å²	83	136.8 Å²	136.8	86%	0.856	81%	0.81	S	S	*	*			trans	157.9	105.9	-179.5	0	0	0	0	0	114
674	T	28.8	Very low	27.3	Very low	151 Å²	151	136.6 Å²	136.6	93%	0.926	81%	0.806	S	S	*	*			trans	-76.9	144.5	177.1	48.6	0	0	0	0	112.8
675	G	31.2	Very low	27.4	Very low	76 Å²	76	136.3 Å²	136.3	78%	0.784	80%	0.804	S	S	*	*			trans	174.4	96.9	166.7	0	0	0	0	0	114.5
676	N	26.8	Very low	27.2	Very low	167 Å²	167	140.2 Å²	140.2	89%	0.893	81%	0.807	S	S	*	*			trans	-65.6	147.4	167.7	-74	-31.2	0	0	0	111.1
677	V	28.4	Very low	27.4	Very low	144 Å²	144	140.3 Å²	140.3	87%	0.873	82%	0.817	S	S	*	*				-171.2	161.5	129.2	143.2	0	0	0	0	110.1
678	T	26.7	Very low	27.3	Very low	119 Å²	119	140.7 Å²	140.7	73%	0.73	82%	0.819	S	S	*	*			trans	-81.6	144.3	-154.9	46.7	0	0	0	0	118
679	V	27.2	Very low	27.4	Very low	147 Å²	147	136.1 Å²	136.1	89%	0.891	82%	0.819	S	S	*	*			trans	33.7	109.9	134.2	-171.2	0	0	0	0	118
680	G	25.4	Very low	27.2	Very low	65 Å²	65	138 Å²	138	67%	0.67	82%	0.815	S	S	*	*			trans	174.8	116.9	159.4	0	0	0	0	0	113.9
681	S	26.1	Very low	27.4	Very low	127 Å²	127	143.9 Å²	143.9	89%	0.888	83%	0.825	S	S	*	*			trans	63.2	129.1	151.4	-54.4	0	0	0	0	120.4
682	R	27.2	Very low	27.3	Very low	212 Å²	212	146.9 Å²	146.9	80%	0.8	82%	0.823	S	S	*	*			trans	-2.3	139.8	164	-77.4	-179.1	170.3	-179.4	-1.8	119.1
683	P	28.5	Very low	27.2	Very low	127 Å²	127	153 Å²	153	83%	0.825	82%	0.823	S	S	*	*			trans	-115.1	112.6	134.3	32.6	-23.1	0	0	0	111.9
684	Q	28.2	Very low	27	Very low	145 Å²	145	152.7 Å²	152.7	68%	0.678	82%	0.819	S	S	*	*			trans	-75.6	133.8	138.9	-69.9	173	-51.1	0	0	106.3
685	H	27.1	Very low	26.8	Very low	181 Å²	181	153.5 Å²	153.5	84%	0.838	82%	0.816	S	S	*	*			trans	165	151.5	140	-103.8	-87.1	0	0	0	112.7
686	R	25.2	Very low	26.6	Very low	236 Å²	236	155.3 Å²	155.3	89%	0.891	82%	0.815	S	S	*	*			trans	72.9	127.7	171	-65.4	171.2	168.3	167.4	-4.6	114.7
687	V	30.2	Very low	26.7	Very low	136 Å²	136	152.1 Å²	152.1	82%	0.824	81%	0.806	S	S	*	*			cis	-129.4	134.4	11.4	177	0	0	0	0	111.5
688	L	25.9	Very low	26.8	Very low	179 Å²	179	150 Å²	150	94%	0.937	80%	0.795	S	S	*	*			trans	-133.3	103.9	173.8	-136.5	176.1	0	0	0	107.2
689	A	25.4	Very low	27.3	Very low	82 Å²	82	148.4 Å²	148.4	68%	0.678	79%	0.787	S	S	*	*			trans	-164.7	108.1	172.9	0	0	0	0	0	115.6
690	R	24.2	Very low	27.7	Very low	205 Å²	205	144.5 Å²	144.5	77%	0.774	77%	0.77	S	S	*	*			trans	50.8	107.7	137.4	-65.2	179.6	168.9	178.4	-3.3	121.7
691	R	27.6	Very low	28.1	Very low	237 Å²	237	144.5 Å²	144.5	89%	0.894	76%	0.759	S	S	*	*				176.3	114.4	123.8	-94.1	169.4	-172.6	-171.6	2.4	105
692	K	26.7	Very low	28.7	Very low	183 Å²	183	143.2 Å²	143.2	80%	0.796	74%	0.742	S	S	*	*			cis	53.8	84	35	-136.5	-177.6	-172.1	-175.5	0	112.9
693	Y	24.5	Very low	29.5	Very low	212 Å²	212	137.2 Å²	137.2	83%	0.831	72%	0.723	S	S	*	*	S	Bend	trans	64.2	143.3	178.9	-53.8	-76.4	0	0	0	116.1
694	G	24.7	Very low	30.2	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	71%	0.713	S	S	*	*			trans	118.3	101.4	162.2	0	0	0	0	0	116.6
695	I	26	Very low	31.2	Very low	169 Å²	169	134.9 Å²	134.9	87%	0.867	70%	0.703	S	S	*	*			trans	-18.8	131.7	147.9	-59.9	153.8	0	0	0	114.7
696	C	25.9	Very low	32.5	Very low	113 Å²	113	130.3 Å²	130.3	76%	0.764	68%	0.68	S	S	*	*			trans	-165	96.6	141.2	-129.7	0	0	0	0	112
697	S	29.3	Very low	34.1	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	67%	0.667	S	S	*	*			trans	-72.1	140.9	153.3	-54.7	0	0	0	0	107.8	P699	S697-P699 WeakPolarHBondContact O-CD 3.22Å; S697-P699 VanDerWaalsContact O-N 3.14Å
698	P	31.7	Very low	35.4	Very low	100 Å²	100	121.4 Å²	121.4	65%	0.649	65%	0.649	S	S	*	*			trans	-63.6	112.9	-176.2	-20.3	32.4	0	0	0	111.6	A700	P698-A700 VanDerWaalsContact C-N 3.27Å; P698-A700 PolarHBondContact O-N 3.34Å
699	P	36.3	Very low	37	Very low	84 Å²	84	117.4 Å²	117.4	55%	0.545	63%	0.628	S	S	.	*	H	α-helix	trans	-71.5	-24.2	-176.9	-18.9	34.2	0	0	0	112.9	S697 E703	S697-P699 WeakPolarHBondContact O-CD 3.22Å; S697-P699 VanDerWaalsContact O-N 3.14Å; P699-E703 PolarHBondContact O-N 2.95Å
700	A	34.7	Very low	39	Very low	66 Å²	66	117.6 Å²	117.6	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-64.4	-45.7	-177.5	0	0	0	0	0	112.8	P698 L702 E703 E704	P698-A700 VanDerWaalsContact C-N 3.27Å; P698-A700 PolarHBondContact O-N 3.34Å; A700-L702 VanDerWaalsContact C-N 3.31Å; A700-L702 PolarHBondContact O-N 3.34Å; A700-E703 PolarHBondContact O-N 2.86Å; A700-E704 WeakPolarHBondContact O-CG 3.27Å; A700-E704 PolarHBondContact O-N 3.2Å
701	C	33.9	Very low	40.7	Very low	64 Å²	64	111 Å²	111	43%	0.432	60%	0.602	S	S	.	*	H	α-helix	trans	-69.4	-30.4	-175.2	-159	0	0	0	0	112.1	I705	C701-I705 WeakPolarHBondContact O-CB 3.37Å; C701-I705 WeakPolarHBondContact O-CD1 3.36Å; C701-I705 VanDerWaalsContact O-CG1 3.24Å; C701-I705 WeakPolarHBondContact O-CG1 3.35Å; C701-I705 PolarHBondContact O-N 2.98Å; C701-I705 VanDerWaalsContact O-N 3.08Å
702	L	39.7	Very low	41.9	Very low	101 Å²	101	105.1 Å²	105.1	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-72.4	-34.5	177.7	-149.5	86.1	0	0	0	112.7	A700 K706	A700-L702 VanDerWaalsContact C-N 3.31Å; A700-L702 PolarHBondContact O-N 3.34Å; L702-K706 WeakPolarHBondContact O-CG 3.14Å; L702-K706 PolarHBondContact O-N 2.76Å
703	E	44.4	Very low	43.1	Very low	86 Å²	86	102.6 Å²	102.6	40%	0.402	58%	0.576	S	S	.	*	H	α-helix	trans	-78.3	-32.5	175.3	-68.7	-54.5	143.4	0	0	112.5	P699 A700 K706 Q707	P699-E703 PolarHBondContact O-N 2.95Å; A700-E703 PolarHBondContact O-N 2.86Å; E703-K706 PolarHBondContact O-N 3.13Å; E703-K706 WeakPolarHBondContact OE1-CD 3.34Å; E703-K706 IonicContact OE1-NZ 2.82Å; E703-K706 PolarHBondContact OE1-NZ 3.3Å; E703-K706 VanDerWaalsContact OE2-CD 3.24Å; E703-K706 WeakPolarHBondContact OE2-CD 3.29Å; E703-K706 IonicContact OE2-NZ 3.65Å; E703-Q707 WeakPolarHBondContact O-CB 3.45Å; E703-Q707 WeakPolarHBondContact O-CG 3.37Å; E703-Q707 PolarHBondContact O-N 3.48Å
704	E	43.3	Very low	44.7	Very low	131 Å²	131	98.3 Å²	98.3	61%	0.612	56%	0.563	S	S	*	*	H	α-helix	trans	-61.8	-43.5	169.5	-73.7	173.7	163.5	0	0	111.4	A700 Q707 A708	A700-E704 WeakPolarHBondContact O-CG 3.27Å; A700-E704 PolarHBondContact O-N 3.2Å; E704-Q707 PolarHBondContact O-N 3.34Å; E704-A708 WeakPolarHBondContact O-CB 3.36Å; E704-A708 PolarHBondContact O-N 2.74Å
705	I	48.2	Very low	46	Very low	91 Å²	91	100.5 Å²	100.5	47%	0.467	55%	0.553	S	S	.	*	H	α-helix	trans	-64.5	-41	175.3	-70	166.2	0	0	0	111.5	C701 A708 L709	C701-I705 WeakPolarHBondContact O-CB 3.37Å; C701-I705 WeakPolarHBondContact O-CD1 3.36Å; C701-I705 VanDerWaalsContact O-CG1 3.24Å; C701-I705 WeakPolarHBondContact O-CG1 3.35Å; C701-I705 PolarHBondContact O-N 2.98Å; C701-I705 VanDerWaalsContact O-N 3.08Å; I705-A708 PolarHBondContact O-N 2.74Å; I705-L709 HydrophobicContact CG2-CD1 4.01Å; I705-L709 WeakPolarHBondContact O-CB 3.42Å; I705-L709 PolarHBondContact O-N 2.87Å
706	K	54.9	Low	47.1	Very low	86 Å²	86	97.6 Å²	97.6	37%	0.374	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-44.5	173.5	-78	169.3	175.3	-178.2	0	112.3	L702 E703 A708 L709 I710	L702-K706 WeakPolarHBondContact O-CG 3.14Å; L702-K706 PolarHBondContact O-N 2.76Å; E703-K706 PolarHBondContact O-N 3.13Å; E703-K706 WeakPolarHBondContact OE1-CD 3.34Å; E703-K706 IonicContact OE1-NZ 2.82Å; E703-K706 PolarHBondContact OE1-NZ 3.3Å; E703-K706 VanDerWaalsContact OE2-CD 3.24Å; E703-K706 WeakPolarHBondContact OE2-CD 3.29Å; E703-K706 IonicContact OE2-NZ 3.65Å; K706-A708 VanDerWaalsContact C-N 3.32Å; K706-A708 PolarHBondContact O-N 3.3Å; K706-L709 PolarHBondContact O-N 2.56Å; K706-I710 WeakPolarHBondContact O-CB 3.3Å; K706-I710 WeakPolarHBondContact O-CD1 3.14Å; K706-I710 WeakPolarHBondContact O-CG1 3.17Å; K706-I710 PolarHBondContact O-N 3.24Å
707	Q	59.7	Low	48.3	Very low	130 Å²	130	96 Å²	96	61%	0.607	52%	0.523	S	S	*	.	H	α-helix	trans	-65.7	-35.5	178.3	-74.5	-176.2	6.9	0	0	112	E703 E704 S711	E703-Q707 WeakPolarHBondContact O-CB 3.45Å; E703-Q707 WeakPolarHBondContact O-CG 3.37Å; E703-Q707 PolarHBondContact O-N 3.48Å; E704-Q707 PolarHBondContact O-N 3.34Å; Q707-S711 VanDerWaalsContact O-CB 3.31Å; Q707-S711 WeakPolarHBondContact O-CB 3.35Å; Q707-S711 PolarHBondContact O-N 3.14Å; Q707-S711 PolarHBondContact O-OG 3.07Å
708	A	56.3	Low	49.1	Very low	55 Å²	55	97.4 Å²	97.4	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-46.2	172.4	0	0	0	0	0	112.2	E704 I705 K706 S711 Q712	E704-A708 WeakPolarHBondContact O-CB 3.36Å; E704-A708 PolarHBondContact O-N 2.74Å; I705-A708 PolarHBondContact O-N 2.74Å; K706-A708 VanDerWaalsContact C-N 3.32Å; K706-A708 PolarHBondContact O-N 3.3Å; A708-S711 PolarHBondContact O-N 2.95Å; A708-Q712 PolarHBondContact O-N 2.84Å
709	L	60.2	Low	49.8	Very low	94 Å²	94	99 Å²	99	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-64.1	-41.6	175.8	-85.5	159.8	0	0	0	112.7	I705 K706 S711 Q712 Q713	I705-L709 HydrophobicContact CG2-CD1 4.01Å; I705-L709 WeakPolarHBondContact O-CB 3.42Å; I705-L709 PolarHBondContact O-N 2.87Å; K706-L709 PolarHBondContact O-N 2.56Å; L709-S711 VanDerWaalsContact C-N 3.34Å; L709-Q712 PolarHBondContact O-N 2.87Å; L709-Q713 WeakPolarHBondContact O-CG 3.44Å; L709-Q713 PolarHBondContact O-N 2.95Å
710	I	67.1	Low	50.2	Low	86 Å²	86	104 Å²	104	44%	0.441	53%	0.525	S	S	.	.	H	α-helix	trans	-66.2	-37.5	176	-69.3	165.7	0	0	0	110.6	K706 Q713 H714	K706-I710 WeakPolarHBondContact O-CB 3.3Å; K706-I710 WeakPolarHBondContact O-CD1 3.14Å; K706-I710 WeakPolarHBondContact O-CG1 3.17Å; K706-I710 PolarHBondContact O-N 3.24Å; I710-Q713 PolarHBondContact O-N 3.22Å; I710-H714 PolarHBondContact O-N 3.14Å; I710-H714 PolarHBondContact O-ND1 3.39Å
711	S	59.2	Low	50.6	Low	66 Å²	66	107 Å²	107	46%	0.462	53%	0.532	S	S	.	.	H	α-helix	trans	-67.6	-42.6	175.2	-60.4	0	0	0	0	112	Q707 A708 L709 H714 Q715	Q707-S711 VanDerWaalsContact O-CB 3.31Å; Q707-S711 WeakPolarHBondContact O-CB 3.35Å; Q707-S711 PolarHBondContact O-N 3.14Å; Q707-S711 PolarHBondContact O-OG 3.07Å; A708-S711 PolarHBondContact O-N 2.95Å; L709-S711 VanDerWaalsContact C-N 3.34Å; S711-H714 PolarHBondContact O-N 2.63Å; S711-Q715 PolarHBondContact O-N 3.33Å
712	Q	53	Low	51.1	Low	115 Å²	115	109.9 Å²	109.9	54%	0.537	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-39.8	174.2	-79.4	-170.9	-22.8	0	0	112.4	A708 L709 Q715 Q716	A708-Q712 PolarHBondContact O-N 2.84Å; L709-Q712 PolarHBondContact O-N 2.87Å; Q712-Q715 PolarHBondContact O-N 3.31Å; Q712-Q716 WeakPolarHBondContact O-CB 3.48Å; Q712-Q716 WeakPolarHBondContact O-CG 3.45Å; Q712-Q716 PolarHBondContact O-N 3.16Å
713	Q	53.4	Low	51.2	Low	129 Å²	129	110.4 Å²	110.4	60%	0.603	55%	0.549	S	S	*	.	H	α-helix	trans	-65.4	-38.4	174.1	-78.5	-172	-27	0	0	112.4	L709 I710 T717	L709-Q713 WeakPolarHBondContact O-CG 3.44Å; L709-Q713 PolarHBondContact O-N 2.95Å; I710-Q713 PolarHBondContact O-N 3.22Å; Q713-T717 WeakPolarHBondContact O-CB 3.47Å; Q713-T717 PolarHBondContact O-N 2.77Å; Q713-T717 PolarHBondContact O-OG1 2.76Å
714	H	57.1	Low	51	Low	122 Å²	122	113.3 Å²	113.3	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-67.9	-40.6	174.2	-79.1	85	0	0	0	112.1	I710 S711 T717 H718	I710-H714 PolarHBondContact O-N 3.14Å; I710-H714 PolarHBondContact O-ND1 3.39Å; S711-H714 PolarHBondContact O-N 2.63Å; H714-T717 WeakPolarHBondContact CA-OG1 3.35Å; H714-T717 PolarHBondContact O-N 3.05Å; H714-T717 PolarHBondContact O-OG1 3.08Å; H714-H718 WeakPolarHBondContact O-CB 3.11Å; H714-H718 PolarHBondContact O-N 2.94Å
715	Q	52.5	Low	50.6	Low	121 Å²	121	114.8 Å²	114.8	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-63.5	-46.7	174.4	-78.2	178.8	-60.1	0	0	111.8	S711 Q712 T717 H718 E719	S711-Q715 PolarHBondContact O-N 3.33Å; Q712-Q715 PolarHBondContact O-N 3.31Å; Q715-T717 VanDerWaalsContact C-N 3.28Å; Q715-T717 PolarHBondContact O-N 3.02Å; Q715-H718 PolarHBondContact O-N 2.82Å; Q715-H718 VanDerWaalsContact O-N 3.09Å; Q715-E719 WeakPolarHBondContact O-CB 3.37Å; Q715-E719 WeakPolarHBondContact O-CG 3.3Å; Q715-E719 PolarHBondContact O-N 3.42Å
716	Q	48.6	Very low	50.1	Low	109 Å²	109	118.4 Å²	118.4	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-68.4	-22.3	178.7	-70.1	-179.2	1.8	0	0	114.1	Q712 R720	Q712-Q716 WeakPolarHBondContact O-CB 3.48Å; Q712-Q716 WeakPolarHBondContact O-CG 3.45Å; Q712-Q716 PolarHBondContact O-N 3.16Å; Q716-R720 WeakPolarHBondContact O-CB 3.4Å; Q716-R720 VanDerWaalsContact O-CG 3.29Å; Q716-R720 WeakPolarHBondContact O-CG 3.48Å; Q716-R720 PolarHBondContact O-N 2.8Å
717	T	50.3	Low	49.2	Very low	79 Å²	79	126.1 Å²	126.1	49%	0.485	65%	0.645	S	S	.	*	H	α-helix	trans	-89.1	-18.3	170.6	46.4	0	0	0	0	113.5	Q713 H714 Q715 N721	Q713-T717 WeakPolarHBondContact O-CB 3.47Å; Q713-T717 PolarHBondContact O-N 2.77Å; Q713-T717 PolarHBondContact O-OG1 2.76Å; H714-T717 WeakPolarHBondContact CA-OG1 3.35Å; H714-T717 PolarHBondContact O-N 3.05Å; H714-T717 PolarHBondContact O-OG1 3.08Å; Q715-T717 VanDerWaalsContact C-N 3.28Å; Q715-T717 PolarHBondContact O-N 3.02Å; T717-N721 PolarHBondContact O-ND2 3.36Å
718	H	47.7	Very low	48.7	Very low	131 Å²	131	125.9 Å²	125.9	61%	0.606	65%	0.647	S	S	*	*	H	α-helix	trans	-82.6	-30.3	169.9	-134.7	-62.1	0	0	0	112.2	H714 Q715 I722	H714-H718 WeakPolarHBondContact O-CB 3.11Å; H714-H718 PolarHBondContact O-N 2.94Å; Q715-H718 PolarHBondContact O-N 2.82Å; Q715-H718 VanDerWaalsContact O-N 3.09Å; H718-I722 WeakPolarHBondContact ND1-CD1 3.41Å; H718-I722 WeakPolarHBondContact O-CD1 3.23Å; H718-I722 WeakPolarHBondContact O-CG1 3.48Å
719	E	45.8	Very low	48.3	Very low	132 Å²	132	129.6 Å²	129.6	62%	0.617	66%	0.657	S	S	*	*	H	α-helix	trans	-79.8	-26.1	175.8	-71.1	171.2	168.8	0	0	112.7	Q715	Q715-E719 WeakPolarHBondContact O-CB 3.37Å; Q715-E719 WeakPolarHBondContact O-CG 3.3Å; Q715-E719 PolarHBondContact O-N 3.42Å
720	R	43.6	Very low	47.6	Very low	189 Å²	189	131.6 Å²	131.6	71%	0.713	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	3.8	174.1	-73.5	-179.1	176.4	174.3	0.1	115.3	Q716	Q716-R720 WeakPolarHBondContact O-CB 3.4Å; Q716-R720 VanDerWaalsContact O-CG 3.29Å; Q716-R720 WeakPolarHBondContact O-CG 3.48Å; Q716-R720 PolarHBondContact O-N 2.8Å
721	N	43.4	Very low	46.5	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	21.7	175.5	-73.8	-52.6	0	0	0	112	T717	T717-N721 PolarHBondContact O-ND2 3.36Å
722	I	44.1	Very low	45.7	Very low	123 Å²	123	138.6 Å²	138.6	63%	0.631	69%	0.693	S	S	*	*	S	Bend	trans	-129.8	22.1	178.5	-63.3	177.9	0	0	0	110.4	H718	H718-I722 WeakPolarHBondContact ND1-CD1 3.41Å; H718-I722 WeakPolarHBondContact O-CD1 3.23Å; H718-I722 WeakPolarHBondContact O-CG1 3.48Å
723	T	42.1	Very low	45.2	Very low	113 Å²	113	140.1 Å²	140.1	69%	0.693	70%	0.704	S	S	*	*	S	Bend	trans	-132.1	11.6	-178.4	31.7	0	0	0	0	114.8
724	D	39.7	Very low	44.6	Very low	147 Å²	147	140.9 Å²	140.9	79%	0.786	71%	0.711	S	S	*	*	S	Bend	trans	-126.5	65.6	172.8	-73.4	-46.2	0	0	0	109.9
725	D	35.9	Very low	43.7	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	72%	0.722	S	S	*	*	S	Bend	trans	-179	87.4	163.9	-97.2	-27	0	0	0	109.4
726	D	37.8	Very low	42.9	Very low	168 Å²	168	144.2 Å²	144.2	90%	0.898	74%	0.735	S	S	*	*			trans	160.7	132.1	147.8	-86.9	-25.1	0	0	0	111.2
727	D	36	Very low	42.4	Very low	247 Å²	247	147.4 Å²	147.4	100%	1.321	76%	0.756	S	S	*	*			trans	66.2	0	-178.5	-73.4	-23.7	0	0	0	119.9

Retrieved 727 of 727 residues in 771.1 ms (Link to these results)

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