A0A077Z6C1_TRITR Loading...

Acyl-CoA dh N domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6C1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 376 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	24.3	Very low	21.8	Very low	237 Å²	237	164.2 Å²	164.2	100%	1.167	86%	0.855	S	S	*	*				0	54.8	0	-161.4	175.6	-158.3	0	0	110.3
2	Y	23.7	Very low	22.1	Very low	241 Å²	241	162.8 Å²	162.8	95%	0.945	86%	0.858	S	S	*	*			trans	-149.7	106.9	168.6	-94.4	-75.9	0	0	0	107.9
3	T	19.6	Very low	22	Very low	134 Å²	134	168.4 Å²	168.4	82%	0.822	86%	0.86	S	S	*	*			trans	-107.6	125.4	173	33.6	0	0	0	0	108.6
4	C	22.3	Very low	22.2	Very low	122 Å²	122	174.4 Å²	174.4	82%	0.824	87%	0.867	S	S	*	*			trans	-171.9	114.6	145.1	-105.3	0	0	0	0	107.6
5	H	20.3	Very low	22.2	Very low	157 Å²	157	176.3 Å²	176.3	73%	0.727	87%	0.868	S	S	*	*				75.5	127.4	67	-98.2	-61	0	0	0	116
6	R	21.1	Very low	22.4	Very low	222 Å²	222	176.6 Å²	176.6	84%	0.838	87%	0.873	S	S	*	*			trans	62.9	110.3	152.4	-74	170.8	167.7	167.6	-5.2	116.3
7	A	21.4	Very low	22.4	Very low	91 Å²	91	172.2 Å²	172.2	75%	0.752	86%	0.864	S	S	*	*				81.4	129.8	64.2	0	0	0	0	0	113.7
8	L	21.9	Very low	22.6	Very low	165 Å²	165	172.3 Å²	172.3	86%	0.864	87%	0.866	S	S	*	*			trans	-163	135.3	138.1	-107.4	158.2	0	0	0	111
9	L	19.3	Very low	22.7	Very low	160 Å²	160	169.5 Å²	169.5	84%	0.838	86%	0.862	S	S	*	*			trans	-97.3	131.2	178.2	-77.5	144.7	0	0	0	109.7
10	F	24.5	Very low	22.9	Very low	208 Å²	208	172.9 Å²	172.9	91%	0.912	87%	0.865	S	S	*	*			trans	-161.8	135	146.5	-78.9	-69.6	0	0	0	108.5
11	G	20.9	Very low	23.1	Very low	69 Å²	69	175.9 Å²	175.9	71%	0.711	87%	0.866	S	S	*	*			cis	136.8	45.4	-8.7	0	0	0	0	0	116.7
12	V	25.8	Very low	23	Very low	148 Å²	148	175.9 Å²	175.9	90%	0.897	85%	0.853	S	S	*	*			trans	-138.1	133	167.3	-179.4	0	0	0	0	112.5
13	R	20.7	Very low	23.1	Very low	235 Å²	235	171 Å²	171	89%	0.887	85%	0.852	S	S	*	*			trans	-90.2	149.6	174.2	-63.6	169.7	168	176.6	-4	111.3
14	R	24.9	Very low	23.4	Very low	253 Å²	253	169.6 Å²	169.6	96%	0.955	86%	0.855	S	S	*	*				-166.5	139.1	121.2	-106.9	170.4	-169.5	-153.7	2.5	112.8
15	K	22.2	Very low	23.7	Very low	203 Å²	203	167.6 Å²	167.6	88%	0.883	85%	0.854	S	S	*	*			trans	-74.8	148.3	175.2	-67.1	173.3	172.1	179.9	0	110.6
16	L	25.9	Very low	24.1	Very low	180 Å²	180	165.8 Å²	165.8	94%	0.942	86%	0.86	S	S	*	*			trans	-153.2	128.4	144.4	-107.8	165.9	0	0	0	108.9
17	S	22	Very low	24.4	Very low	103 Å²	103	161.1 Å²	161.1	72%	0.72	86%	0.858	S	S	*	*			trans	-120.5	130.5	-170.7	51.7	0	0	0	0	110.9
18	L	25.9	Very low	24.9	Very low	173 Å²	173	166.9 Å²	166.9	91%	0.906	87%	0.866	S	S	*	*			trans	-142	133.2	160.7	-79.3	177.1	0	0	0	109.8
19	P	24.5	Very low	25	Very low	120 Å²	120	163.7 Å²	163.7	78%	0.779	86%	0.857	S	S	*	*			trans	-92.6	154.4	177.4	36.4	-33.2	0	0	0	111.7
20	Y	27.1	Very low	25.5	Very low	237 Å²	237	164.9 Å²	164.9	93%	0.929	86%	0.858	S	S	*	*			trans	-125.4	138.8	160.7	-152.3	-95.7	0	0	0	110.8
21	R	26.7	Very low	25.5	Very low	235 Å²	235	161.6 Å²	161.6	89%	0.887	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-88.6	162.1	-168.9	-87.8	-176.5	171.5	-168.7	-0.8	113.1
22	R	22.5	Very low	25.9	Very low	237 Å²	237	165.2 Å²	165.2	89%	0.894	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-60.4	151.3	174.8	-60.6	172.6	175.6	170.5	-3.8	113.1
23	C	24.9	Very low	25.8	Very low	138 Å²	138	164.4 Å²	164.4	93%	0.932	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-97.6	145.6	140.5	-74.9	0	0	0	0	109.3
24	A	25.9	Very low	26	Very low	106 Å²	106	158 Å²	158	88%	0.876	85%	0.851	S	S	*	*			trans	-112.9	151.2	-180	0	0	0	0	0	111.1
25	G	29.8	Very low	25.9	Very low	79 Å²	79	157.1 Å²	157.1	81%	0.814	85%	0.848	S	S	*	*			trans	-151.8	137	171.6	0	0	0	0	0	108.7
26	S	27.9	Very low	26.1	Very low	120 Å²	120	154.6 Å²	154.6	84%	0.839	85%	0.849	S	S	*	*			trans	-90	160.3	-157.7	44.9	0	0	0	0	115.7
27	P	27.6	Very low	26.1	Very low	123 Å²	123	151.3 Å²	151.3	80%	0.799	84%	0.842	S	S	*	*			trans	-90.5	165.3	-179.6	37.4	-36.2	0	0	0	113.4
28	K	31.2	Very low	26.2	Very low	213 Å²	213	154.4 Å²	154.4	93%	0.926	85%	0.85	S	S	*	*			trans	-137.8	133.6	157.8	-75.6	-168.5	175.6	-175.9	0	110.8
29	S	24.3	Very low	26.2	Very low	97 Å²	97	151.5 Å²	151.5	68%	0.678	84%	0.844	S	S	*	*			trans	-86.9	161	172.7	46.8	0	0	0	0	111.6
30	H	30	Very low	26.4	Very low	185 Å²	185	151.7 Å²	151.7	86%	0.856	85%	0.848	S	S	*	*				-172.7	133.9	126.4	-99.7	-64.5	0	0	0	111.5
31	D	24.5	Very low	26.3	Very low	140 Å²	140	145.5 Å²	145.5	75%	0.749	84%	0.84	S	S	*	*			trans	-77.6	150.6	177.8	-49.3	-88.3	0	0	0	112.8
32	T	28.9	Very low	26.2	Very low	145 Å²	145	140.9 Å²	140.9	89%	0.89	84%	0.84	S	S	*	*			trans	-152.7	125.6	139.2	-38.6	0	0	0	0	110.5
33	V	23.6	Very low	26.4	Very low	130 Å²	130	133.7 Å²	133.7	79%	0.788	83%	0.831	S	S	*	*			trans	-100.6	134.9	174	171.2	0	0	0	0	109.2
34	A	26.4	Very low	26.6	Very low	100 Å²	100	136.2 Å²	136.2	83%	0.826	83%	0.83	S	S	*	*			trans	-136.2	125	163.9	0	0	0	0	0	110
35	R	21.5	Very low	26.6	Very low	236 Å²	236	137.5 Å²	137.5	89%	0.891	83%	0.827	S	S	*	*			trans	-97	138.5	171.7	-69.8	174.8	172.4	172.1	-3.7	109.3
36	T	27.6	Very low	26.7	Very low	149 Å²	149	138.1 Å²	138.1	91%	0.914	81%	0.81	S	S	*	*			trans	-146	142.9	140	39.5	0	0	0	0	109.3
37	S	24.4	Very low	26.7	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	79%	0.792	S	S	*	*			trans	-84.8	146	-174.8	47.6	0	0	0	0	113.1
38	D	25.9	Very low	26.9	Very low	167 Å²	167	135.3 Å²	135.3	89%	0.893	79%	0.787	S	S	*	*			trans	-154.2	156.1	132.3	-120.6	-25.8	0	0	0	111.7
39	S	24.2	Very low	26.9	Very low	112 Å²	112	131 Å²	131	78%	0.783	77%	0.77	S	S	*	*			trans	-111.6	121.8	-161	57	0	0	0	0	115.1
40	S	29	Very low	27.2	Very low	124 Å²	124	129.9 Å²	129.9	87%	0.867	76%	0.759	S	S	*	*			trans	-154.3	161.5	157.4	59.1	0	0	0	0	111.1
41	S	26.1	Very low	27.1	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	74%	0.742	S	S	*	*			trans	-63.4	153.8	-156.1	47.3	0	0	0	0	117.4	A43	S41-A43 PolarHBondContact O-N 3.05Å
42	P	24.5	Very low	27.4	Very low	137 Å²	137	123 Å²	123	89%	0.89	73%	0.729	S	S	*	*			trans	-84.8	98.8	-178.8	33.9	-33.5	0	0	0	112.3
43	A	26.5	Very low	27.4	Very low	86 Å²	86	120.7 Å²	120.7	71%	0.711	71%	0.71	S	S	*	*			trans	-122.7	99.8	162	0	0	0	0	0	108.7	S41 T45	S41-A43 PolarHBondContact O-N 3.05Å; A43-T45 PolarHBondContact O-N 2.82Å
44	E	28	Very low	27.6	Very low	191 Å²	191	117 Å²	117	89%	0.893	69%	0.693	S	S	*	*			trans	-11.2	85.5	-178.4	-63	-177.7	144.2	0	0	116.4	I46	E44-I46 PolarHBondContact O-N 3.47Å
45	T	27.1	Very low	27.7	Very low	134 Å²	134	120 Å²	120	82%	0.822	68%	0.683	S	S	*	*			trans	-65.1	97.4	166.1	32.6	0	0	0	0	109.2	A43 P47	A43-T45 PolarHBondContact O-N 2.82Å; T45-P47 VanDerWaalsContact O-N 3.11Å
46	I	30.6	Very low	28	Very low	91 Å²	91	110 Å²	110	47%	0.467	65%	0.654	S	S	.	*			trans	-43.1	120.6	168.4	-64.2	172.4	0	0	0	107.9	E44 V50 K51	E44-I46 PolarHBondContact O-N 3.47Å; I46-V50 HydrophobicContact CG2-CB 3.74Å; I46-V50 HydrophobicContact CG2-CG1 3.75Å; I46-K51 HydrophobicContact CG2-CG 4.08Å
47	P	28.8	Very low	28.1	Very low	69 Å²	69	107 Å²	107	45%	0.448	63%	0.629	S	S	.	*			trans	-53.4	144.3	-173.2	-26.7	32.6	0	0	0	111.3	T45 E49 V50 K51	T45-P47 VanDerWaalsContact O-N 3.11Å; P47-E49 WeakPolarHBondContact CB-OE2 3.31Å; P47-E49 PolarHBondContact O-N 3.38Å; P47-E49 VanDerWaalsContact O-N 3.13Å; P47-V50 HydrophobicContact CB-CG2 4.19Å; P47-V50 HydrophobicContact CG-CG2 4.2Å; P47-V50 WeakPolarHBondContact O-CA 3.36Å; P47-V50 PolarHBondContact O-N 3.48Å; P47-K51 PolarHBondContact O-N 3.32Å; P47-K51 VanDerWaalsContact O-N 3.09Å
48	V	32.4	Very low	28.4	Very low	116 Å²	116	109.9 Å²	109.9	70%	0.703	63%	0.627	S	S	*	*	H	α-helix	trans	-59.9	-29	-179.1	178.7	0	0	0	0	110.1	K51 S52	V48-K51 PolarHBondContact O-N 3.2Å; V48-S52 VanDerWaalsContact O-CB 3.26Å; V48-S52 WeakPolarHBondContact O-CB 3.42Å; V48-S52 PolarHBondContact O-N 3.3Å; V48-S52 PolarHBondContact O-OG 3.23Å
49	E	29.9	Very low	28.6	Very low	122 Å²	122	109.3 Å²	109.3	57%	0.57	62%	0.617	S	S	*	*	H	α-helix	trans	-61.8	-39.1	169.8	-57.3	79.7	-175.6	0	0	112.8	P47 S52 I53	P47-E49 WeakPolarHBondContact CB-OE2 3.31Å; P47-E49 PolarHBondContact O-N 3.38Å; P47-E49 VanDerWaalsContact O-N 3.13Å; E49-S52 WeakPolarHBondContact CA-OG 3.44Å; E49-S52 CarbonylContact O-C 3.51Å; E49-S52 PolarHBondContact O-N 3.43Å; E49-S52 PolarHBondContact O-OG 3.35Å; E49-S52 VanDerWaalsContact O-OG 3.11Å; E49-I53 VanDerWaalsContact O-CB 3.23Å; E49-I53 WeakPolarHBondContact O-CB 3.37Å; E49-I53 WeakPolarHBondContact O-CD1 3.27Å; E49-I53 WeakPolarHBondContact O-CG1 3.42Å; E49-I53 PolarHBondContact O-N 2.9Å
50	V	31	Very low	28.8	Very low	73 Å²	73	109.6 Å²	109.6	44%	0.442	61%	0.608	S	S	.	*	H	α-helix	trans	-74.3	-38.6	178	178	0	0	0	0	110.7	I46 P47 S52 I53 A54	I46-V50 HydrophobicContact CG2-CB 3.74Å; I46-V50 HydrophobicContact CG2-CG1 3.75Å; P47-V50 HydrophobicContact CB-CG2 4.19Å; P47-V50 HydrophobicContact CG-CG2 4.2Å; P47-V50 WeakPolarHBondContact O-CA 3.36Å; P47-V50 PolarHBondContact O-N 3.48Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 2.96Å; V50-I53 PolarHBondContact O-N 2.89Å; V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 2.89Å
51	K	29	Very low	29	Very low	114 Å²	114	107.1 Å²	107.1	50%	0.496	59%	0.589	S	S	.	*	H	α-helix	trans	-66.3	-32.5	170.3	-78.3	-176.7	176.5	178.9	0	112.1	I46 P47 V48 R55	I46-K51 HydrophobicContact CG2-CG 4.08Å; P47-K51 PolarHBondContact O-N 3.32Å; P47-K51 VanDerWaalsContact O-N 3.09Å; V48-K51 PolarHBondContact O-N 3.2Å; K51-R55 VanDerWaalsContact O-CB 3.22Å; K51-R55 WeakPolarHBondContact O-CB 3.32Å; K51-R55 VanDerWaalsContact O-CG 3.25Å; K51-R55 WeakPolarHBondContact O-CG 3.16Å; K51-R55 PolarHBondContact O-N 3.29Å
52	S	29.5	Very low	29.3	Very low	67 Å²	67	107.1 Å²	107.1	47%	0.469	58%	0.584	S	S	.	*	H	α-helix	trans	-81.8	-24.2	175.4	81.8	0	0	0	0	113.2	V48 E49 V50 G56	V48-S52 VanDerWaalsContact O-CB 3.26Å; V48-S52 WeakPolarHBondContact O-CB 3.42Å; V48-S52 PolarHBondContact O-N 3.3Å; V48-S52 PolarHBondContact O-OG 3.23Å; E49-S52 WeakPolarHBondContact CA-OG 3.44Å; E49-S52 CarbonylContact O-C 3.51Å; E49-S52 PolarHBondContact O-N 3.43Å; E49-S52 PolarHBondContact O-OG 3.35Å; E49-S52 VanDerWaalsContact O-OG 3.11Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 2.96Å; S52-G56 WeakPolarHBondContact O-CA 3.29Å; S52-G56 PolarHBondContact O-N 3.17Å
53	I	29.6	Very low	29.4	Very low	97 Å²	97	104 Å²	104	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-71.6	-49.3	167.9	-75.7	160.3	0	0	0	108.8	E49 V50 G56 F57	E49-I53 VanDerWaalsContact O-CB 3.23Å; E49-I53 WeakPolarHBondContact O-CB 3.37Å; E49-I53 WeakPolarHBondContact O-CD1 3.27Å; E49-I53 WeakPolarHBondContact O-CG1 3.42Å; E49-I53 PolarHBondContact O-N 2.9Å; V50-I53 PolarHBondContact O-N 2.89Å; I53-G56 CarbonylContact O-C 3.58Å; I53-G56 PolarHBondContact O-N 3.17Å; I53-F57 HydrophobicContact CG2-CD2 3.79Å; I53-F57 HydrophobicContact CG2-CE2 3.85Å; I53-F57 VanDerWaalsContact O-CB 3.27Å; I53-F57 WeakPolarHBondContact O-CB 3.27Å; I53-F57 VanDerWaalsContact O-CD2 3.23Å; I53-F57 WeakPolarHBondContact O-CD2 3.47Å; I53-F57 PolarHBondContact O-N 3.11Å
54	A	28.2	Very low	29.4	Very low	53 Å²	53	106.9 Å²	106.9	44%	0.438	57%	0.573	S	S	.	*	H	α-helix	trans	-60.1	-52	175.8	0	0	0	0	0	111.8	V50 G56 F57 F58	V50-A54 WeakPolarHBondContact O-CB 3.31Å; V50-A54 PolarHBondContact O-N 2.89Å; A54-G56 VanDerWaalsContact C-N 3.27Å; A54-G56 PolarHBondContact O-N 3.5Å; A54-F57 PolarHBondContact O-N 3.18Å; A54-F58 VanDerWaalsContact O-CD2 3.26Å; A54-F58 WeakPolarHBondContact O-CD2 3.25Å; A54-F58 PolarHBondContact O-N 2.94Å
55	R	27.6	Very low	29.4	Very low	161 Å²	161	104.6 Å²	104.6	61%	0.608	56%	0.56	S	S	*	*	H	α-helix	trans	-67.2	-27.3	175.6	-69.4	173	175.5	177	-2.1	112.9	K51 K59	K51-R55 VanDerWaalsContact O-CB 3.22Å; K51-R55 WeakPolarHBondContact O-CB 3.32Å; K51-R55 VanDerWaalsContact O-CG 3.25Å; K51-R55 WeakPolarHBondContact O-CG 3.16Å; K51-R55 PolarHBondContact O-N 3.29Å; R55-K59 WeakPolarHBondContact O-CB 3.33Å; R55-K59 WeakPolarHBondContact O-CD 3.28Å; R55-K59 WeakPolarHBondContact O-CG 3.37Å; R55-K59 PolarHBondContact O-N 3.33Å
56	G	28.1	Very low	29.5	Very low	28 Å²	28	105.9 Å²	105.9	29%	0.289	56%	0.557	S	S	.	*	H	α-helix	trans	-79.1	-33	179.9	0	0	0	0	0	112.9	S52 I53 A54 K59 I60	S52-G56 WeakPolarHBondContact O-CA 3.29Å; S52-G56 PolarHBondContact O-N 3.17Å; I53-G56 CarbonylContact O-C 3.58Å; I53-G56 PolarHBondContact O-N 3.17Å; A54-G56 VanDerWaalsContact C-N 3.27Å; A54-G56 PolarHBondContact O-N 3.5Å; G56-K59 CarbonylContact O-C 3.57Å; G56-K59 WeakPolarHBondContact O-CA 3.25Å; G56-K59 PolarHBondContact O-N 3.4Å; G56-I60 WeakPolarHBondContact O-CG1 3.3Å; G56-I60 PolarHBondContact O-N 2.76Å
57	F	30.1	Very low	29.2	Very low	86 Å²	86	106.1 Å²	106.1	38%	0.377	57%	0.572	S	S	.	*	H	α-helix	trans	-62.6	-42.9	171.9	-101.4	-111.2	0	0	0	111.8	I53 A54 K59 F301	I53-F57 HydrophobicContact CG2-CD2 3.79Å; I53-F57 HydrophobicContact CG2-CE2 3.85Å; I53-F57 VanDerWaalsContact O-CB 3.27Å; I53-F57 WeakPolarHBondContact O-CB 3.27Å; I53-F57 VanDerWaalsContact O-CD2 3.23Å; I53-F57 WeakPolarHBondContact O-CD2 3.47Å; I53-F57 PolarHBondContact O-N 3.11Å; A54-F57 PolarHBondContact O-N 3.18Å; F57-K59 PolarHBondContact O-N 3.28Å; F57-F301 HydrophobicContact CD1-CD2 4.39Å; F57-F301 HydrophobicContact CE1-CB 3.65Å; F57-F301 HydrophobicContact CE1-CD1 4.1Å; F57-F301 AromaticContact CE1-CD2 3.19Å; F57-F301 HydrophobicContact CE1-CD2 3.19Å; F57-F301 AromaticContact CE1-CE2 3.77Å; F57-F301 HydrophobicContact CE1-CE2 3.77Å; F57-F301 AromaticContact CE1-CG 3.36Å; F57-F301 HydrophobicContact CE1-CG 3.36Å; F57-F301 HydrophobicContact CE1-CZ 4.42Å; F57-F301 HydrophobicContact CZ-CB 4.17Å; F57-F301 AromaticContact CZ-CD1 3.74Å; F57-F301 HydrophobicContact CZ-CD1 3.74Å; F57-F301 AromaticContact CZ-CD2 3.4Å; F57-F301 HydrophobicContact CZ-CD2 3.4Å; F57-F301 VanDerWaalsContact CZ-CD2 3.4Å; F57-F301 AromaticContact CZ-CE1 3.88Å; F57-F301 HydrophobicContact CZ-CE1 3.88Å; F57-F301 AromaticContact CZ-CE2 3.54Å; F57-F301 HydrophobicContact CZ-CE2 3.54Å; F57-F301 AromaticContact CZ-CG 3.48Å; F57-F301 HydrophobicContact CZ-CG 3.48Å; F57-F301 VanDerWaalsContact CZ-CG 3.48Å; F57-F301 AromaticContact CZ-CZ 3.78Å; F57-F301 HydrophobicContact CZ-CZ 3.78Å
58	F	30.5	Very low	29	Very low	172 Å²	172	106.1 Å²	106.1	75%	0.754	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	5.9	170	-63.1	-69.2	0	0	0	113.5	A54	A54-F58 VanDerWaalsContact O-CD2 3.26Å; A54-F58 WeakPolarHBondContact O-CD2 3.25Å; A54-F58 PolarHBondContact O-N 2.94Å
59	K	29.3	Very low	28.9	Very low	154 Å²	154	107.3 Å²	107.3	67%	0.67	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	16.9	175.6	-70.9	179.8	178.1	-169.7	0	114	R55 G56 F57	R55-K59 WeakPolarHBondContact O-CB 3.33Å; R55-K59 WeakPolarHBondContact O-CD 3.28Å; R55-K59 WeakPolarHBondContact O-CG 3.37Å; R55-K59 PolarHBondContact O-N 3.33Å; G56-K59 CarbonylContact O-C 3.57Å; G56-K59 WeakPolarHBondContact O-CA 3.25Å; G56-K59 PolarHBondContact O-N 3.4Å; F57-K59 PolarHBondContact O-N 3.28Å
60	I	30	Very low	28.8	Very low	118 Å²	118	106.3 Å²	106.3	61%	0.605	58%	0.582	S	S	*	*	S	Bend	trans	-64.3	126.8	163.3	-58.2	-175.2	0	0	0	106.2	G56 V62	G56-I60 WeakPolarHBondContact O-CG1 3.3Å; G56-I60 PolarHBondContact O-N 2.76Å; I60-V62 PolarHBondContact O-N 2.91Å; I60-V62 VanDerWaalsContact O-N 3.16Å
61	P	31.9	Very low	28.7	Very low	73 Å²	73	112.9 Å²	112.9	47%	0.474	60%	0.6	S	S	.	*			trans	-72	114.5	-130.1	-26.3	36.2	0	0	0	115.8	A63 L64	P61-A63 HydrophobicContact CB-CB 4.14Å; P61-A63 PolarHBondContact O-N 3.49Å; P61-L64 PolarHBondContact O-N 3.23Å
62	V	32.1	Very low	28.8	Very low	107 Å²	107	113.1 Å²	113.1	65%	0.648	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-54.2	-29.1	156.4	178.9	0	0	0	0	110.6	I60 L64 F65 Q66	I60-V62 PolarHBondContact O-N 2.91Å; I60-V62 VanDerWaalsContact O-N 3.16Å; V62-L64 PolarHBondContact O-N 3.45Å; V62-L64 VanDerWaalsContact O-N 3.08Å; V62-F65 PolarHBondContact O-N 3.02Å; V62-Q66 PolarHBondContact O-N 3.12Å
63	A	26.3	Very low	28.8	Very low	71 Å²	71	119 Å²	119	59%	0.587	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-62.3	-8.5	172.9	0	0	0	0	0	115.5	P61	P61-A63 HydrophobicContact CB-CB 4.14Å; P61-A63 PolarHBondContact O-N 3.49Å
64	L	28.2	Very low	29.3	Very low	148 Å²	148	121.4 Å²	121.4	78%	0.775	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-101.1	0	170.3	-99.6	165.6	0	0	0	114	P61 V62	P61-L64 PolarHBondContact O-N 3.23Å; V62-L64 PolarHBondContact O-N 3.45Å; V62-L64 VanDerWaalsContact O-N 3.08Å
65	F	28.2	Very low	29.7	Very low	143 Å²	143	125.2 Å²	125.2	63%	0.627	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-1.3	168.3	-130.4	-101.4	0	0	0	112.7	V62 A67	V62-F65 PolarHBondContact O-N 3.02Å; F65-A67 PolarHBondContact O-N 3.47Å; F65-A67 VanDerWaalsContact O-N 3.14Å
66	Q	28.3	Very low	30.2	Very low	161 Å²	161	126.4 Å²	126.4	75%	0.752	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	13.5	-179	-121.6	169.8	-24	0	0	114.7	V62	V62-Q66 PolarHBondContact O-N 3.12Å
67	A	23.4	Very low	30.7	Very low	95 Å²	95	128.8 Å²	128.8	79%	0.785	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-13.3	-172.1	0	0	0	0	0	115.3	F65	F65-A67 PolarHBondContact O-N 3.47Å; F65-A67 VanDerWaalsContact O-N 3.14Å
68	A	25.8	Very low	31.1	Very low	69 Å²	69	128.4 Å²	128.4	57%	0.57	67%	0.673	S	S	*	*	S	Bend	trans	-161.8	132.4	178.9	0	0	0	0	0	112.6
69	L	29.5	Very low	31.5	Very low	141 Å²	141	123.7 Å²	123.7	74%	0.738	66%	0.655	S	S	*	*			cis	-155.3	119.8	-6	-100.4	162.6	0	0	0	106.6
70	V	27.8	Very low	31.7	Very low	102 Å²	102	123.4 Å²	123.4	62%	0.618	66%	0.661	S	S	*	*			trans	29.8	115.4	152.5	-125.5	0	0	0	0	116.9
71	Y	29.5	Very low	31.9	Very low	210 Å²	210	126.7 Å²	126.7	82%	0.824	67%	0.666	S	S	*	*				-158	159.1	56.8	-91.4	-89.8	0	0	0	113
72	P	30.1	Very low	32.4	Very low	120 Å²	120	127.5 Å²	127.5	78%	0.779	67%	0.666	S	S	*	*			trans	-104	54.4	-172.8	41.7	-34.6	0	0	0	114.6
73	E	31.1	Very low	32.8	Very low	189 Å²	189	132.6 Å²	132.6	88%	0.883	67%	0.673	S	S	*	*			trans	-140.8	94.5	168.8	-71.5	-172	-147.2	0	0	109.4
74	F	38.5	Very low	33.4	Very low	149 Å²	149	139 Å²	139	65%	0.654	68%	0.683	S	S	*	*			trans	-132.7	98.4	-180	-159.9	-90.9	0	0	0	110.5	P86	F74-P86 HydrophobicContact CE2-CG 4.13Å
75	E	36.3	Very low	34.2	Very low	133 Å²	133	135.5 Å²	135.5	62%	0.621	66%	0.664	S	S	*	*			trans	-77.7	125.2	165.2	-77.3	-162.4	145.5	0	0	109.7	T77 D78	E75-T77 PolarHBondContact O-N 2.77Å; E75-D78 PolarHBondContact O-N 2.7Å
76	E	38.8	Very low	34.9	Very low	185 Å²	185	130.9 Å²	130.9	86%	0.864	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-15.7	-178.1	-144.7	172.3	-166.9	0	0	113.2
77	T	38.6	Very low	35.8	Very low	78 Å²	78	131.3 Å²	131.3	48%	0.479	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-14.9	-177.4	48.1	0	0	0	0	115	E75 L79 R81	E75-T77 PolarHBondContact O-N 2.77Å; T77-L79 VanDerWaalsContact C-N 3.33Å; T77-L79 PolarHBondContact O-N 3.18Å; T77-R81 PolarHBondContact O-N 3.41Å
78	D	39.6	Very low	36.9	Very low	79 Å²	79	129.6 Å²	129.6	42%	0.422	64%	0.642	S	S	.	*	H	α-helix	trans	-73.2	-27	-172.6	-116.5	-1.7	0	0	0	113.3	E75 R81 N82	E75-D78 PolarHBondContact O-N 2.7Å; D78-R81 PolarHBondContact O-N 2.72Å; D78-N82 WeakPolarHBondContact O-CB 3.44Å; D78-N82 PolarHBondContact O-N 3.26Å; D78-N82 PolarHBondContact O-ND2 3.26Å; D78-N82 PolarHBondContact OD1-ND2 2.78Å
79	L	38.9	Very low	37.8	Very low	73 Å²	73	129.4 Å²	129.4	38%	0.382	63%	0.633	S	S	.	*	H	α-helix	trans	-69.5	-37.6	-179.7	-152.1	144.5	0	0	0	111.5	T77 I119	T77-L79 VanDerWaalsContact C-N 3.33Å; T77-L79 PolarHBondContact O-N 3.18Å; L79-I119 HydrophobicContact CD1-CD1 3.85Å; L79-I119 HydrophobicContact CD2-CD1 3.78Å; L79-I119 HydrophobicContact CD2-CG1 4.34Å
80	D	32.7	Very low	38.7	Very low	147 Å²	147	124.7 Å²	124.7	79%	0.786	61%	0.609	S	S	*	*	H	α-helix	trans	-75.6	-37.8	173	-99.2	-19.7	0	0	0	112.7
81	R	34.8	Very low	39.4	Very low	188 Å²	188	126.5 Å²	126.5	71%	0.709	61%	0.606	S	S	*	*	H	α-helix	trans	-67.7	-50.5	-179.8	-100.2	-178.5	171	164.9	-1.2	113	T77 D78	T77-R81 PolarHBondContact O-N 3.41Å; D78-R81 PolarHBondContact O-N 2.72Å
82	N	42.7	Very low	40.1	Very low	90 Å²	90	118.6 Å²	118.6	48%	0.481	59%	0.588	S	S	.	*	H	α-helix	trans	-98.9	-11.1	-162.8	-62.8	-41.5	0	0	0	114.1	D78 R84	D78-N82 WeakPolarHBondContact O-CB 3.44Å; D78-N82 PolarHBondContact O-N 3.26Å; D78-N82 PolarHBondContact O-ND2 3.26Å; D78-N82 PolarHBondContact OD1-ND2 2.78Å; N82-R84 WeakPolarHBondContact O-CG 3.49Å; N82-R84 PolarHBondContact O-N 2.73Å
83	R	39.7	Very low	40.8	Very low	213 Å²	213	114.1 Å²	114.1	80%	0.804	56%	0.556	S	S	*	*			trans	50.2	30.6	-179.6	-60.9	-178.7	174.3	160.9	-0.1	114
84	R	39.3	Very low	41.4	Very low	207 Å²	207	111.7 Å²	111.7	78%	0.781	54%	0.542	S	S	*	.	S	Bend	trans	-129.3	139.7	-178.9	-74.6	177.5	179.1	-170.8	-0.2	109.3	N82	N82-R84 WeakPolarHBondContact O-CG 3.49Å; N82-R84 PolarHBondContact O-N 2.73Å
85	I	44.2	Very low	41.4	Very low	73 Å²	73	111.8 Å²	111.8	37%	0.374	54%	0.543	S	S	.	.			trans	-69.9	129.5	171.2	-59.9	170.4	0	0	0	107.3	V89 L90 F123	I85-V89 HydrophobicContact CG2-CB 3.92Å; I85-V89 HydrophobicContact CG2-CG1 3.93Å; I85-L90 HydrophobicContact CB-CD1 4.44Å; I85-L90 HydrophobicContact CB-CD2 4.36Å; I85-L90 HydrophobicContact CB-CG 4.29Å; I85-L90 HydrophobicContact CG2-CD2 4.1Å; I85-L90 HydrophobicContact CG2-CG 3.96Å; I85-F123 HydrophobicContact CD1-CE2 4.37Å; I85-F123 HydrophobicContact CD1-CZ 3.92Å; I85-F123 HydrophobicContact CG2-CZ 4.21Å
86	P	43.6	Very low	41.3	Very low	47 Å²	47	111.5 Å²	111.5	31%	0.305	55%	0.545	S	S	.	.			trans	-57.4	139.7	-179.7	-26.2	34.3	0	0	0	112.6	F74 G88 V89 L90	F74-P86 HydrophobicContact CE2-CG 4.13Å; P86-G88 PolarHBondContact O-N 2.93Å; P86-G88 VanDerWaalsContact O-N 3.13Å; P86-V89 HydrophobicContact CB-CG2 4.36Å; P86-V89 WeakPolarHBondContact O-CB 3.28Å; P86-V89 PolarHBondContact O-N 3.27Å; P86-L90 PolarHBondContact O-N 2.9Å
87	E	47.4	Very low	41.2	Very low	169 Å²	169	104.4 Å²	104.4	79%	0.79	52%	0.521	S	S	*	.	H	α-helix	trans	-59.3	-29.3	-177.2	-72.1	-159.8	152.8	0	0	113.3	V89 L90 Y91	E87-V89 VanDerWaalsContact C-N 3.33Å; E87-V89 PolarHBondContact O-N 2.83Å; E87-L90 CarbonylContact O-C 3.52Å; E87-L90 PolarHBondContact O-N 3.44Å; E87-Y91 VanDerWaalsContact O-CB 3.25Å; E87-Y91 WeakPolarHBondContact O-CB 3.4Å; E87-Y91 PolarHBondContact O-N 3.24Å
88	G	46	Very low	41.6	Very low	60 Å²	60	101 Å²	101	62%	0.619	50%	0.502	S	S	*	.	H	α-helix	trans	-61.7	-37.3	173.8	0	0	0	0	0	113.5	P86 Y91 G92	P86-G88 PolarHBondContact O-N 2.93Å; P86-G88 VanDerWaalsContact O-N 3.13Å; G88-Y91 PolarHBondContact O-N 3.25Å; G88-G92 PolarHBondContact O-N 3.37Å; G88-G92 VanDerWaalsContact O-N 3.08Å
89	V	45.2	Very low	42.1	Very low	64 Å²	64	98.9 Å²	98.9	39%	0.388	49%	0.49	S	S	.	.	H	α-helix	trans	-69.6	-44.5	175	-180	0	0	0	0	109.9	I85 P86 E87 Y91 G92 F93 F123	I85-V89 HydrophobicContact CG2-CB 3.92Å; I85-V89 HydrophobicContact CG2-CG1 3.93Å; P86-V89 HydrophobicContact CB-CG2 4.36Å; P86-V89 WeakPolarHBondContact O-CB 3.28Å; P86-V89 PolarHBondContact O-N 3.27Å; E87-V89 VanDerWaalsContact C-N 3.33Å; E87-V89 PolarHBondContact O-N 2.83Å; V89-Y91 VanDerWaalsContact C-N 3.31Å; V89-Y91 PolarHBondContact O-N 2.73Å; V89-G92 PolarHBondContact O-N 2.93Å; V89-F93 HydrophobicContact CG1-CD2 4.33Å; V89-F93 WeakPolarHBondContact O-CD2 3.04Å; V89-F93 PolarHBondContact O-N 2.76Å; V89-F123 HydrophobicContact CG1-CZ 4.23Å
90	L	47.2	Very low	42.6	Very low	43 Å²	43	99.5 Å²	99.5	23%	0.225	51%	0.506	C	S	.	.	H	α-helix	trans	-63.4	-34.1	175.5	-65.8	170.7	0	0	0	112.5	I85 P86 E87 F93 K94	I85-L90 HydrophobicContact CB-CD1 4.44Å; I85-L90 HydrophobicContact CB-CD2 4.36Å; I85-L90 HydrophobicContact CB-CG 4.29Å; I85-L90 HydrophobicContact CG2-CD2 4.1Å; I85-L90 HydrophobicContact CG2-CG 3.96Å; P86-L90 PolarHBondContact O-N 2.9Å; E87-L90 CarbonylContact O-C 3.52Å; E87-L90 PolarHBondContact O-N 3.44Å; L90-F93 WeakPolarHBondContact O-CB 3.46Å; L90-F93 PolarHBondContact O-N 3.4Å; L90-K94 WeakPolarHBondContact O-CB 3.33Å; L90-K94 PolarHBondContact O-N 3.42Å
91	Y	44	Very low	43.4	Very low	140 Å²	140	95.2 Å²	95.2	55%	0.549	48%	0.483	S	S	.	.	H	α-helix	trans	-69.6	-42.4	177.2	-174.5	-91.4	0	0	0	111.7	E87 G88 V89 F93 K94 K95	E87-Y91 VanDerWaalsContact O-CB 3.25Å; E87-Y91 WeakPolarHBondContact O-CB 3.4Å; E87-Y91 PolarHBondContact O-N 3.24Å; G88-Y91 PolarHBondContact O-N 3.25Å; V89-Y91 VanDerWaalsContact C-N 3.31Å; V89-Y91 PolarHBondContact O-N 2.73Å; Y91-F93 VanDerWaalsContact C-N 3.32Å; Y91-F93 PolarHBondContact O-N 3.3Å; Y91-K94 PolarHBondContact O-N 3.4Å; Y91-K95 HydrophobicContact CE1-CD 4.27Å; Y91-K95 PolarHBondContact O-N 2.97Å
92	G	42.9	Very low	44.1	Very low	43 Å²	43	90.1 Å²	90.1	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-41.5	171.2	0	0	0	0	0	112.5	G88 V89	G88-G92 PolarHBondContact O-N 3.37Å; G88-G92 VanDerWaalsContact O-N 3.08Å; V89-G92 PolarHBondContact O-N 2.93Å
93	F	46.6	Very low	44.5	Very low	27 Å²	27	88.3 Å²	88.3	12%	0.118	47%	0.465	C	S	.	.	H	α-helix	trans	-62.4	-48.8	172.6	-99.7	-95.6	0	0	0	112.8	V89 L90 Y91 K95 L96 G97 G98 L109 F123 N127	V89-F93 HydrophobicContact CG1-CD2 4.33Å; V89-F93 WeakPolarHBondContact O-CD2 3.04Å; V89-F93 PolarHBondContact O-N 2.76Å; L90-F93 WeakPolarHBondContact O-CB 3.46Å; L90-F93 PolarHBondContact O-N 3.4Å; Y91-F93 VanDerWaalsContact C-N 3.32Å; Y91-F93 PolarHBondContact O-N 3.3Å; F93-K95 VanDerWaalsContact C-N 3.32Å; F93-K95 PolarHBondContact O-N 3.35Å; F93-L96 PolarHBondContact O-N 3.08Å; F93-G97 PolarHBondContact O-N 3.1Å; F93-G98 PolarHBondContact O-N 3.05Å; F93-G98 VanDerWaalsContact O-N 3.1Å; F93-L109 HydrophobicContact CZ-CD2 4.29Å; F93-F123 HydrophobicContact CD2-CE1 4.31Å; F93-F123 HydrophobicContact CE1-CD1 4.39Å; F93-F123 HydrophobicContact CE1-CE1 4.44Å; F93-F123 AromaticContact CE2-CD1 3.98Å; F93-F123 HydrophobicContact CE2-CD1 3.98Å; F93-F123 AromaticContact CE2-CE1 3.59Å; F93-F123 HydrophobicContact CE2-CE1 3.59Å; F93-F123 AromaticContact CZ-CD1 3.63Å; F93-F123 HydrophobicContact CZ-CD1 3.63Å; F93-F123 AromaticContact CZ-CE1 3.69Å; F93-F123 HydrophobicContact CZ-CE1 3.69Å; F93-N127 WeakPolarHBondContact CE1-ND2 3.34Å; F93-N127 WeakPolarHBondContact CZ-ND2 3.08Å
94	K	41.7	Very low	45	Very low	137 Å²	137	85 Å²	85	60%	0.596	46%	0.457	S	S	*	.	H	α-helix	trans	-55.3	-41.5	-179.6	-103.7	176.9	175.7	170.6	0	113.5	L90 Y91	L90-K94 WeakPolarHBondContact O-CB 3.33Å; L90-K94 PolarHBondContact O-N 3.42Å; Y91-K94 PolarHBondContact O-N 3.4Å
95	K	38.5	Very low	45.5	Very low	151 Å²	151	77 Å²	77	66%	0.657	44%	0.435	S	S	*	.	H	α-helix	trans	-83	-14.8	-168.9	-150.4	172.7	-174.3	173.7	0	114.5	Y91 F93	Y91-K95 HydrophobicContact CE1-CD 4.27Å; Y91-K95 PolarHBondContact O-N 2.97Å; F93-K95 VanDerWaalsContact C-N 3.32Å; F93-K95 PolarHBondContact O-N 3.35Å
96	L	34.6	Very low	46	Very low	127 Å²	127	73.9 Å²	73.9	67%	0.665	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.3	14.3	178.5	-71.2	168	0	0	0	112.8	F93 G98	F93-L96 PolarHBondContact O-N 3.08Å; L96-G98 PolarHBondContact O-N 2.86Å
97	G	38.3	Very low	46.5	Very low	36 Å²	36	73.5 Å²	73.5	37%	0.371	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	8.3	174.7	0	0	0	0	0	115.6	F93 L99	F93-G97 PolarHBondContact O-N 3.1Å; G97-L99 WeakPolarHBondContact O-CB 3.49Å; G97-L99 PolarHBondContact O-N 3.45Å
98	G	45.4	Very low	46.7	Very low	7 Å²	7	69.9 Å²	69.9	7%	0.072	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-18.4	174.6	0	0	0	0	0	118.2	F93 L96	F93-G98 PolarHBondContact O-N 3.05Å; F93-G98 VanDerWaalsContact O-N 3.1Å; L96-G98 PolarHBondContact O-N 2.86Å
99	L	50.1	Low	47.2	Very low	34 Å²	34	69.2 Å²	69.2	18%	0.178	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-12.3	-161.6	-67.7	161.2	0	0	0	112.8	G97 N127 L147	G97-L99 WeakPolarHBondContact O-CB 3.49Å; G97-L99 PolarHBondContact O-N 3.45Å; L99-N127 HydrophobicContact CD2-CB 4.37Å; L99-L147 HydrophobicContact CD1-CB 4.16Å; L99-L147 HydrophobicContact CD1-CD2 3.83Å; L99-L147 HydrophobicContact CD1-CG 4.48Å
100	A	48.9	Very low	48	Very low	86 Å²	86	67.4 Å²	67.4	71%	0.711	37%	0.368	S	S	*	.			trans	-94.9	17	-178.2	0	0	0	0	0	113.4	C102	A100-C102 PolarHBondContact O-N 3.45Å
101	L	51.4	Low	48.2	Very low	57 Å²	57	67.4 Å²	67.4	30%	0.298	37%	0.374	S	S	.	.			trans	-67.1	129.4	171.9	-64.8	-175.1	0	0	0	109.6	A105 S106 L109	L101-A105 HydrophobicContact CB-CB 4.14Å; L101-A105 HydrophobicContact CD2-CB 4.17Å; L101-S106 WeakPolarHBondContact CB-OG 3.26Å; L101-L109 HydrophobicContact CD1-CD2 3.82Å
102	C	49	Very low	48.7	Very low	81 Å²	81	66.4 Å²	66.4	55%	0.547	38%	0.375	S	S	.	.			trans	-66	153.9	169.6	71.8	0	0	0	0	109.7	A100 K104 A105 S106	A100-C102 PolarHBondContact O-N 3.45Å; C102-K104 PolarHBondContact O-N 2.92Å; C102-A105 WeakPolarHBondContact O-CA 3.33Å; C102-A105 PolarHBondContact O-N 3.41Å; C102-S106 PolarHBondContact O-N 3.46Å
103	N	51.4	Low	49	Very low	53 Å²	53	66.1 Å²	66.1	28%	0.283	36%	0.363	S	S	.	.	H	α-helix	trans	-51.4	-31	-174.8	-68.6	-19.2	0	0	0	113.9	S107 C315	N103-S107 WeakPolarHBondContact O-CB 3.43Å; N103-S107 PolarHBondContact O-N 3.27Å; N103-C315 PolarHBondContact ND2-SG 3.28Å; N103-C315 VanDerWaalsContact ND2-SG 3.42Å
104	K	49	Very low	49	Very low	142 Å²	142	65 Å²	65	62%	0.617	36%	0.359	S	S	*	.	H	α-helix	trans	-68.1	-40.5	174.3	-172.2	-175.5	178.6	-169.3	0	113	C102 K108	C102-K104 PolarHBondContact O-N 2.92Å; K104-K108 PolarHBondContact O-N 3.13Å; K104-K108 VanDerWaalsContact O-N 3.08Å
105	A	50.3	Low	49.1	Very low	39 Å²	39	61.6 Å²	61.6	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-71.7	-43.7	177.1	0	0	0	0	0	111.1	L101 C102 K108 L109	L101-A105 HydrophobicContact CB-CB 4.14Å; L101-A105 HydrophobicContact CD2-CB 4.17Å; C102-A105 WeakPolarHBondContact O-CA 3.33Å; C102-A105 PolarHBondContact O-N 3.41Å; A105-K108 PolarHBondContact O-N 3.23Å; A105-L109 PolarHBondContact O-N 3.2Å
106	S	54.4	Low	49.3	Very low	9 Å²	9	57.6 Å²	57.6	6%	0.063	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-46.8	171.5	-59.2	0	0	0	0	111.5	L101 C102 K108 L109 Y110	L101-S106 WeakPolarHBondContact CB-OG 3.26Å; C102-S106 PolarHBondContact O-N 3.46Å; S106-K108 VanDerWaalsContact C-N 3.31Å; S106-K108 PolarHBondContact O-N 3.43Å; S106-L109 PolarHBondContact O-N 3.26Å; S106-Y110 WeakPolarHBondContact O-CB 3.46Å; S106-Y110 WeakPolarHBondContact O-CD2 3.44Å; S106-Y110 PolarHBondContact O-N 2.75Å
107	S	53.4	Low	49.8	Very low	39 Å²	39	54.7 Å²	54.7	27%	0.273	33%	0.327	S	S	.	.	H	α-helix	trans	-57.2	-41.7	176.8	169.8	0	0	0	0	112.3	N103 A111	N103-S107 WeakPolarHBondContact O-CB 3.43Å; N103-S107 PolarHBondContact O-N 3.27Å; S107-A111 WeakPolarHBondContact O-CB 3.07Å; S107-A111 PolarHBondContact O-N 3.01Å
108	K	52.8	Low	50	Low	92 Å²	92	56.9 Å²	56.9	40%	0.4	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-49.7	174.6	-168.8	-179.3	179.1	-167.5	0	111.4	K104 A105 S106 Y110 A111 E112	K104-K108 PolarHBondContact O-N 3.13Å; K104-K108 VanDerWaalsContact O-N 3.08Å; A105-K108 PolarHBondContact O-N 3.23Å; S106-K108 VanDerWaalsContact C-N 3.31Å; S106-K108 PolarHBondContact O-N 3.43Å; K108-Y110 PolarHBondContact O-N 2.96Å; K108-A111 WeakPolarHBondContact O-CB 3.28Å; K108-A111 PolarHBondContact O-N 3.38Å; K108-E112 VanDerWaalsContact CE-OE1 3.22Å; K108-E112 WeakPolarHBondContact CE-OE1 3.46Å; K108-E112 WeakPolarHBondContact O-CG 3Å; K108-E112 PolarHBondContact O-N 3.07Å; K108-E112 VanDerWaalsContact O-N 3.1Å
109	L	55.8	Low	50.3	Low	47 Å²	47	58.6 Å²	58.6	25%	0.246	34%	0.344	C	S	.	.	H	α-helix	trans	-51.8	-46.6	177.1	175.2	63.6	0	0	0	111.2	F93 L101 A105 S106 E112 L113	F93-L109 HydrophobicContact CZ-CD2 4.29Å; L101-L109 HydrophobicContact CD1-CD2 3.82Å; A105-L109 PolarHBondContact O-N 3.2Å; S106-L109 PolarHBondContact O-N 3.26Å; L109-E112 PolarHBondContact O-N 2.94Å; L109-L113 HydrophobicContact CD1-CD1 3.96Å; L109-L113 HydrophobicContact CD1-CG 4Å; L109-L113 HydrophobicContact CG-CD1 3.91Å; L109-L113 HydrophobicContact CG-CG 4.28Å; L109-L113 WeakPolarHBondContact O-CB 3.25Å; L109-L113 VanDerWaalsContact O-CG 3.31Å; L109-L113 WeakPolarHBondContact O-CG 3.04Å; L109-L113 PolarHBondContact O-N 3.44Å
110	Y	61.9	Low	50.5	Low	26 Å²	26	58 Å²	58	10%	0.102	34%	0.339	C	S	.	.	H	α-helix	trans	-70.6	-27.9	179.2	-68.2	-43.6	0	0	0	114.3	S106 K108 L113 G114 F120 F123 Y124 N127 E128	S106-Y110 WeakPolarHBondContact O-CB 3.46Å; S106-Y110 WeakPolarHBondContact O-CD2 3.44Å; S106-Y110 PolarHBondContact O-N 2.75Å; K108-Y110 PolarHBondContact O-N 2.96Å; Y110-L113 HydrophobicContact CD1-CD1 4.29Å; Y110-L113 HydrophobicContact CE1-CD1 4.48Å; Y110-G114 PolarHBondContact O-N 2.88Å; Y110-F120 AromaticContact CD1-CD2 3.63Å; Y110-F120 HydrophobicContact CD1-CD2 3.63Å; Y110-F120 AromaticContact CD1-CE2 3.59Å; Y110-F120 HydrophobicContact CD1-CE2 3.59Å; Y110-F120 HydrophobicContact CE1-CE2 4.44Å; Y110-F120 HydrophobicContact CG-CD2 4.1Å; Y110-F120 AromaticContact CG-CE2 3.71Å; Y110-F120 HydrophobicContact CG-CE2 3.71Å; Y110-F123 HydrophobicContact CE1-CB 4.36Å; Y110-F123 PolarHBondContact OH-O 3.27Å; Y110-Y124 HydrophobicContact CD2-CD2 4.38Å; Y110-Y124 HydrophobicContact CE1-CD2 4.35Å; Y110-Y124 HydrophobicContact CE2-CD2 4.12Å; Y110-N127 WeakPolarHBondContact OH-CB 3.43Å; Y110-E128 HydrophobicContact CE2-CG 3.61Å; Y110-E128 WeakPolarHBondContact OH-CG 3.38Å
111	A	52.6	Low	50.6	Low	42 Å²	42	55.2 Å²	55.2	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-68.6	-36.4	171.7	0	0	0	0	0	112.5	S107 K108 N270	S107-A111 WeakPolarHBondContact O-CB 3.07Å; S107-A111 PolarHBondContact O-N 3.01Å; K108-A111 WeakPolarHBondContact O-CB 3.28Å; K108-A111 PolarHBondContact O-N 3.38Å; A111-N270 PolarHBondContact O-ND2 3.43Å; A111-N270 VanDerWaalsContact O-ND2 3.07Å
112	E	52.8	Low	50.8	Low	120 Å²	120	55.1 Å²	55.1	56%	0.561	32%	0.316	S	S	*	.	H	α-helix	trans	-73.4	-49.9	173.6	-51.2	-61.8	170.9	0	0	110.8	K108 L109 G114 A115	K108-E112 VanDerWaalsContact CE-OE1 3.22Å; K108-E112 WeakPolarHBondContact CE-OE1 3.46Å; K108-E112 WeakPolarHBondContact O-CG 3Å; K108-E112 PolarHBondContact O-N 3.07Å; K108-E112 VanDerWaalsContact O-N 3.1Å; L109-E112 PolarHBondContact O-N 2.94Å; E112-G114 PolarHBondContact O-N 3.27Å; E112-A115 VanDerWaalsContact O-CB 3.29Å; E112-A115 WeakPolarHBondContact O-CB 3.33Å; E112-A115 PolarHBondContact O-N 3.49Å
113	L	51.1	Low	51.4	Low	37 Å²	37	52.2 Å²	52.2	19%	0.194	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-25.1	177.8	-67.4	-177.4	0	0	0	112.6	L109 Y110 A115 D116 I119 F120 F123	L109-L113 HydrophobicContact CD1-CD1 3.96Å; L109-L113 HydrophobicContact CD1-CG 4Å; L109-L113 HydrophobicContact CG-CD1 3.91Å; L109-L113 HydrophobicContact CG-CG 4.28Å; L109-L113 WeakPolarHBondContact O-CB 3.25Å; L109-L113 VanDerWaalsContact O-CG 3.31Å; L109-L113 WeakPolarHBondContact O-CG 3.04Å; L109-L113 PolarHBondContact O-N 3.44Å; Y110-L113 HydrophobicContact CD1-CD1 4.29Å; Y110-L113 HydrophobicContact CE1-CD1 4.48Å; L113-A115 PolarHBondContact O-N 2.94Å; L113-D116 CarbonylContact O-C 3.39Å; L113-D116 PolarHBondContact O-N 2.72Å; L113-I119 HydrophobicContact CD2-CG2 3.92Å; L113-F120 HydrophobicContact CB-CB 4.25Å; L113-F123 HydrophobicContact CD1-CB 3.77Å; L113-F123 HydrophobicContact CD1-CD2 3.96Å; L113-F123 HydrophobicContact CD1-CG 3.88Å
114	G	46	Very low	52	Low	3 Å²	3	51.2 Å²	51.2	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.1	173.1	0	0	0	0	0	114.7	Y110 E112 D116 C267	Y110-G114 PolarHBondContact O-N 2.88Å; E112-G114 PolarHBondContact O-N 3.27Å; G114-D116 PolarHBondContact O-N 3.18Å; G114-C267 WeakPolarHBondContact O-CB 3.1Å
115	A	43.9	Very low	52.5	Low	65 Å²	65	44.8 Å²	44.8	54%	0.537	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.5	164.9	0	0	0	0	0	113.4	E112 L113 V271	E112-A115 VanDerWaalsContact O-CB 3.29Å; E112-A115 WeakPolarHBondContact O-CB 3.33Å; E112-A115 PolarHBondContact O-N 3.49Å; L113-A115 PolarHBondContact O-N 2.94Å; A115-V271 WeakPolarHBondContact O-CG2 3.45Å
116	D	41.6	Very low	53.3	Low	67 Å²	67	43.5 Å²	43.5	36%	0.358	25%	0.246	S	C	.	.	S	Bend	trans	-132.5	117.4	166.1	-174	-75.6	0	0	0	110.6	L113 G114 S118 I119 F120	L113-D116 CarbonylContact O-C 3.39Å; L113-D116 PolarHBondContact O-N 2.72Å; G114-D116 PolarHBondContact O-N 3.18Å; D116-S118 PolarHBondContact O-N 3.01Å; D116-S118 VanDerWaalsContact OD1-CA 3.25Å; D116-S118 WeakPolarHBondContact OD1-CA 3.39Å; D116-S118 WeakPolarHBondContact OD1-CB 3.37Å; D116-S118 PolarHBondContact OD1-N 3Å; D116-S118 PolarHBondContact OD1-OG 3.14Å; D116-S118 VanDerWaalsContact OD1-OG 3.11Å; D116-I119 HydrophobicContact CB-CB 4.1Å; D116-I119 HydrophobicContact CB-CD1 3.82Å; D116-I119 HydrophobicContact CB-CG1 3.87Å; D116-I119 PolarHBondContact O-N 3.3Å; D116-I119 PolarHBondContact OD1-N 2.92Å; D116-F120 WeakPolarHBondContact O-CB 3.13Å; D116-F120 PolarHBondContact O-N 3.27Å
117	L	44.7	Very low	53.9	Low	67 Å²	67	43.5 Å²	43.5	35%	0.351	25%	0.246	S	C	.	.	H	α-helix	trans	-61.8	-32.2	-177.2	-176	70.8	0	0	0	112.7	F120 T121 V264 C267	L117-F120 HydrophobicContact CD1-CD1 4.12Å; L117-T121 WeakPolarHBondContact O-CB 3.45Å; L117-T121 PolarHBondContact O-N 3.3Å; L117-T121 PolarHBondContact O-OG1 2.94Å; L117-V264 HydrophobicContact CD1-CG1 4.49Å; L117-V264 HydrophobicContact CD2-CG1 4Å; L117-V264 HydrophobicContact CD2-CG2 3.89Å; L117-C267 HydrophobicContact CD1-CB 3.9Å; L117-C267 VanDerWaalsContact CD1-SG 3.56Å
118	S	43.7	Very low	54.6	Low	82 Å²	82	42.8 Å²	42.8	57%	0.573	24%	0.238	S	C	*	.	H	α-helix	trans	-71.4	-44.6	-179.2	-32.1	0	0	0	0	110.5	D116 T122	D116-S118 PolarHBondContact O-N 3.01Å; D116-S118 VanDerWaalsContact OD1-CA 3.25Å; D116-S118 WeakPolarHBondContact OD1-CA 3.39Å; D116-S118 WeakPolarHBondContact OD1-CB 3.37Å; D116-S118 PolarHBondContact OD1-N 3Å; D116-S118 PolarHBondContact OD1-OG 3.14Å; D116-S118 VanDerWaalsContact OD1-OG 3.11Å; S118-T122 WeakPolarHBondContact O-CB 3.48Å; S118-T122 PolarHBondContact O-N 3.48Å; S118-T122 PolarHBondContact O-OG1 3.48Å
119	I	50.4	Low	55.2	Low	43 Å²	43	39 Å²	39	22%	0.221	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-53.7	174.2	-58.1	179.6	0	0	0	109.3	L79 L113 D116 T121 T122 F123	L79-I119 HydrophobicContact CD1-CD1 3.85Å; L79-I119 HydrophobicContact CD2-CD1 3.78Å; L79-I119 HydrophobicContact CD2-CG1 4.34Å; L113-I119 HydrophobicContact CD2-CG2 3.92Å; D116-I119 HydrophobicContact CB-CB 4.1Å; D116-I119 HydrophobicContact CB-CD1 3.82Å; D116-I119 HydrophobicContact CB-CG1 3.87Å; D116-I119 PolarHBondContact O-N 3.3Å; D116-I119 PolarHBondContact OD1-N 2.92Å; I119-T121 PolarHBondContact O-N 2.85Å; I119-T122 PolarHBondContact O-N 3.04Å; I119-T122 VanDerWaalsContact O-N 3.16Å; I119-F123 HydrophobicContact CG2-CD2 3.66Å; I119-F123 HydrophobicContact CG2-CE2 3.74Å; I119-F123 WeakPolarHBondContact O-CD2 3.29Å; I119-F123 PolarHBondContact O-N 2.87Å
120	F	54.4	Low	55.6	Low	20 Å²	20	36.9 Å²	36.9	9%	0.088	21%	0.211	C	C	.	.	H	α-helix	trans	-51	-52.3	176.7	165	-107.2	0	0	0	112.1	Y110 L113 D116 L117 T122 F123 Y124 F250	Y110-F120 AromaticContact CD1-CD2 3.63Å; Y110-F120 HydrophobicContact CD1-CD2 3.63Å; Y110-F120 AromaticContact CD1-CE2 3.59Å; Y110-F120 HydrophobicContact CD1-CE2 3.59Å; Y110-F120 HydrophobicContact CE1-CE2 4.44Å; Y110-F120 HydrophobicContact CG-CD2 4.1Å; Y110-F120 AromaticContact CG-CE2 3.71Å; Y110-F120 HydrophobicContact CG-CE2 3.71Å; L113-F120 HydrophobicContact CB-CB 4.25Å; D116-F120 WeakPolarHBondContact O-CB 3.13Å; D116-F120 PolarHBondContact O-N 3.27Å; L117-F120 HydrophobicContact CD1-CD1 4.12Å; F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 PolarHBondContact O-N 3.3Å; F120-F123 PolarHBondContact O-N 3.19Å; F120-Y124 AromaticContact CE2-CD2 3.99Å; F120-Y124 HydrophobicContact CE2-CD2 3.99Å; F120-Y124 HydrophobicContact CE2-CG 4.33Å; F120-Y124 AromaticContact CZ-CD2 3.97Å; F120-Y124 HydrophobicContact CZ-CD2 3.97Å; F120-Y124 HydrophobicContact CZ-CG 4.14Å; F120-Y124 WeakPolarHBondContact O-CB 3.32Å; F120-Y124 PolarHBondContact O-N 3.39Å; F120-F250 AromaticContact CE1-CE2 3.8Å; F120-F250 HydrophobicContact CE1-CE2 3.8Å; F120-F250 AromaticContact CE1-CZ 3.73Å; F120-F250 HydrophobicContact CE1-CZ 3.73Å; F120-F250 AromaticContact CZ-CE2 3.86Å; F120-F250 HydrophobicContact CZ-CE2 3.86Å; F120-F250 HydrophobicContact CZ-CZ 4.14Å
121	T	51.6	Low	55.8	Low	28 Å²	28	35.7 Å²	35.7	17%	0.172	21%	0.206	C	C	.	.	H	α-helix	trans	-61.9	-40.3	-178	-56.8	0	0	0	0	111.3	L117 I119 Y124 V125 F196	L117-T121 WeakPolarHBondContact O-CB 3.45Å; L117-T121 PolarHBondContact O-N 3.3Å; L117-T121 PolarHBondContact O-OG1 2.94Å; I119-T121 PolarHBondContact O-N 2.85Å; T121-Y124 PolarHBondContact O-N 3.37Å; T121-V125 HydrophobicContact CG2-CG2 4.26Å; T121-V125 WeakPolarHBondContact O-CB 3.47Å; T121-V125 VanDerWaalsContact O-CG2 3.24Å; T121-V125 WeakPolarHBondContact O-CG2 3.34Å; T121-V125 PolarHBondContact O-N 3.03Å; T121-F196 HydrophobicContact CG2-CD1 4.2Å
122	T	55.1	Low	56.5	Low	56 Å²	56	35.8 Å²	35.8	34%	0.344	20%	0.199	S	C	.	.	H	α-helix	trans	-63.8	-49.9	179.2	-56	0	0	0	0	111.6	S118 I119 F120 Y124 Q126	S118-T122 WeakPolarHBondContact O-CB 3.48Å; S118-T122 PolarHBondContact O-N 3.48Å; S118-T122 PolarHBondContact O-OG1 3.48Å; I119-T122 PolarHBondContact O-N 3.04Å; I119-T122 VanDerWaalsContact O-N 3.16Å; F120-T122 VanDerWaalsContact C-N 3.32Å; F120-T122 PolarHBondContact O-N 3.3Å; T122-Y124 VanDerWaalsContact C-N 3.34Å; T122-Y124 PolarHBondContact O-N 3.35Å; T122-Q126 WeakPolarHBondContact O-CB 3.17Å; T122-Q126 PolarHBondContact O-N 3Å; T122-Q126 VanDerWaalsContact O-N 3.11Å
123	F	61.6	Low	57.1	Low	20 Å²	20	30.8 Å²	30.8	9%	0.088	18%	0.178	C	C	.	.	H	α-helix	trans	-68.7	-30.5	177.7	-82.3	-81.5	0	0	0	113.2	I85 V89 F93 Y110 L113 I119 F120 N127	I85-F123 HydrophobicContact CD1-CE2 4.37Å; I85-F123 HydrophobicContact CD1-CZ 3.92Å; I85-F123 HydrophobicContact CG2-CZ 4.21Å; V89-F123 HydrophobicContact CG1-CZ 4.23Å; F93-F123 HydrophobicContact CD2-CE1 4.31Å; F93-F123 HydrophobicContact CE1-CD1 4.39Å; F93-F123 HydrophobicContact CE1-CE1 4.44Å; F93-F123 AromaticContact CE2-CD1 3.98Å; F93-F123 HydrophobicContact CE2-CD1 3.98Å; F93-F123 AromaticContact CE2-CE1 3.59Å; F93-F123 HydrophobicContact CE2-CE1 3.59Å; F93-F123 AromaticContact CZ-CD1 3.63Å; F93-F123 HydrophobicContact CZ-CD1 3.63Å; F93-F123 AromaticContact CZ-CE1 3.69Å; F93-F123 HydrophobicContact CZ-CE1 3.69Å; Y110-F123 HydrophobicContact CE1-CB 4.36Å; Y110-F123 PolarHBondContact OH-O 3.27Å; L113-F123 HydrophobicContact CD1-CB 3.77Å; L113-F123 HydrophobicContact CD1-CD2 3.96Å; L113-F123 HydrophobicContact CD1-CG 3.88Å; I119-F123 HydrophobicContact CG2-CD2 3.66Å; I119-F123 HydrophobicContact CG2-CE2 3.74Å; I119-F123 WeakPolarHBondContact O-CD2 3.29Å; I119-F123 PolarHBondContact O-N 2.87Å; F120-F123 PolarHBondContact O-N 3.19Å; F123-N127 WeakPolarHBondContact O-CB 3.06Å; F123-N127 VanDerWaalsContact O-CG 3.3Å; F123-N127 PolarHBondContact O-N 3.33Å; F123-N127 VanDerWaalsContact O-N 3.12Å; F123-N127 PolarHBondContact O-ND2 3.18Å
124	Y	64.1	Low	57.8	Low	31 Å²	31	29.3 Å²	29.3	12%	0.122	17%	0.17	C	C	.	.	H	α-helix	trans	-68.5	-51.3	175.5	-174.5	-94.3	0	0	0	111.2	Y110 F120 T121 T122 Q126 N127 E128 L129 V246 F250	Y110-Y124 HydrophobicContact CD2-CD2 4.38Å; Y110-Y124 HydrophobicContact CE1-CD2 4.35Å; Y110-Y124 HydrophobicContact CE2-CD2 4.12Å; F120-Y124 AromaticContact CE2-CD2 3.99Å; F120-Y124 HydrophobicContact CE2-CD2 3.99Å; F120-Y124 HydrophobicContact CE2-CG 4.33Å; F120-Y124 AromaticContact CZ-CD2 3.97Å; F120-Y124 HydrophobicContact CZ-CD2 3.97Å; F120-Y124 HydrophobicContact CZ-CG 4.14Å; F120-Y124 WeakPolarHBondContact O-CB 3.32Å; F120-Y124 PolarHBondContact O-N 3.39Å; T121-Y124 PolarHBondContact O-N 3.37Å; T122-Y124 VanDerWaalsContact C-N 3.34Å; T122-Y124 PolarHBondContact O-N 3.35Å; Y124-Q126 VanDerWaalsContact C-N 3.33Å; Y124-Q126 PolarHBondContact O-N 2.85Å; Y124-N127 PolarHBondContact O-N 3.29Å; Y124-E128 HydrophobicContact CD2-CB 4.03Å; Y124-E128 HydrophobicContact CD2-CG 3.79Å; Y124-E128 HydrophobicContact CE1-CB 4.42Å; Y124-E128 HydrophobicContact CE2-CB 3.88Å; Y124-E128 HydrophobicContact CE2-CG 3.79Å; Y124-E128 HydrophobicContact CG-CB 4.36Å; Y124-E128 HydrophobicContact CG-CG 4.5Å; Y124-E128 WeakPolarHBondContact O-CA 3.33Å; Y124-E128 WeakPolarHBondContact O-CB 3.49Å; Y124-E128 PolarHBondContact O-N 2.93Å; Y124-L129 HydrophobicContact CE1-CD2 4.35Å; Y124-L129 HydrophobicContact CE1-CG 4.44Å; Y124-L129 PolarHBondContact O-N 3.47Å; Y124-V246 HydrophobicContact CE1-CG1 4.38Å; Y124-V246 WeakPolarHBondContact OH-CG1 3.42Å; Y124-F250 HydrophobicContact CD1-CE1 4.27Å; Y124-F250 HydrophobicContact CD1-CE2 4.49Å; Y124-F250 HydrophobicContact CD1-CZ 4.21Å; Y124-F250 HydrophobicContact CE1-CD1 4.13Å; Y124-F250 HydrophobicContact CE1-CD2 4.12Å; Y124-F250 HydrophobicContact CE1-CE1 4.2Å; Y124-F250 HydrophobicContact CE1-CE2 4.23Å; Y124-F250 HydrophobicContact CE1-CG 4.08Å; Y124-F250 HydrophobicContact CE1-CZ 4.26Å
125	V	60.8	Low	58.8	Low	7 Å²	7	31.8 Å²	31.8	4%	0.042	19%	0.186	C	C	.	.	I	π-helix	trans	-57.8	-45.8	177.5	171.2	0	0	0	0	111	T121 L129 V130 V159 F196	T121-V125 HydrophobicContact CG2-CG2 4.26Å; T121-V125 WeakPolarHBondContact O-CB 3.47Å; T121-V125 VanDerWaalsContact O-CG2 3.24Å; T121-V125 WeakPolarHBondContact O-CG2 3.34Å; T121-V125 PolarHBondContact O-N 3.03Å; V125-L129 HydrophobicContact CB-CD1 4.44Å; V125-L129 HydrophobicContact CG1-CD1 4.46Å; V125-L129 HydrophobicContact CG2-CD1 4.09Å; V125-L129 WeakPolarHBondContact O-CB 3.34Å; V125-L129 PolarHBondContact O-N 3.07Å; V125-V130 PolarHBondContact O-N 2.99Å; V125-V159 HydrophobicContact CG1-CG2 4.07Å; V125-F196 HydrophobicContact CG2-CB 4.15Å
126	Q	67.3	Low	59.7	Low	13 Å²	13	34.5 Å²	34.5	6%	0.061	19%	0.186	C	C	.	.	I	π-helix	trans	-64.6	-45.3	-179.6	-179.8	164.7	-44.5	0	0	113.3	T122 Y124 G131 L150	T122-Q126 WeakPolarHBondContact O-CB 3.17Å; T122-Q126 PolarHBondContact O-N 3Å; T122-Q126 VanDerWaalsContact O-N 3.11Å; Y124-Q126 VanDerWaalsContact C-N 3.33Å; Y124-Q126 PolarHBondContact O-N 2.85Å; Q126-G131 PolarHBondContact O-N 2.89Å; Q126-L150 HydrophobicContact CG-CD2 3.99Å; Q126-L150 PolarHBondContact NE2-O 3.38Å
127	N	67.2	Low	61	Low	9 Å²	9	33 Å²	33	5%	0.048	18%	0.177	C	C	.	.	I	π-helix	trans	-91.4	-48.3	-172	-61.4	-16.5	0	0	0	112.9	F93 L99 Y110 F123 Y124 G131 K132	F93-N127 WeakPolarHBondContact CE1-ND2 3.34Å; F93-N127 WeakPolarHBondContact CZ-ND2 3.08Å; L99-N127 HydrophobicContact CD2-CB 4.37Å; Y110-N127 WeakPolarHBondContact OH-CB 3.43Å; F123-N127 WeakPolarHBondContact O-CB 3.06Å; F123-N127 VanDerWaalsContact O-CG 3.3Å; F123-N127 PolarHBondContact O-N 3.33Å; F123-N127 VanDerWaalsContact O-N 3.12Å; F123-N127 PolarHBondContact O-ND2 3.18Å; Y124-N127 PolarHBondContact O-N 3.29Å; N127-G131 WeakPolarHBondContact O-CA 3.44Å; N127-K132 PolarHBondContact O-N 2.96Å
128	E	67.2	Low	61.7	Low	23 Å²	23	30.3 Å²	30.3	11%	0.107	16%	0.164	C	C	.	.	I	π-helix	trans	-85.9	-31.4	-170.4	-67.7	-74.5	142.2	0	0	112.8	Y110 Y124 K132	Y110-E128 HydrophobicContact CE2-CG 3.61Å; Y110-E128 WeakPolarHBondContact OH-CG 3.38Å; Y124-E128 HydrophobicContact CD2-CB 4.03Å; Y124-E128 HydrophobicContact CD2-CG 3.79Å; Y124-E128 HydrophobicContact CE1-CB 4.42Å; Y124-E128 HydrophobicContact CE2-CB 3.88Å; Y124-E128 HydrophobicContact CE2-CG 3.79Å; Y124-E128 HydrophobicContact CG-CB 4.36Å; Y124-E128 HydrophobicContact CG-CG 4.5Å; Y124-E128 WeakPolarHBondContact O-CA 3.33Å; Y124-E128 WeakPolarHBondContact O-CB 3.49Å; Y124-E128 PolarHBondContact O-N 2.93Å; E128-K132 WeakPolarHBondContact O-CB 3.48Å; E128-K132 VanDerWaalsContact OE1-CE 3.23Å; E128-K132 WeakPolarHBondContact OE1-CE 3.49Å; E128-K132 IonicContact OE1-NZ 3.66Å; E128-K132 PolarHBondContact OE1-NZ 2.9Å; E128-K132 WeakPolarHBondContact OE2-CE 3.12Å; E128-K132 IonicContact OE2-NZ 3.71Å; E128-K132 PolarHBondContact OE2-NZ 3.27Å
129	L	65.2	Low	63.1	Low	12 Å²	12	27.7 Å²	27.7	6%	0.063	15%	0.146	C	C	.	.	I	π-helix	trans	-92	-69.5	174.1	-51	-179.4	0	0	0	110.5	Y124 V125 A133 V159 V246	Y124-L129 HydrophobicContact CE1-CD2 4.35Å; Y124-L129 HydrophobicContact CE1-CG 4.44Å; Y124-L129 PolarHBondContact O-N 3.47Å; V125-L129 HydrophobicContact CB-CD1 4.44Å; V125-L129 HydrophobicContact CG1-CD1 4.46Å; V125-L129 HydrophobicContact CG2-CD1 4.09Å; V125-L129 WeakPolarHBondContact O-CB 3.34Å; V125-L129 PolarHBondContact O-N 3.07Å; L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 3.47Å; L129-V159 HydrophobicContact CB-CG2 3.71Å; L129-V159 HydrophobicContact CD1-CB 4.46Å; L129-V159 HydrophobicContact CD1-CG2 3.95Å; L129-V246 HydrophobicContact CD2-CB 4.06Å; L129-V246 HydrophobicContact CD2-CG1 3.46Å; L129-V246 VanDerWaalsContact CD2-CG1 3.46Å
130	V	63.6	Low	64.4	Low	4 Å²	4	30.6 Å²	30.6	2%	0.024	16%	0.162	C	C	.	.	I	π-helix	trans	-67.7	-53.9	-172.7	177.8	0	0	0	0	111.6	V125 A133 I134 L150 A158 V159 L205	V125-V130 PolarHBondContact O-N 2.99Å; V130-A133 PolarHBondContact O-N 3.29Å; V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 WeakPolarHBondContact O-CD1 3.42Å; V130-I134 WeakPolarHBondContact O-CG1 3.02Å; V130-I134 PolarHBondContact O-N 2.99Å; V130-L150 HydrophobicContact CG1-CD1 4.13Å; V130-L150 HydrophobicContact CG1-CD2 4.44Å; V130-A158 WeakPolarHBondContact CG2-O 3.45Å; V130-V159 HydrophobicContact CG2-CG2 3.61Å; V130-L205 HydrophobicContact CG1-CB 4.06Å
131	G	67.2	Low	65.5	Low	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	I	π-helix	trans	-58.8	-52	-177.4	0	0	0	0	0	113.4	Q126 N127 A133 I134 C135	Q126-G131 PolarHBondContact O-N 2.89Å; N127-G131 WeakPolarHBondContact O-CA 3.44Å; G131-A133 PolarHBondContact O-N 2.99Å; G131-I134 PolarHBondContact O-N 3.03Å; G131-C135 PolarHBondContact O-N 3.22Å; G131-C135 PolarHBondContact O-SG 3.01Å
132	K	67.2	Low	66.4	Low	45 Å²	45	33.9 Å²	33.9	20%	0.196	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-34.5	176.6	-72.8	-175.3	-178.4	176.8	0	113.1	N127 E128 C135 K136 F242	N127-K132 PolarHBondContact O-N 2.96Å; E128-K132 WeakPolarHBondContact O-CB 3.48Å; E128-K132 VanDerWaalsContact OE1-CE 3.23Å; E128-K132 WeakPolarHBondContact OE1-CE 3.49Å; E128-K132 IonicContact OE1-NZ 3.66Å; E128-K132 PolarHBondContact OE1-NZ 2.9Å; E128-K132 WeakPolarHBondContact OE2-CE 3.12Å; E128-K132 IonicContact OE2-NZ 3.71Å; E128-K132 PolarHBondContact OE2-NZ 3.27Å; K132-C135 PolarHBondContact O-N 3.08Å; K132-K136 VanDerWaalsContact O-CB 3.29Å; K132-K136 WeakPolarHBondContact O-CB 3.48Å; K132-K136 PolarHBondContact O-N 3.16Å; K132-F242 HydrophobicContact CB-CE1 3.96Å; K132-F242 HydrophobicContact CB-CZ 4.05Å; K132-F242 HydrophobicContact CD-CZ 4.28Å
133	A	64.1	Low	67.3	Low	15 Å²	15	33.9 Å²	33.9	12%	0.124	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-46.4	174	0	0	0	0	0	111.6	L129 V130 G131 K136 F137 I243	L129-A133 WeakPolarHBondContact O-CB 3.46Å; L129-A133 PolarHBondContact O-N 3.47Å; V130-A133 PolarHBondContact O-N 3.29Å; G131-A133 PolarHBondContact O-N 2.99Å; A133-K136 PolarHBondContact O-N 2.86Å; A133-F137 HydrophobicContact CB-CD2 4.48Å; A133-F137 WeakPolarHBondContact O-CB 3.36Å; A133-F137 VanDerWaalsContact O-CD2 3.32Å; A133-F137 WeakPolarHBondContact O-CD2 3.05Å; A133-F137 PolarHBondContact O-N 3.25Å; A133-I243 HydrophobicContact CB-CD1 4.26Å
134	I	66.3	Low	67.9	Low	6 Å²	6	40.3 Å²	40.3	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-63.8	-43.9	176.2	-59.3	155.3	0	0	0	110.9	V130 G131 K136 G138 K143 L147 L150 L205	V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 WeakPolarHBondContact O-CD1 3.42Å; V130-I134 WeakPolarHBondContact O-CG1 3.02Å; V130-I134 PolarHBondContact O-N 2.99Å; G131-I134 PolarHBondContact O-N 3.03Å; I134-K136 VanDerWaalsContact C-N 3.31Å; I134-K136 PolarHBondContact O-N 3.21Å; I134-G138 WeakPolarHBondContact O-CA 3.34Å; I134-G138 PolarHBondContact O-N 3.42Å; I134-K143 HydrophobicContact CG2-CG 4.25Å; I134-K143 WeakPolarHBondContact O-CE 3.37Å; I134-L147 HydrophobicContact CB-CD2 3.68Å; I134-L147 HydrophobicContact CD1-CD2 4.31Å; I134-L147 HydrophobicContact CG2-CD2 3.47Å; I134-L147 VanDerWaalsContact CG2-CD2 3.47Å; I134-L147 HydrophobicContact CG2-CG 3.92Å; I134-L150 HydrophobicContact CD1-CD1 3.37Å; I134-L205 HydrophobicContact CD1-CD1 3.68Å; I134-L205 HydrophobicContact CD1-CD2 3.91Å; I134-L205 HydrophobicContact CD1-CG 4.28Å; I134-L205 HydrophobicContact CG1-CD1 4.02Å; I134-L205 HydrophobicContact CG1-CD2 3.55Å; I134-L205 HydrophobicContact CG1-CG 4.39Å
135	C	67.6	Low	68.4	Low	54 Å²	54	42.9 Å²	42.9	37%	0.365	20%	0.204	S	C	.	.	H	α-helix	trans	-59.3	-39	176.8	-73.3	0	0	0	0	112.9	G131 K132 K143 L147	G131-C135 PolarHBondContact O-N 3.22Å; G131-C135 PolarHBondContact O-SG 3.01Å; K132-C135 PolarHBondContact O-N 3.08Å; C135-K143 WeakPolarHBondContact O-CE 3.34Å; C135-L147 VanDerWaalsContact SG-CD1 3.59Å
136	K	62.9	Low	68.8	Low	122 Å²	122	42.8 Å²	42.8	53%	0.53	20%	0.203	S	C	.	.	H	α-helix	trans	-87.6	-36.4	-174.8	-171.7	174	167.9	-164.9	0	113.3	K132 A133 I134	K132-K136 VanDerWaalsContact O-CB 3.29Å; K132-K136 WeakPolarHBondContact O-CB 3.48Å; K132-K136 PolarHBondContact O-N 3.16Å; A133-K136 PolarHBondContact O-N 2.86Å; I134-K136 VanDerWaalsContact C-N 3.31Å; I134-K136 PolarHBondContact O-N 3.21Å
137	F	68.5	Low	68.9	Low	37 Å²	37	43.8 Å²	43.8	16%	0.162	21%	0.209	C	C	.	.	H	α-helix	trans	-122.3	-16	-168.9	-51.8	-71.7	0	0	0	114.9	A133 S235 D238 A239 F242	A133-F137 HydrophobicContact CB-CD2 4.48Å; A133-F137 WeakPolarHBondContact O-CB 3.36Å; A133-F137 VanDerWaalsContact O-CD2 3.32Å; A133-F137 WeakPolarHBondContact O-CD2 3.05Å; A133-F137 PolarHBondContact O-N 3.25Å; F137-S235 WeakPolarHBondContact CD1-O 3.47Å; F137-S235 WeakPolarHBondContact CE1-O 3.32Å; F137-D238 HydrophobicContact CE1-CB 3.61Å; F137-D238 HydrophobicContact CZ-CB 4.17Å; F137-D238 WeakPolarHBondContact CZ-O 3.47Å; F137-A239 HydrophobicContact CB-CB 4.18Å; F137-A239 HydrophobicContact CD1-CB 4.05Å; F137-A239 HydrophobicContact CD2-CB 3.35Å; F137-A239 HydrophobicContact CE1-CB 4.23Å; F137-A239 HydrophobicContact CE2-CB 3.61Å; F137-A239 HydrophobicContact CG-CB 3.58Å; F137-A239 VanDerWaalsContact CZ-CA 3.4Å; F137-A239 HydrophobicContact CZ-CB 4.01Å; F137-F242 HydrophobicContact CE2-CB 4.01Å; F137-F242 HydrophobicContact CE2-CD1 4.11Å; F137-F242 HydrophobicContact CE2-CG 4.26Å; F137-F242 HydrophobicContact CZ-CB 3.99Å
138	G	60.2	Low	69.1	Low	9 Å²	9	46.9 Å²	46.9	9%	0.093	23%	0.229	C	C	.	.	S	Bend	trans	-67.1	148.7	178.4	0	0	0	0	0	112.6	I134 Q142 K143	I134-G138 WeakPolarHBondContact O-CA 3.34Å; I134-G138 PolarHBondContact O-N 3.42Å; G138-Q142 VanDerWaalsContact CA-OE1 3.24Å; G138-K143 WeakPolarHBondContact O-CE 3.35Å; G138-K143 PolarHBondContact O-NZ 2.64Å
139	S	73.2	Confident	69.2	Low	27 Å²	27	48.9 Å²	48.9	19%	0.189	24%	0.24	C	C	.	.			trans	-63.9	160.6	166.8	70.8	0	0	0	0	110.7	E141 Q142 K143 D229	S139-E141 PolarHBondContact O-N 3.08Å; S139-E141 VanDerWaalsContact O-N 3.17Å; S139-Q142 PolarHBondContact O-N 2.93Å; S139-Q142 VanDerWaalsContact OG-CG 3.29Å; S139-Q142 WeakPolarHBondContact OG-CG 3.1Å; S139-Q142 PolarHBondContact OG-N 3.21Å; S139-Q142 PolarHBondContact OG-OE1 3.01Å; S139-K143 WeakPolarHBondContact O-CG 3.23Å; S139-K143 PolarHBondContact O-N 2.85Å; S139-D229 PolarHBondContact OG-O 2.78Å
140	D	77.3	Confident	69.2	Low	105 Å²	105	48.4 Å²	48.4	56%	0.561	24%	0.238	S	C	*	.	H	α-helix	trans	-60.1	-28.3	179.6	-72	-15.2	0	0	0	112.7	R144	D140-R144 WeakPolarHBondContact O-CB 3.2Å; D140-R144 WeakPolarHBondContact O-CG 3.49Å; D140-R144 PolarHBondContact O-N 2.86Å
141	E	76.5	Confident	69.3	Low	90 Å²	90	48.7 Å²	48.7	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-74.1	-44.9	175.9	-164.8	54.8	-152.9	0	0	112.1	S139 K143 R144 R145	S139-E141 PolarHBondContact O-N 3.08Å; S139-E141 VanDerWaalsContact O-N 3.17Å; E141-K143 VanDerWaalsContact C-N 3.27Å; E141-K143 PolarHBondContact O-N 2.79Å; E141-R144 PolarHBondContact O-N 2.83Å; E141-R144 IonicContact OE2-CZ 3.38Å; E141-R144 IonicContact OE2-NE 3.05Å; E141-R144 PolarHBondContact OE2-NE 3.18Å; E141-R144 IonicContact OE2-NH2 2.82Å; E141-R144 PolarHBondContact OE2-NH2 3.47Å; E141-R145 VanDerWaalsContact O-CB 3.25Å; E141-R145 WeakPolarHBondContact O-CB 3.34Å; E141-R145 PolarHBondContact O-N 3.08Å
142	Q	70.5	Confident	69.2	Low	27 Å²	27	49.7 Å²	49.7	13%	0.126	25%	0.248	C	C	.	.	H	α-helix	trans	-58.4	-40.8	171.6	-68.6	173.7	-31.6	0	0	111.5	G138 S139 R145 Y146 D229	G138-Q142 VanDerWaalsContact CA-OE1 3.24Å; S139-Q142 PolarHBondContact O-N 2.93Å; S139-Q142 VanDerWaalsContact OG-CG 3.29Å; S139-Q142 WeakPolarHBondContact OG-CG 3.1Å; S139-Q142 PolarHBondContact OG-N 3.21Å; S139-Q142 PolarHBondContact OG-OE1 3.01Å; Q142-R145 PolarHBondContact O-N 2.92Å; Q142-Y146 HydrophobicContact CB-CD2 3.99Å; Q142-Y146 HydrophobicContact CB-CE2 4.11Å; Q142-Y146 HydrophobicContact CG-CD2 4.47Å; Q142-Y146 HydrophobicContact CG-CE2 4.1Å; Q142-Y146 WeakPolarHBondContact O-CB 3.22Å; Q142-Y146 WeakPolarHBondContact O-CD2 3.44Å; Q142-Y146 PolarHBondContact O-N 2.92Å; Q142-D229 VanDerWaalsContact CD-O 3.29Å; Q142-D229 HydrophobicContact CG-CB 4.07Å; Q142-D229 PolarHBondContact NE2-O 2.59Å; Q142-D229 VanDerWaalsContact NE2-O 3.11Å
143	K	73.9	Confident	69	Low	56 Å²	56	49 Å²	49	24%	0.243	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-50.4	176	-74.3	161.6	170.2	150.7	0	111.8	I134 C135 G138 S139 E141 R145 L147	I134-K143 HydrophobicContact CG2-CG 4.25Å; I134-K143 WeakPolarHBondContact O-CE 3.37Å; C135-K143 WeakPolarHBondContact O-CE 3.34Å; G138-K143 WeakPolarHBondContact O-CE 3.35Å; G138-K143 PolarHBondContact O-NZ 2.64Å; S139-K143 WeakPolarHBondContact O-CG 3.23Å; S139-K143 PolarHBondContact O-N 2.85Å; E141-K143 VanDerWaalsContact C-N 3.27Å; E141-K143 PolarHBondContact O-N 2.79Å; K143-R145 VanDerWaalsContact C-N 3.28Å; K143-R145 PolarHBondContact O-N 3.43Å; K143-L147 HydrophobicContact CB-CD1 3.92Å; K143-L147 HydrophobicContact CB-CG 4.45Å; K143-L147 HydrophobicContact CG-CD1 4.03Å; K143-L147 VanDerWaalsContact O-CB 3.32Å; K143-L147 WeakPolarHBondContact O-CB 3.41Å; K143-L147 VanDerWaalsContact O-CG 3.31Å; K143-L147 WeakPolarHBondContact O-CG 3.05Å; K143-L147 PolarHBondContact O-N 3.12Å
144	R	74.8	Confident	69	Low	155 Å²	155	52.2 Å²	52.2	59%	0.585	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-37.1	176.8	-80.8	-173.7	-69.8	-94.9	0.6	112.6	D140 E141 P148	D140-R144 WeakPolarHBondContact O-CB 3.2Å; D140-R144 WeakPolarHBondContact O-CG 3.49Å; D140-R144 PolarHBondContact O-N 2.86Å; E141-R144 PolarHBondContact O-N 2.83Å; E141-R144 IonicContact OE2-CZ 3.38Å; E141-R144 IonicContact OE2-NE 3.05Å; E141-R144 PolarHBondContact OE2-NE 3.18Å; E141-R144 IonicContact OE2-NH2 2.82Å; E141-R144 PolarHBondContact OE2-NH2 3.47Å; R144-P148 VanDerWaalsContact O-CD 3.27Å; R144-P148 WeakPolarHBondContact O-CD 3.31Å; R144-P148 VanDerWaalsContact O-CG 3.31Å; R144-P148 WeakPolarHBondContact O-CG 3.33Å
145	R	75.2	Confident	68.8	Low	84 Å²	84	52.6 Å²	52.6	32%	0.317	28%	0.277	S	S	.	.	H	α-helix	trans	-80.2	-48.4	-176.2	-172.1	170.7	175.3	-168.6	-8.2	113.5	E141 Q142 K143 L149 R225	E141-R145 VanDerWaalsContact O-CB 3.25Å; E141-R145 WeakPolarHBondContact O-CB 3.34Å; E141-R145 PolarHBondContact O-N 3.08Å; Q142-R145 PolarHBondContact O-N 2.92Å; K143-R145 VanDerWaalsContact C-N 3.28Å; K143-R145 PolarHBondContact O-N 3.43Å; R145-L149 VanDerWaalsContact O-CD1 3.28Å; R145-L149 WeakPolarHBondContact O-CD1 3.29Å; R145-L149 WeakPolarHBondContact O-CG 3.45Å; R145-R225 PolarHBondContact NH1-O 3.07Å; R145-R225 PolarHBondContact NH2-O 2.94Å
146	Y	68.5	Low	68.3	Low	6 Å²	6	52.3 Å²	52.3	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-96	-34.2	-168.1	-57.6	-57.2	0	0	0	114.5	Q142 L149 L150 V203 L205 L226	Q142-Y146 HydrophobicContact CB-CD2 3.99Å; Q142-Y146 HydrophobicContact CB-CE2 4.11Å; Q142-Y146 HydrophobicContact CG-CD2 4.47Å; Q142-Y146 HydrophobicContact CG-CE2 4.1Å; Q142-Y146 WeakPolarHBondContact O-CB 3.22Å; Q142-Y146 WeakPolarHBondContact O-CD2 3.44Å; Q142-Y146 PolarHBondContact O-N 2.92Å; Y146-L149 PolarHBondContact O-N 3.01Å; Y146-L150 WeakPolarHBondContact O-CG 3.42Å; Y146-L150 PolarHBondContact O-N 2.84Å; Y146-V203 HydrophobicContact CD1-CG1 3.75Å; Y146-V203 HydrophobicContact CE1-CG1 3.96Å; Y146-L205 HydrophobicContact CD1-CD1 4.16Å; Y146-L205 HydrophobicContact CD2-CD1 3.48Å; Y146-L205 VanDerWaalsContact CD2-CD1 3.48Å; Y146-L205 HydrophobicContact CE2-CD1 3.91Å; Y146-L205 HydrophobicContact CG-CD1 3.63Å; Y146-L226 HydrophobicContact CE1-CD2 3.68Å; Y146-L226 HydrophobicContact CE1-CG 4.09Å; Y146-L226 WeakPolarHBondContact OH-CA 3.35Å; Y146-L226 WeakPolarHBondContact OH-CD2 3.22Å; Y146-L226 VanDerWaalsContact OH-CG 3.3Å; Y146-L226 WeakPolarHBondContact OH-CG 3.47Å; Y146-L226 PolarHBondContact OH-O 2.87Å
147	L	70.4	Confident	68	Low	33 Å²	33	46.5 Å²	46.5	17%	0.173	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-41.5	-177.4	-56.9	179.6	0	0	0	113	L99 I134 C135 K143 L149 L150 A151	L99-L147 HydrophobicContact CD1-CB 4.16Å; L99-L147 HydrophobicContact CD1-CD2 3.83Å; L99-L147 HydrophobicContact CD1-CG 4.48Å; I134-L147 HydrophobicContact CB-CD2 3.68Å; I134-L147 HydrophobicContact CD1-CD2 4.31Å; I134-L147 HydrophobicContact CG2-CD2 3.47Å; I134-L147 VanDerWaalsContact CG2-CD2 3.47Å; I134-L147 HydrophobicContact CG2-CG 3.92Å; C135-L147 VanDerWaalsContact SG-CD1 3.59Å; K143-L147 HydrophobicContact CB-CD1 3.92Å; K143-L147 HydrophobicContact CB-CG 4.45Å; K143-L147 HydrophobicContact CG-CD1 4.03Å; K143-L147 VanDerWaalsContact O-CB 3.32Å; K143-L147 WeakPolarHBondContact O-CB 3.41Å; K143-L147 VanDerWaalsContact O-CG 3.31Å; K143-L147 WeakPolarHBondContact O-CG 3.05Å; K143-L147 PolarHBondContact O-N 3.12Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L147-L149 PolarHBondContact O-N 3.38Å; L147-L150 PolarHBondContact O-N 3.42Å; L147-A151 VanDerWaalsContact O-CB 3.26Å; L147-A151 WeakPolarHBondContact O-CB 3.5Å; L147-A151 PolarHBondContact O-N 2.84Å
148	P	71.1	Confident	67.4	Low	74 Å²	74	45.2 Å²	45.2	48%	0.481	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-35.9	175.5	-23.3	36.3	0	0	0	113	R144 A151 S152	R144-P148 VanDerWaalsContact O-CD 3.27Å; R144-P148 WeakPolarHBondContact O-CD 3.31Å; R144-P148 VanDerWaalsContact O-CG 3.31Å; R144-P148 WeakPolarHBondContact O-CG 3.33Å; P148-A151 PolarHBondContact O-N 3.47Å; P148-S152 WeakPolarHBondContact O-CB 3.43Å; P148-S152 PolarHBondContact O-N 3.4Å; P148-S152 PolarHBondContact O-OG 3.03Å
149	L	69.9	Low	67.3	Low	65 Å²	65	45.3 Å²	45.3	34%	0.34	24%	0.244	S	C	.	.	H	α-helix	trans	-70.6	-39.8	179	-63.9	175.9	0	0	0	111.8	R145 Y146 L147 S152 G153 S154 I155	R145-L149 VanDerWaalsContact O-CD1 3.28Å; R145-L149 WeakPolarHBondContact O-CD1 3.29Å; R145-L149 WeakPolarHBondContact O-CG 3.45Å; Y146-L149 PolarHBondContact O-N 3.01Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L147-L149 PolarHBondContact O-N 3.38Å; L149-S152 WeakPolarHBondContact CA-OG 3.41Å; L149-S152 PolarHBondContact O-OG 3.11Å; L149-G153 PolarHBondContact O-N 2.73Å; L149-S154 PolarHBondContact O-N 3.5Å; L149-S154 VanDerWaalsContact O-N 3.07Å; L149-I155 HydrophobicContact CB-CD1 3.47Å; L149-I155 VanDerWaalsContact CB-CD1 3.47Å; L149-I155 HydrophobicContact CB-CG1 3.63Å; L149-I155 HydrophobicContact CB-CG2 4.25Å; L149-I155 HydrophobicContact CD1-CD1 4.24Å; L149-I155 HydrophobicContact CD1-CG2 4.5Å; L149-I155 PolarHBondContact O-N 3.46Å
150	L	63.9	Low	66.8	Low	2 Å²	2	45.9 Å²	45.9	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-43.7	172.7	-72.3	165	0	0	0	111.1	Q126 V130 I134 Y146 L147 S152 G153 I155	Q126-L150 HydrophobicContact CG-CD2 3.99Å; Q126-L150 PolarHBondContact NE2-O 3.38Å; V130-L150 HydrophobicContact CG1-CD1 4.13Å; V130-L150 HydrophobicContact CG1-CD2 4.44Å; I134-L150 HydrophobicContact CD1-CD1 3.37Å; Y146-L150 WeakPolarHBondContact O-CG 3.42Å; Y146-L150 PolarHBondContact O-N 2.84Å; L147-L150 PolarHBondContact O-N 3.42Å; L150-S152 VanDerWaalsContact C-N 3.3Å; L150-S152 PolarHBondContact O-N 2.93Å; L150-G153 PolarHBondContact O-N 2.88Å; L150-I155 HydrophobicContact CD2-CD1 4.1Å; L150-I155 HydrophobicContact CD2-CG1 3.91Å; L150-I155 HydrophobicContact CG-CD1 3.89Å; L150-I155 HydrophobicContact CG-CG1 4.01Å
151	A	66	Low	66	Low	11 Å²	11	41.3 Å²	41.3	9%	0.091	22%	0.223	C	C	.	.	H	α-helix	trans	-68.7	-26.9	178.8	0	0	0	0	0	113.1	L147 P148	L147-A151 VanDerWaalsContact O-CB 3.26Å; L147-A151 WeakPolarHBondContact O-CB 3.5Å; L147-A151 PolarHBondContact O-N 2.84Å; P148-A151 PolarHBondContact O-N 3.47Å
152	S	66.2	Low	65.1	Low	20 Å²	20	39.6 Å²	39.6	14%	0.14	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.1	173.3	67.6	0	0	0	0	114.1	P148 L149 L150 S154	P148-S152 WeakPolarHBondContact O-CB 3.43Å; P148-S152 PolarHBondContact O-N 3.4Å; P148-S152 PolarHBondContact O-OG 3.03Å; L149-S152 WeakPolarHBondContact CA-OG 3.41Å; L149-S152 PolarHBondContact O-OG 3.11Å; L150-S152 VanDerWaalsContact C-N 3.3Å; L150-S152 PolarHBondContact O-N 2.93Å; S152-S154 PolarHBondContact O-N 3.38Å; S152-S154 VanDerWaalsContact OG-CB 3.27Å; S152-S154 WeakPolarHBondContact OG-CB 3.41Å; S152-S154 PolarHBondContact OG-N 2.99Å; S152-S154 PolarHBondContact OG-OG 3.24Å
153	G	61.4	Low	64.8	Low	32 Å²	32	38.7 Å²	38.7	33%	0.33	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	15.1	-169.9	0	0	0	0	0	113.9	L149 L150 I155	L149-G153 PolarHBondContact O-N 2.73Å; L150-G153 PolarHBondContact O-N 2.88Å; G153-I155 PolarHBondContact O-N 3.19Å
154	S	64.2	Low	64.5	Low	82 Å²	82	41.7 Å²	41.7	57%	0.573	23%	0.229	S	C	*	.	S	Bend	trans	-72.4	-21.7	176.6	-60.3	0	0	0	0	112.4	L149 S152	L149-S154 PolarHBondContact O-N 3.5Å; L149-S154 VanDerWaalsContact O-N 3.07Å; S152-S154 PolarHBondContact O-N 3.38Å; S152-S154 VanDerWaalsContact OG-CB 3.27Å; S152-S154 WeakPolarHBondContact OG-CB 3.41Å; S152-S154 PolarHBondContact OG-N 2.99Å; S152-S154 PolarHBondContact OG-OG 3.24Å
155	I	62.1	Low	64.1	Low	13 Å²	13	37 Å²	37	7%	0.067	22%	0.224	C	C	.	.	S	Bend	trans	-132.3	156.9	170.9	65.4	177	0	0	0	108.9	L149 L150 G153 A202 V203	L149-I155 HydrophobicContact CB-CD1 3.47Å; L149-I155 VanDerWaalsContact CB-CD1 3.47Å; L149-I155 HydrophobicContact CB-CG1 3.63Å; L149-I155 HydrophobicContact CB-CG2 4.25Å; L149-I155 HydrophobicContact CD1-CD1 4.24Å; L149-I155 HydrophobicContact CD1-CG2 4.5Å; L149-I155 PolarHBondContact O-N 3.46Å; L150-I155 HydrophobicContact CD2-CD1 4.1Å; L150-I155 HydrophobicContact CD2-CG1 3.91Å; L150-I155 HydrophobicContact CG-CD1 3.89Å; L150-I155 HydrophobicContact CG-CG1 4.01Å; G153-I155 PolarHBondContact O-N 3.19Å; I155-A202 HydrophobicContact CG2-CB 4.22Å; I155-V203 HydrophobicContact CB-CB 4.06Å; I155-V203 HydrophobicContact CB-CG2 4.18Å; I155-V203 HydrophobicContact CD1-CB 3.62Å; I155-V203 HydrophobicContact CD1-CG1 3.62Å; I155-V203 HydrophobicContact CD1-CG2 3.85Å; I155-V203 HydrophobicContact CG1-CB 4.34Å; I155-V203 HydrophobicContact CG2-CB 4.2Å; I155-V203 HydrophobicContact CG2-CG2 3.74Å
156	T	57.6	Low	63.3	Low	48 Å²	48	33.4 Å²	33.4	29%	0.294	21%	0.211	S	C	.	.			trans	-119.1	126.6	179.3	-58	0	0	0	0	109.7	A197 A200	T156-A197 HydrophobicContact CG2-CB 4.31Å; T156-A200 HydrophobicContact CG2-CB 4.25Å
157	G	57.1	Low	62.9	Low	1 Å²	1	34.9 Å²	34.9	1%	0.01	23%	0.228	C	C	.	.			trans	-71.6	139	176.3	0	0	0	0	0	112.4
158	A	55.3	Low	62.3	Low	10 Å²	10	40.3 Å²	40.3	8%	0.083	25%	0.253	C	S	.	.			trans	-132.6	155.4	170.6	0	0	0	0	0	110	V130 A197	V130-A158 WeakPolarHBondContact CG2-O 3.45Å; A158-A197 HydrophobicContact CB-CB 4.36Å
159	V	58.6	Low	61.8	Low	11 Å²	11	40 Å²	40	7%	0.067	25%	0.247	C	C	.	.			trans	-125.5	129.2	180	175.8	0	0	0	0	109	V125 L129 V130 L161	V125-V159 HydrophobicContact CG1-CG2 4.07Å; L129-V159 HydrophobicContact CB-CG2 3.71Å; L129-V159 HydrophobicContact CD1-CB 4.46Å; L129-V159 HydrophobicContact CD1-CG2 3.95Å; V130-V159 HydrophobicContact CG2-CG2 3.61Å; V159-L161 HydrophobicContact CG1-CD1 3.42Å; V159-L161 VanDerWaalsContact CG1-CD1 3.42Å; V159-L161 HydrophobicContact CG1-CG 3.66Å
160	C	63	Low	61.2	Low	38 Å²	38	38.4 Å²	38.4	26%	0.257	24%	0.239	S	C	.	.			trans	-124.9	52.3	-163.3	-59	0	0	0	0	112.4	K192 L195 T207	C160-K192 HydrophobicContact CB-CG 4.26Å; C160-K192 WeakPolarHBondContact O-CD 3.27Å; C160-K192 WeakPolarHBondContact O-CE 3.45Å; C160-K192 WeakPolarHBondContact O-CG 3.26Å; C160-L195 HydrophobicContact CB-CD2 4.12Å; C160-L195 VanDerWaalsContact SG-CD2 3.55Å; C160-T207 CarbonylContact C-O 3.57Å
161	L	60.1	Low	60.9	Low	9 Å²	9	42 Å²	42	5%	0.047	27%	0.268	C	S	.	.			trans	-81.9	-52.4	-170.1	-66.7	159.2	0	0	0	113.6	V159 K192 T207 I208 I243 M247	V159-L161 HydrophobicContact CG1-CD1 3.42Å; V159-L161 VanDerWaalsContact CG1-CD1 3.42Å; V159-L161 HydrophobicContact CG1-CG 3.66Å; L161-K192 PolarHBondContact O-NZ 2.84Å; L161-T207 HydrophobicContact CD2-CG2 3.8Å; L161-I208 HydrophobicContact CD2-CD1 3.47Å; L161-I208 VanDerWaalsContact CD2-CD1 3.47Å; L161-I208 HydrophobicContact CD2-CG1 3.71Å; L161-I243 HydrophobicContact CD1-CG2 3.66Å; L161-M247 HydrophobicContact CD1-CE 4.22Å; L161-M247 HydrophobicContact CD1-SD 3.16Å; L161-M247 WeakPolarHBondContact CD1-SD 3.28Å
162	H	57.5	Low	60.9	Low	54 Å²	54	47.3 Å²	47.3	25%	0.25	29%	0.289	C	S	.	.			trans	-70.2	146.1	-165.3	-167.9	-72.9	0	0	0	112.8	G167 K192 T193 W194	H162-G167 PolarHBondContact NE2-O 2.98Å; H162-K192 CarbonylContact O-C 3.55Å; H162-K192 WeakPolarHBondContact O-CA 3.12Å; H162-T193 PolarHBondContact ND1-OG1 3.26Å; H162-T193 PolarHBondContact O-N 3.44Å; H162-W194 HydrophobicContact CB-CB 4.43Å; H162-W194 AromaticContact CE1-CD1 3.78Å; H162-W194 AromaticContact CG-CD1 3.82Å; H162-W194 AromaticContact ND1-CD1 3.49Å
163	E	63.9	Low	60.8	Low	8 Å²	8	47.3 Å²	47.3	4%	0.037	29%	0.289	C	S	.	.			trans	-136.4	149.5	168.4	-55	168.8	-163.3	0	0	107.9	A165 C166 T173 E174 T175 T191 K192	E163-A165 PolarHBondContact O-N 3.17Å; E163-A165 VanDerWaalsContact O-N 3.16Å; E163-C166 WeakPolarHBondContact O-CB 3.48Å; E163-C166 PolarHBondContact O-N 3.43Å; E163-T173 PolarHBondContact OE1-OG1 3.24Å; E163-E174 PolarHBondContact OE1-N 3Å; E163-E174 WeakPolarHBondContact OE2-CA 3.21Å; E163-E174 PolarHBondContact OE2-N 2.88Å; E163-T175 VanDerWaalsContact CD-OG1 3.27Å; E163-T175 WeakPolarHBondContact OE1-CB 3.22Å; E163-T175 PolarHBondContact OE1-N 2.82Å; E163-T175 VanDerWaalsContact OE1-N 3.08Å; E163-T175 PolarHBondContact OE1-OG1 3.34Å; E163-T175 PolarHBondContact OE2-N 3.43Å; E163-T191 WeakPolarHBondContact CG-O 3.41Å; E163-K192 HydrophobicContact CG-CD 3.67Å; E163-K192 IonicContact OE1-NZ 2.73Å; E163-K192 PolarHBondContact OE1-NZ 2.73Å
164	D	67.9	Low	61.1	Low	119 Å²	119	52 Å²	52	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.7	-177.8	-64.6	-14.4	0	0	0	112.6	T193	D164-T193 VanDerWaalsContact OD1-CB 3.28Å; D164-T193 WeakPolarHBondContact OD1-CB 3.38Å; D164-T193 WeakPolarHBondContact OD1-CG2 3.18Å; D164-T193 PolarHBondContact OD1-OG1 3.4Å
165	A	65.5	Low	61	Low	58 Å²	58	48.5 Å²	48.5	48%	0.479	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-26.1	174.2	0	0	0	0	0	114	E163 E174	E163-A165 PolarHBondContact O-N 3.17Å; E163-A165 VanDerWaalsContact O-N 3.16Å; A165-E174 HydrophobicContact CB-CG 4.18Å
166	C	59.3	Low	60.9	Low	7 Å²	7	54 Å²	54	5%	0.047	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-33.2	-177.8	-58.7	0	0	0	0	113	E163 E168 D169 K172 T173	E163-C166 WeakPolarHBondContact O-CB 3.48Å; E163-C166 PolarHBondContact O-N 3.43Å; C166-E168 PolarHBondContact O-N 2.57Å; C166-D169 WeakPolarHBondContact CB-O 3.47Å; C166-D169 PolarHBondContact O-N 3.46Å; C166-D169 VanDerWaalsContact O-N 3.15Å; C166-K172 VanDerWaalsContact SG-C 3.51Å; C166-K172 PolarHBondContact SG-O 2.88Å; C166-T173 VanDerWaalsContact SG-CA 3.5Å
167	G	60.7	Low	60.9	Low	37 Å²	37	52.3 Å²	52.3	38%	0.381	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-131.6	-164.9	0	0	0	0	0	111	H162 D169	H162-G167 PolarHBondContact NE2-O 2.98Å; G167-D169 VanDerWaalsContact C-N 3.25Å; G167-D169 PolarHBondContact O-N 3.11Å
168	E	56.3	Low	60.8	Low	147 Å²	147	56 Å²	56	69%	0.687	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-8	178.5	-55.8	-166.7	178.8	0	0	114.4	C166 R255	C166-E168 PolarHBondContact O-N 2.57Å; E168-R255 IonicContact OE1-CZ 2.72Å; E168-R255 IonicContact OE1-NH1 3.29Å; E168-R255 PolarHBondContact OE1-NH1 3.34Å; E168-R255 IonicContact OE2-CZ 2.61Å; E168-R255 IonicContact OE2-NH1 3.51Å; E168-R255 PolarHBondContact OE2-NH1 3.09Å; E168-R255 IonicContact OE2-NH2 2.7Å; E168-R255 PolarHBondContact OE2-NH2 2.75Å
169	D	61.3	Low	60.8	Low	68 Å²	68	58.9 Å²	58.9	36%	0.364	33%	0.33	S	S	.	.			trans	-111.8	86.2	-172	-174.5	-2.9	0	0	0	110.9	C166 G167 A171 K172	C166-D169 WeakPolarHBondContact CB-O 3.47Å; C166-D169 PolarHBondContact O-N 3.46Å; C166-D169 VanDerWaalsContact O-N 3.15Å; G167-D169 VanDerWaalsContact C-N 3.25Å; G167-D169 PolarHBondContact O-N 3.11Å; D169-A171 PolarHBondContact O-N 2.9Å; D169-A171 VanDerWaalsContact O-N 3.09Å; D169-A171 WeakPolarHBondContact OD1-CB 3.22Å; D169-A171 PolarHBondContact OD1-N 3.1Å; D169-K172 HydrophobicContact CB-CD 4.36Å; D169-K172 HydrophobicContact CB-CG 4.3Å; D169-K172 WeakPolarHBondContact O-CB 3.49Å; D169-K172 PolarHBondContact O-N 2.91Å; D169-K172 WeakPolarHBondContact OD2-CE 3.14Å; D169-K172 IonicContact OD2-NZ 3.78Å; D169-K172 PolarHBondContact OD2-NZ 3.26Å
170	I	57.4	Low	60.7	Low	32 Å²	32	60.7 Å²	60.7	16%	0.164	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.2	-14.4	-175.8	70.3	171.4	0	0	0	113.8	K172 T173 E244	I170-K172 PolarHBondContact O-N 3.11Å; I170-T173 PolarHBondContact O-N 3.39Å; I170-E244 HydrophobicContact CD1-CG 3.7Å; I170-E244 HydrophobicContact CG1-CG 4.38Å
171	A	58.2	Low	60.3	Low	76 Å²	76	67.7 Å²	67.7	63%	0.628	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-68.2	-16.5	172.3	0	0	0	0	0	112.4	D169 T173	D169-A171 PolarHBondContact O-N 2.9Å; D169-A171 VanDerWaalsContact O-N 3.09Å; D169-A171 WeakPolarHBondContact OD1-CB 3.22Å; D169-A171 PolarHBondContact OD1-N 3.1Å; A171-T173 PolarHBondContact O-N 2.75Å
172	K	64.5	Low	60	Low	123 Å²	123	75.6 Å²	75.6	54%	0.535	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-86.2	27.6	172.3	-59.6	-172.2	178	97.4	0	113.7	C166 D169 I170 E174	C166-K172 VanDerWaalsContact SG-C 3.51Å; C166-K172 PolarHBondContact SG-O 2.88Å; D169-K172 HydrophobicContact CB-CD 4.36Å; D169-K172 HydrophobicContact CB-CG 4.3Å; D169-K172 WeakPolarHBondContact O-CB 3.49Å; D169-K172 PolarHBondContact O-N 2.91Å; D169-K172 WeakPolarHBondContact OD2-CE 3.14Å; D169-K172 IonicContact OD2-NZ 3.78Å; D169-K172 PolarHBondContact OD2-NZ 3.26Å; I170-K172 PolarHBondContact O-N 3.11Å; K172-E174 PolarHBondContact O-N 2.86Å
173	T	65.9	Low	59.7	Low	21 Å²	21	75.3 Å²	75.3	13%	0.129	41%	0.411	C	S	.	.			trans	-58.3	119	173.8	-174.6	0	0	0	0	110.9	E163 C166 I170 A171 K192 I208 M209	E163-T173 PolarHBondContact OE1-OG1 3.24Å; C166-T173 VanDerWaalsContact SG-CA 3.5Å; I170-T173 PolarHBondContact O-N 3.39Å; A171-T173 PolarHBondContact O-N 2.75Å; T173-K192 PolarHBondContact OG1-NZ 3.37Å; T173-I208 HydrophobicContact CG2-CD1 4.33Å; T173-I208 HydrophobicContact CG2-CG2 3.71Å; T173-M209 HydrophobicContact CG2-CE 4.32Å
174	E	67.1	Low	59.3	Low	131 Å²	131	81.7 Å²	81.7	61%	0.612	45%	0.445	S	S	*	.			trans	-93.3	-14.7	179.4	-61.8	-164.6	151.8	0	0	112.5	E163 A165 K172 K176	E163-E174 PolarHBondContact OE1-N 3Å; E163-E174 WeakPolarHBondContact OE2-CA 3.21Å; E163-E174 PolarHBondContact OE2-N 2.88Å; A165-E174 HydrophobicContact CB-CG 4.18Å; K172-E174 PolarHBondContact O-N 2.86Å; E174-K176 WeakPolarHBondContact O-CG 3.13Å; E174-K176 PolarHBondContact O-N 3.28Å
175	T	61.7	Low	58.2	Low	7 Å²	7	79.5 Å²	79.5	4%	0.043	43%	0.428	C	S	.	.			trans	-52.4	122.4	168.7	-61.5	0	0	0	0	109.2	E163 L188 S189 K192 M209	E163-T175 VanDerWaalsContact CD-OG1 3.27Å; E163-T175 WeakPolarHBondContact OE1-CB 3.22Å; E163-T175 PolarHBondContact OE1-N 2.82Å; E163-T175 VanDerWaalsContact OE1-N 3.08Å; E163-T175 PolarHBondContact OE1-OG1 3.34Å; E163-T175 PolarHBondContact OE2-N 3.43Å; T175-L188 HydrophobicContact CG2-CD2 4.18Å; T175-S189 CarbonylContact C-O 3.55Å; T175-S189 VanDerWaalsContact CA-O 3.3Å; T175-S189 WeakPolarHBondContact CA-O 3.35Å; T175-K192 WeakPolarHBondContact OG1-CE 3.29Å; T175-M209 WeakPolarHBondContact O-CE 3.24Å; T175-M209 WeakPolarHBondContact O-CG 3.22Å
176	K	60.1	Low	57.4	Low	129 Å²	129	76.8 Å²	76.8	56%	0.561	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	143	-179.5	-76.1	165.3	-169.4	174.1	0	111.4	E174 V178 L188 S189	E174-K176 WeakPolarHBondContact O-CG 3.13Å; E174-K176 PolarHBondContact O-N 3.28Å; K176-V178 HydrophobicContact CB-CG2 4.23Å; K176-L188 WeakPolarHBondContact O-CA 3.47Å; K176-S189 PolarHBondContact N-O 2.61Å; K176-S189 PolarHBondContact O-N 3.1Å
177	A	56.8	Low	57.1	Low	13 Å²	13	80.6 Å²	80.6	11%	0.107	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.2	159	0	0	0	0	0	109.6	A186 F187 M209 F212	A177-A186 HydrophobicContact CB-CB 4.24Å; A177-F187 WeakPolarHBondContact CA-O 3.47Å; A177-M209 HydrophobicContact CB-CB 4.07Å; A177-M209 WeakPolarHBondContact CB-O 3.1Å; A177-F212 HydrophobicContact CB-CB 3.82Å; A177-F212 HydrophobicContact CB-CD2 4.17Å
178	V	55.1	Low	56.8	Low	79 Å²	79	82.4 Å²	82.4	48%	0.479	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	97.5	-176.6	-177.1	0	0	0	0	110.1	K176 A186 F187	K176-V178 HydrophobicContact CB-CG2 4.23Å; V178-A186 CarbonylContact O-C 3.25Å; V178-A186 WeakPolarHBondContact O-CA 3.19Å; V178-A186 WeakPolarHBondContact O-CB 3.21Å; V178-F187 PolarHBondContact N-O 3.32Å; V178-F187 PolarHBondContact O-N 2.78Å
179	V	55.5	Low	57	Low	69 Å²	69	79.3 Å²	79.3	42%	0.418	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	137.8	174.2	-158.2	0	0	0	0	109.1	A186 F212	V179-A186 VanDerWaalsContact CA-CB 3.4Å; V179-A186 HydrophobicContact CB-CB 4.2Å; V179-A186 HydrophobicContact CG2-CB 4.09Å; V179-F212 HydrophobicContact CG2-CB 3.39Å; V179-F212 HydrophobicContact CG2-CD1 3.21Å; V179-F212 HydrophobicContact CG2-CE1 4.13Å; V179-F212 HydrophobicContact CG2-CG 3.5Å
180	T	56.2	Low	57	Low	49 Å²	49	78.5 Å²	78.5	30%	0.301	42%	0.424	S	S	.	.			trans	-96.6	130.9	163.2	54.3	0	0	0	0	109.4	H182 S183 R185 F187	T180-H182 PolarHBondContact O-N 3.07Å; T180-S183 PolarHBondContact O-N 3.04Å; T180-S183 VanDerWaalsContact O-O 3.1Å; T180-S183 PolarHBondContact OG1-OG 3.02Å; T180-R185 PolarHBondContact N-O 3.47Å; T180-R185 PolarHBondContact OG1-O 2.72Å; T180-F187 HydrophobicContact CG2-CD2 3.96Å; T180-F187 HydrophobicContact CG2-CE2 3.68Å
181	E	55.9	Low	57.1	Low	185 Å²	185	82.3 Å²	82.3	86%	0.864	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-1.7	-174.6	-61	-174	154.2	0	0	115
182	H	53.4	Low	57.3	Low	176 Å²	176	80.7 Å²	80.7	82%	0.815	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	8.8	-172.1	-58	-23.6	0	0	0	113.8	T180	T180-H182 PolarHBondContact O-N 3.07Å
183	S	51.7	Low	56.8	Low	48 Å²	48	76.1 Å²	76.1	34%	0.336	41%	0.41	S	S	.	.	S	Bend	trans	-153.4	155.7	170.2	45.3	0	0	0	0	111.7	T180 R185	T180-S183 PolarHBondContact O-N 3.04Å; T180-S183 VanDerWaalsContact O-O 3.1Å; T180-S183 PolarHBondContact OG1-OG 3.02Å; S183-R185 PolarHBondContact O-N 3.26Å; S183-R185 WeakPolarHBondContact OG-CB 3.46Å
184	D	55	Low	56	Low	141 Å²	141	83.9 Å²	83.9	75%	0.754	44%	0.437	S	S	*	.	S	Bend	trans	-70.5	53.3	171.9	-53.9	-43.4	0	0	0	110.4	G213	D184-G213 CarbonylContact C-O 3.53Å
185	R	45	Very low	55.1	Low	74 Å²	74	82.4 Å²	82.4	28%	0.279	43%	0.433	S	S	.	.			trans	-152.8	102.3	-158.9	-73.6	179.1	-177.3	-131.7	2.6	111	T180 S183 G213 A214 S215 E224	T180-R185 PolarHBondContact N-O 3.47Å; T180-R185 PolarHBondContact OG1-O 2.72Å; S183-R185 PolarHBondContact O-N 3.26Å; S183-R185 WeakPolarHBondContact OG-CB 3.46Å; R185-G213 CarbonylContact C-O 3.44Å; R185-G213 WeakPolarHBondContact CA-O 3.09Å; R185-G213 PolarHBondContact N-O 2.65Å; R185-A214 VanDerWaalsContact CA-CA 3.45Å; R185-A214 HydrophobicContact CB-CB 3.38Å; R185-A214 HydrophobicContact CG-CB 3.92Å; R185-S215 VanDerWaalsContact CD-OG 3.28Å; R185-S215 WeakPolarHBondContact CD-OG 3.44Å; R185-S215 PolarHBondContact NH1-OG 2.9Å; R185-E224 IonicContact CZ-OE1 3.42Å; R185-E224 IonicContact CZ-OE2 3.44Å; R185-E224 VanDerWaalsContact NH1-CD 3.27Å; R185-E224 IonicContact NH1-OE1 3.26Å; R185-E224 PolarHBondContact NH1-OE1 3.26Å; R185-E224 IonicContact NH1-OE2 3.86Å; R185-E224 PolarHBondContact NH1-OE2 2.91Å; R185-E224 IonicContact NH2-OE1 2.72Å; R185-E224 IonicContact NH2-OE2 3.15Å; R185-E224 PolarHBondContact NH2-OE2 3.04Å
186	A	48.7	Very low	54	Low	0 Å²	0	86.7 Å²	86.7	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.6	151.5	0	0	0	0	0	120.4	A177 V178 V179 F212 G213 A214	A177-A186 HydrophobicContact CB-CB 4.24Å; V178-A186 CarbonylContact O-C 3.25Å; V178-A186 WeakPolarHBondContact O-CA 3.19Å; V178-A186 WeakPolarHBondContact O-CB 3.21Å; V179-A186 VanDerWaalsContact CA-CB 3.4Å; V179-A186 HydrophobicContact CB-CB 4.2Å; V179-A186 HydrophobicContact CG2-CB 4.09Å; A186-F212 HydrophobicContact CB-CB 3.45Å; A186-F212 VanDerWaalsContact CB-CB 3.45Å; A186-F212 WeakPolarHBondContact CB-O 3.2Å; A186-F212 PolarHBondContact N-O 2.92Å; A186-G213 PolarHBondContact N-O 2.89Å; A186-G213 CarbonylContact O-C 3.57Å; A186-A214 VanDerWaalsContact O-CA 3.28Å; A186-A214 WeakPolarHBondContact O-CA 3.25Å; A186-A214 WeakPolarHBondContact O-CB 3.46Å; A186-A214 PolarHBondContact O-N 3.26Å
187	F	52.2	Low	52.9	Low	87 Å²	87	82.2 Å²	82.2	38%	0.382	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	137	-179.8	-62.4	-95.8	0	0	0	112.2	A177 V178 T180 A214 S215	A177-F187 WeakPolarHBondContact CA-O 3.47Å; V178-F187 PolarHBondContact N-O 3.32Å; V178-F187 PolarHBondContact O-N 2.78Å; T180-F187 HydrophobicContact CG2-CD2 3.96Å; T180-F187 HydrophobicContact CG2-CE2 3.68Å; F187-A214 HydrophobicContact CD2-CB 4.39Å; F187-A214 HydrophobicContact CG-CB 4.42Å; F187-S215 WeakPolarHBondContact CD1-O 3.43Å; F187-S215 WeakPolarHBondContact CE1-O 3.03Å
188	L	55.5	Low	51.6	Low	76 Å²	76	93.3 Å²	93.3	40%	0.398	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.3	167	-75.4	175.1	0	0	0	110.4	T175 K176 M209 E210	T175-L188 HydrophobicContact CG2-CD2 4.18Å; K176-L188 WeakPolarHBondContact O-CA 3.47Å; L188-M209 HydrophobicContact CD2-CB 4.38Å; L188-M209 WeakPolarHBondContact CD2-O 3.44Å; L188-E210 WeakPolarHBondContact CD1-OE1 3.23Å
189	S	58.8	Low	50.4	Low	81 Å²	81	99.5 Å²	99.5	57%	0.566	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	110.5	174.3	-175.3	0	0	0	0	110.2	T175 K176	T175-S189 CarbonylContact C-O 3.55Å; T175-S189 VanDerWaalsContact CA-O 3.3Å; T175-S189 WeakPolarHBondContact CA-O 3.35Å; K176-S189 PolarHBondContact N-O 2.61Å; K176-S189 PolarHBondContact O-N 3.1Å
190	G	61.5	Low	49.2	Very low	52 Å²	52	97.6 Å²	97.6	54%	0.536	48%	0.483	S	S	.	.			trans	166.3	171.7	-178.6	0	0	0	0	0	112.5
191	T	60.9	Low	47.8	Very low	111 Å²	111	102.8 Å²	102.8	68%	0.681	51%	0.508	S	S	*	.			trans	-122.4	107.5	-178.6	-58.1	0	0	0	0	110.1	E163	E163-T191 WeakPolarHBondContact CG-O 3.41Å
192	K	61.7	Low	46.4	Very low	43 Å²	43	95.8 Å²	95.8	19%	0.187	48%	0.482	C	S	.	.			trans	-83.1	139.3	173.8	-62.4	-55.2	-167.1	176.5	0	111.4	C160 L161 H162 E163 T173 T175 L195	C160-K192 HydrophobicContact CB-CG 4.26Å; C160-K192 WeakPolarHBondContact O-CD 3.27Å; C160-K192 WeakPolarHBondContact O-CE 3.45Å; C160-K192 WeakPolarHBondContact O-CG 3.26Å; L161-K192 PolarHBondContact O-NZ 2.84Å; H162-K192 CarbonylContact O-C 3.55Å; H162-K192 WeakPolarHBondContact O-CA 3.12Å; E163-K192 HydrophobicContact CG-CD 3.67Å; E163-K192 IonicContact OE1-NZ 2.73Å; E163-K192 PolarHBondContact OE1-NZ 2.73Å; T173-K192 PolarHBondContact OG1-NZ 3.37Å; T175-K192 WeakPolarHBondContact OG1-CE 3.29Å; K192-L195 HydrophobicContact CB-CD2 4.43Å
193	T	54.6	Low	45.4	Very low	27 Å²	27	88.2 Å²	88.2	17%	0.166	45%	0.447	C	S	.	.			trans	-118.7	169.7	174.1	58.7	0	0	0	0	111.3	H162 D164 L195	H162-T193 PolarHBondContact ND1-OG1 3.26Å; H162-T193 PolarHBondContact O-N 3.44Å; D164-T193 VanDerWaalsContact OD1-CB 3.28Å; D164-T193 WeakPolarHBondContact OD1-CB 3.38Å; D164-T193 WeakPolarHBondContact OD1-CG2 3.18Å; D164-T193 PolarHBondContact OD1-OG1 3.4Å; T193-L195 PolarHBondContact O-N 3.18Å
194	W	49.7	Very low	44.4	Very low	184 Å²	184	87.5 Å²	87.5	70%	0.697	45%	0.448	S	S	*	.			trans	55.5	46.7	-177.8	-58.1	93.9	0	0	0	115.3	H162 F196	H162-W194 HydrophobicContact CB-CB 4.43Å; H162-W194 AromaticContact CE1-CD1 3.78Å; H162-W194 AromaticContact CG-CD1 3.82Å; H162-W194 AromaticContact ND1-CD1 3.49Å; W194-F196 VanDerWaalsContact O-CD2 3.23Å; W194-F196 WeakPolarHBondContact O-CD2 3.16Å; W194-F196 WeakPolarHBondContact O-CE2 3.26Å; W194-F196 PolarHBondContact O-N 2.91Å; W194-F196 VanDerWaalsContact O-N 3.07Å
195	L	47.4	Very low	43.3	Very low	100 Å²	100	82.1 Å²	82.1	52%	0.524	42%	0.419	S	S	.	.			trans	-64.4	105.7	173.3	-62	176	0	0	0	111.7	C160 K192 T193	C160-L195 HydrophobicContact CB-CD2 4.12Å; C160-L195 VanDerWaalsContact SG-CD2 3.55Å; K192-L195 HydrophobicContact CB-CD2 4.43Å; T193-L195 PolarHBondContact O-N 3.18Å
196	F	38.4	Very low	42.9	Very low	96 Å²	96	81.8 Å²	81.8	42%	0.421	43%	0.425	S	S	.	.	S	Bend	trans	-75.9	137.1	166	-60.8	-83	0	0	0	109.4	T121 V125 W194	T121-F196 HydrophobicContact CG2-CD1 4.2Å; V125-F196 HydrophobicContact CG2-CB 4.15Å; W194-F196 VanDerWaalsContact O-CD2 3.23Å; W194-F196 WeakPolarHBondContact O-CD2 3.16Å; W194-F196 WeakPolarHBondContact O-CE2 3.26Å; W194-F196 PolarHBondContact O-N 2.91Å; W194-F196 VanDerWaalsContact O-N 3.07Å
197	A	37.6	Very low	42.3	Very low	35 Å²	35	82.5 Å²	82.5	29%	0.289	43%	0.429	S	S	.	.	S	Bend	trans	73.2	75.2	-165.9	0	0	0	0	0	115.3	T156 A158 R199	T156-A197 HydrophobicContact CG2-CB 4.31Å; A158-A197 HydrophobicContact CB-CB 4.36Å; A197-R199 PolarHBondContact O-N 3.07Å
198	R	29.8	Very low	41.4	Very low	246 Å²	246	79.5 Å²	79.5	93%	0.928	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	13.9	-171.2	-150.1	-177.2	-178.1	-148.5	-0.1	117.4
199	R	28.8	Very low	40.3	Very low	210 Å²	210	78.8 Å²	78.8	79%	0.792	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.3	17.7	-179.2	-137.4	173.2	-179.3	159.3	0.7	116.7	A197 I201	A197-R199 PolarHBondContact O-N 3.07Å; R199-I201 VanDerWaalsContact C-N 3.26Å; R199-I201 PolarHBondContact O-N 2.94Å
200	A	29.8	Very low	39.1	Very low	28 Å²	28	76 Å²	76	23%	0.231	39%	0.39	C	S	.	.			trans	-76.1	69.4	-180	0	0	0	0	0	112.7	T156 A202	T156-A200 HydrophobicContact CG2-CB 4.25Å; A200-A202 PolarHBondContact O-N 2.88Å
201	I	26.5	Very low	37.7	Very low	159 Å²	159	76.6 Å²	76.6	82%	0.815	38%	0.38	S	S	*	.			trans	-81	67.2	170.1	-51.6	176.8	0	0	0	108.6	R199	R199-I201 VanDerWaalsContact C-N 3.26Å; R199-I201 PolarHBondContact O-N 2.94Å
202	A	27.8	Very low	36.2	Very low	38 Å²	38	77.4 Å²	77.4	31%	0.314	38%	0.375	S	S	.	.	S	Bend	trans	176	110	162.1	0	0	0	0	0	107.7	I155 A200	I155-A202 HydrophobicContact CG2-CB 4.22Å; A200-A202 PolarHBondContact O-N 2.88Å
203	V	31.6	Very low	34.6	Very low	16 Å²	16	75.9 Å²	75.9	10%	0.097	37%	0.372	C	S	.	.			trans	64.8	58.8	174.9	-163.3	0	0	0	0	115.3	Y146 I155 L205 L226	Y146-V203 HydrophobicContact CD1-CG1 3.75Å; Y146-V203 HydrophobicContact CE1-CG1 3.96Å; I155-V203 HydrophobicContact CB-CB 4.06Å; I155-V203 HydrophobicContact CB-CG2 4.18Å; I155-V203 HydrophobicContact CD1-CB 3.62Å; I155-V203 HydrophobicContact CD1-CG1 3.62Å; I155-V203 HydrophobicContact CD1-CG2 3.85Å; I155-V203 HydrophobicContact CG1-CB 4.34Å; I155-V203 HydrophobicContact CG2-CB 4.2Å; I155-V203 HydrophobicContact CG2-CG2 3.74Å; V203-L205 HydrophobicContact CG1-CB 4.27Å; V203-L205 HydrophobicContact CG1-CD1 4.02Å; V203-L205 PolarHBondContact O-N 3.16Å; V203-L226 HydrophobicContact CB-CD2 4.21Å; V203-L226 HydrophobicContact CG1-CD2 3.75Å; V203-L226 HydrophobicContact CG2-CD2 4.01Å
204	G	30.8	Very low	33.4	Very low	33 Å²	33	74.8 Å²	74.8	34%	0.34	37%	0.365	S	S	.	.			trans	-72.3	97.9	157.7	0	0	0	0	0	110	V206	G204-V206 PolarHBondContact O-N 3.35Å
205	L	33	Very low	32.4	Very low	28 Å²	28	66.3 Å²	66.3	15%	0.147	33%	0.334	C	S	.	.			trans	-91.8	98.1	-165.7	-159.9	144.7	0	0	0	113.4	V130 I134 Y146 V203	V130-L205 HydrophobicContact CG1-CB 4.06Å; I134-L205 HydrophobicContact CD1-CD1 3.68Å; I134-L205 HydrophobicContact CD1-CD2 3.91Å; I134-L205 HydrophobicContact CD1-CG 4.28Å; I134-L205 HydrophobicContact CG1-CD1 4.02Å; I134-L205 HydrophobicContact CG1-CD2 3.55Å; I134-L205 HydrophobicContact CG1-CG 4.39Å; Y146-L205 HydrophobicContact CD1-CD1 4.16Å; Y146-L205 HydrophobicContact CD2-CD1 3.48Å; Y146-L205 VanDerWaalsContact CD2-CD1 3.48Å; Y146-L205 HydrophobicContact CE2-CD1 3.91Å; Y146-L205 HydrophobicContact CG-CD1 3.63Å; V203-L205 HydrophobicContact CG1-CB 4.27Å; V203-L205 HydrophobicContact CG1-CD1 4.02Å; V203-L205 PolarHBondContact O-N 3.16Å
206	V	36.3	Very low	31.6	Very low	67 Å²	67	63.6 Å²	63.6	41%	0.406	32%	0.323	S	S	.	.			trans	49.8	94.7	142.4	-168.6	0	0	0	0	118.1	G204	G204-V206 PolarHBondContact O-N 3.35Å
207	T	35.4	Very low	31.2	Very low	15 Å²	15	63.5 Å²	63.5	9%	0.092	34%	0.335	C	S	.	.			trans	-167.3	126.1	144.7	-5.3	0	0	0	0	105	C160 L161 I243	C160-T207 CarbonylContact C-O 3.57Å; L161-T207 HydrophobicContact CD2-CG2 3.8Å; T207-I243 HydrophobicContact CG2-CD1 4.03Å
208	I	33.4	Very low	30.6	Very low	24 Å²	24	68.3 Å²	68.3	12%	0.123	36%	0.36	C	S	.	.	S	Bend	cis	-130.3	158.5	14.3	-71	153.2	0	0	0	109.4	L161 T173 F236	L161-I208 HydrophobicContact CD2-CD1 3.47Å; L161-I208 VanDerWaalsContact CD2-CD1 3.47Å; L161-I208 HydrophobicContact CD2-CG1 3.71Å; T173-I208 HydrophobicContact CG2-CD1 4.33Å; T173-I208 HydrophobicContact CG2-CG2 3.71Å; I208-F236 HydrophobicContact CG2-CZ 4.18Å
209	M	31.9	Very low	30.4	Very low	62 Å²	62	60 Å²	60	31%	0.305	34%	0.344	S	S	.	.			trans	81.2	74.2	175.9	-65.3	-118.3	-168.1	0	0	116.2	T173 T175 A177 L188	T173-M209 HydrophobicContact CG2-CE 4.32Å; T175-M209 WeakPolarHBondContact O-CE 3.24Å; T175-M209 WeakPolarHBondContact O-CG 3.22Å; A177-M209 HydrophobicContact CB-CB 4.07Å; A177-M209 WeakPolarHBondContact CB-O 3.1Å; L188-M209 HydrophobicContact CD2-CB 4.38Å; L188-M209 WeakPolarHBondContact CD2-O 3.44Å
210	E	33.6	Very low	30.3	Very low	23 Å²	23	58.3 Å²	58.3	11%	0.107	35%	0.345	C	S	.	.			trans	-146.6	32.4	170.4	-135.8	157.7	-128.9	0	0	114.3	L188 F212 L227	L188-E210 WeakPolarHBondContact CD1-OE1 3.23Å; E210-F212 PolarHBondContact O-N 3.31Å; E210-L227 HydrophobicContact CG-CD2 4.24Å; E210-L227 WeakPolarHBondContact OE1-CD2 3.5Å; E210-L227 VanDerWaalsContact OE2-CD2 3.25Å; E210-L227 WeakPolarHBondContact OE2-CD2 3.46Å
211	I	32.7	Very low	30.2	Very low	63 Å²	63	65.1 Å²	65.1	32%	0.323	38%	0.377	S	S	.	.	S	Bend	trans	-88.7	25.1	170.3	-64	177	0	0	0	111.3	L233 F236	I211-L233 HydrophobicContact CD1-CD1 3.84Å; I211-L233 HydrophobicContact CG2-CD1 4.01Å; I211-F236 HydrophobicContact CD1-CB 3.58Å; I211-F236 HydrophobicContact CD1-CD1 3.84Å; I211-F236 HydrophobicContact CD1-CD2 4.15Å; I211-F236 HydrophobicContact CD1-CG 3.58Å
212	F	30.5	Very low	30.4	Very low	128 Å²	128	64.5 Å²	64.5	56%	0.561	37%	0.371	S	S	*	.	S	Bend	trans	-141.4	-25.8	-178.3	-75.2	-46.5	0	0	0	109.6	A177 V179 A186 E210	A177-F212 HydrophobicContact CB-CB 3.82Å; A177-F212 HydrophobicContact CB-CD2 4.17Å; V179-F212 HydrophobicContact CG2-CB 3.39Å; V179-F212 HydrophobicContact CG2-CD1 3.21Å; V179-F212 HydrophobicContact CG2-CE1 4.13Å; V179-F212 HydrophobicContact CG2-CG 3.5Å; A186-F212 HydrophobicContact CB-CB 3.45Å; A186-F212 VanDerWaalsContact CB-CB 3.45Å; A186-F212 WeakPolarHBondContact CB-O 3.2Å; A186-F212 PolarHBondContact N-O 2.92Å; E210-F212 PolarHBondContact O-N 3.31Å
213	G	26.4	Very low	30.5	Very low	12 Å²	12	66.7 Å²	66.7	12%	0.124	37%	0.373	C	S	.	.			trans	42.2	106.9	163.9	0	0	0	0	0	121.5	D184 R185 A186	D184-G213 CarbonylContact C-O 3.53Å; R185-G213 CarbonylContact C-O 3.44Å; R185-G213 WeakPolarHBondContact CA-O 3.09Å; R185-G213 PolarHBondContact N-O 2.65Å; A186-G213 PolarHBondContact N-O 2.89Å; A186-G213 CarbonylContact O-C 3.57Å
214	A	29.3	Very low	30.4	Very low	4 Å²	4	69.8 Å²	69.8	3%	0.033	39%	0.387	C	S	.	.			trans	-135.8	155.3	162	0	0	0	0	0	112.7	R185 A186 F187 L227	R185-A214 VanDerWaalsContact CA-CA 3.45Å; R185-A214 HydrophobicContact CB-CB 3.38Å; R185-A214 HydrophobicContact CG-CB 3.92Å; A186-A214 VanDerWaalsContact O-CA 3.28Å; A186-A214 WeakPolarHBondContact O-CA 3.25Å; A186-A214 WeakPolarHBondContact O-CB 3.46Å; A186-A214 PolarHBondContact O-N 3.26Å; F187-A214 HydrophobicContact CD2-CB 4.39Å; F187-A214 HydrophobicContact CG-CB 4.42Å; A214-L227 WeakPolarHBondContact O-CD1 3.3Å
215	S	30	Very low	30.4	Very low	5 Å²	5	77.4 Å²	77.4	4%	0.035	41%	0.405	C	S	.	.			trans	-31	131.5	137.9	57.3	0	0	0	0	116.5	R185 F187 E224	R185-S215 VanDerWaalsContact CD-OG 3.28Å; R185-S215 WeakPolarHBondContact CD-OG 3.44Å; R185-S215 PolarHBondContact NH1-OG 2.9Å; F187-S215 WeakPolarHBondContact CD1-O 3.43Å; F187-S215 WeakPolarHBondContact CE1-O 3.03Å; S215-E224 WeakPolarHBondContact CB-OE1 3.14Å
216	S	30.7	Very low	30.6	Very low	43 Å²	43	77.7 Å²	77.7	30%	0.301	41%	0.407	S	S	.	.			trans	-104.3	133.9	144.7	57.2	0	0	0	0	110.3
217	S	29.4	Very low	30.5	Very low	95 Å²	95	75.4 Å²	75.4	66%	0.664	39%	0.392	S	S	*	.	S	Bend	trans	-70.5	137.5	143.3	51	0	0	0	0	107
218	T	25.5	Very low	30.4	Very low	135 Å²	135	82.9 Å²	82.9	83%	0.828	42%	0.418	S	S	*	.	S	Bend	cis	-153.6	101.4	31.4	-22.5	0	0	0	0	110
219	A	26.1	Very low	30.5	Very low	71 Å²	71	84.2 Å²	84.2	59%	0.587	43%	0.426	S	S	*	.	S	Bend	trans	-156.8	58.8	165.6	0	0	0	0	0	109.4
220	E	25.5	Very low	30.8	Very low	175 Å²	175	84.2 Å²	84.2	82%	0.818	43%	0.429	S	S	*	.			trans	46.5	92.9	159.8	-62.6	178.6	167	0	0	118.9	E222	E220-E222 PolarHBondContact O-N 3.37Å
221	L	27.9	Very low	30.8	Very low	171 Å²	171	87.3 Å²	87.3	90%	0.895	45%	0.45	S	S	*	.	S	Bend	trans	62.2	-28.3	154.8	-91.3	81.6	0	0	0	121.8
222	E	31.1	Very low	30.8	Very low	146 Å²	146	89 Å²	89	68%	0.682	46%	0.463	S	S	*	.	S	Bend	trans	-85	-29.8	176.1	-71.7	-148.6	135.3	0	0	113.2	E220 E224 R225 L226	E220-E222 PolarHBondContact O-N 3.37Å; E222-E224 PolarHBondContact O-N 3.06Å; E222-R225 PolarHBondContact O-N 2.6Å; E222-L226 WeakPolarHBondContact O-CD1 3.14Å
223	F	30.2	Very low	30.6	Very low	85 Å²	85	88.2 Å²	88.2	37%	0.373	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-65	-39.3	-168	-149.9	-105.1	0	0	0	114	R225 L226 L227	F223-R225 PolarHBondContact O-N 3.11Å; F223-L226 PolarHBondContact O-N 3.42Å; F223-L226 VanDerWaalsContact O-N 3.12Å; F223-L227 HydrophobicContact CD1-CD1 4.1Å; F223-L227 HydrophobicContact CE1-CD1 4.36Å; F223-L227 WeakPolarHBondContact O-CD1 3.39Å
224	E	29.1	Very low	30.7	Very low	80 Å²	80	91.4 Å²	91.4	37%	0.374	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-63.4	-24.2	179.7	-65.5	-152.8	153.6	0	0	114.1	R185 S215 E222 L226	R185-E224 IonicContact CZ-OE1 3.42Å; R185-E224 IonicContact CZ-OE2 3.44Å; R185-E224 VanDerWaalsContact NH1-CD 3.27Å; R185-E224 IonicContact NH1-OE1 3.26Å; R185-E224 PolarHBondContact NH1-OE1 3.26Å; R185-E224 IonicContact NH1-OE2 3.86Å; R185-E224 PolarHBondContact NH1-OE2 2.91Å; R185-E224 IonicContact NH2-OE1 2.72Å; R185-E224 IonicContact NH2-OE2 3.15Å; R185-E224 PolarHBondContact NH2-OE2 3.04Å; S215-E224 WeakPolarHBondContact CB-OE1 3.14Å; E222-E224 PolarHBondContact O-N 3.06Å; E224-L226 VanDerWaalsContact C-N 3.29Å; E224-L226 PolarHBondContact O-N 2.72Å
225	R	30.4	Very low	30.7	Very low	194 Å²	194	92.6 Å²	92.6	73%	0.732	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-78.6	-8.5	178.6	-93.2	-178.3	169.2	172.5	-2.5	113.2	R145 E222 F223	R145-R225 PolarHBondContact NH1-O 3.07Å; R145-R225 PolarHBondContact NH2-O 2.94Å; E222-R225 PolarHBondContact O-N 2.6Å; F223-R225 PolarHBondContact O-N 3.11Å
226	L	37.2	Very low	30.8	Very low	34 Å²	34	94.9 Å²	94.9	18%	0.178	50%	0.502	C	S	.	.	G	3₁₀ helix	trans	-84.1	-16.8	179.3	-85.6	99.9	0	0	0	114	Y146 V203 E222 F223 E224	Y146-L226 HydrophobicContact CE1-CD2 3.68Å; Y146-L226 HydrophobicContact CE1-CG 4.09Å; Y146-L226 WeakPolarHBondContact OH-CA 3.35Å; Y146-L226 WeakPolarHBondContact OH-CD2 3.22Å; Y146-L226 VanDerWaalsContact OH-CG 3.3Å; Y146-L226 WeakPolarHBondContact OH-CG 3.47Å; Y146-L226 PolarHBondContact OH-O 2.87Å; V203-L226 HydrophobicContact CB-CD2 4.21Å; V203-L226 HydrophobicContact CG1-CD2 3.75Å; V203-L226 HydrophobicContact CG2-CD2 4.01Å; E222-L226 WeakPolarHBondContact O-CD1 3.14Å; F223-L226 PolarHBondContact O-N 3.42Å; F223-L226 VanDerWaalsContact O-N 3.12Å; E224-L226 VanDerWaalsContact C-N 3.29Å; E224-L226 PolarHBondContact O-N 2.72Å
227	L	34.4	Very low	30.8	Very low	18 Å²	18	97 Å²	97	9%	0.094	51%	0.51	C	S	.	.	S	Bend	trans	-102.1	5.9	-153.5	-71.1	153.8	0	0	0	115.5	E210 A214 F223	E210-L227 HydrophobicContact CG-CD2 4.24Å; E210-L227 WeakPolarHBondContact OE1-CD2 3.5Å; E210-L227 VanDerWaalsContact OE2-CD2 3.25Å; E210-L227 WeakPolarHBondContact OE2-CD2 3.46Å; A214-L227 WeakPolarHBondContact O-CD1 3.3Å; F223-L227 HydrophobicContact CD1-CD1 4.1Å; F223-L227 HydrophobicContact CE1-CD1 4.36Å; F223-L227 WeakPolarHBondContact O-CD1 3.39Å
228	R	33.2	Very low	31	Very low	172 Å²	172	96.2 Å²	96.2	65%	0.649	50%	0.498	S	S	*	.	S	Bend	trans	-94.7	-12.9	-172.6	-72	-175	-179.6	-108.6	4.8	116.2
229	D	34.9	Very low	31.3	Very low	53 Å²	53	90.3 Å²	90.3	28%	0.283	46%	0.463	S	S	.	.			trans	-117	23.9	-157.3	-56	-38.7	0	0	0	116.1	S139 Q142	S139-D229 PolarHBondContact OG-O 2.78Å; Q142-D229 VanDerWaalsContact CD-O 3.29Å; Q142-D229 HydrophobicContact CG-CB 4.07Å; Q142-D229 PolarHBondContact NE2-O 2.59Å; Q142-D229 VanDerWaalsContact NE2-O 3.11Å
230	V	39.2	Very low	31.5	Very low	62 Å²	62	87.8 Å²	87.8	38%	0.376	44%	0.44	S	S	.	.			trans	-95.4	116	-176.5	-174.9	0	0	0	0	111.7
231	T	33.6	Very low	32.1	Very low	88 Å²	88	86.8 Å²	86.8	54%	0.54	43%	0.429	S	S	.	.			trans	-121.7	133.2	-175.2	45.1	0	0	0	0	114.4
232	T	32.7	Very low	32.7	Very low	97 Å²	97	80.1 Å²	80.1	60%	0.595	39%	0.393	S	S	*	.			trans	73.7	139.3	171.7	72.4	0	0	0	0	119.3	S235	T232-S235 PolarHBondContact O-OG 3.43Å; T232-S235 PolarHBondContact OG1-OG 3.08Å
233	L	26.4	Very low	33	Very low	113 Å²	113	73.4 Å²	73.4	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-78	-27.7	-172.8	-167.2	82.7	0	0	0	113.8	I211 L237	I211-L233 HydrophobicContact CD1-CD1 3.84Å; I211-L233 HydrophobicContact CG2-CD1 4.01Å; L233-L237 PolarHBondContact O-N 3.49Å
234	S	28	Very low	33.3	Very low	78 Å²	78	73 Å²	73	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-73.9	-45.6	-176	46.4	0	0	0	0	112.5	F236 L237 D238	S234-F236 PolarHBondContact O-N 2.78Å; S234-L237 PolarHBondContact O-N 3.24Å; S234-D238 PolarHBondContact O-N 2.77Å
235	S	30	Very low	33.9	Very low	29 Å²	29	73.1 Å²	73.1	20%	0.203	36%	0.362	C	S	.	.	H	α-helix	trans	-57.2	-36.9	174.6	55.4	0	0	0	0	111.6	F137 T232 D238 A239	F137-S235 WeakPolarHBondContact CD1-O 3.47Å; F137-S235 WeakPolarHBondContact CE1-O 3.32Å; T232-S235 PolarHBondContact O-OG 3.43Å; T232-S235 PolarHBondContact OG1-OG 3.08Å; S235-D238 PolarHBondContact O-N 3.08Å; S235-A239 WeakPolarHBondContact O-CB 3.27Å; S235-A239 PolarHBondContact O-N 2.7Å
236	F	30.7	Very low	34.3	Very low	53 Å²	53	64.6 Å²	64.6	23%	0.232	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-45.9	177.1	173.3	-98.5	0	0	0	113.7	I208 I211 S234 D238 A239 C240	I208-F236 HydrophobicContact CG2-CZ 4.18Å; I211-F236 HydrophobicContact CD1-CB 3.58Å; I211-F236 HydrophobicContact CD1-CD1 3.84Å; I211-F236 HydrophobicContact CD1-CD2 4.15Å; I211-F236 HydrophobicContact CD1-CG 3.58Å; S234-F236 PolarHBondContact O-N 2.78Å; F236-D238 VanDerWaalsContact C-N 3.29Å; F236-D238 PolarHBondContact O-N 3.31Å; F236-A239 WeakPolarHBondContact O-CA 3.14Å; F236-A239 WeakPolarHBondContact O-CB 3.06Å; F236-A239 PolarHBondContact O-N 3.29Å; F236-A239 VanDerWaalsContact O-N 3.08Å; F236-C240 WeakPolarHBondContact CZ-SG 3.4Å; F236-C240 PolarHBondContact O-N 3.21Å
237	L	31.9	Very low	34.3	Very low	89 Å²	89	65.6 Å²	65.6	47%	0.466	34%	0.335	S	S	.	.	H	α-helix	trans	-64.8	-36.7	177.3	-73.4	174.6	0	0	0	111.7	L233 S234 A239 R241	L233-L237 PolarHBondContact O-N 3.49Å; S234-L237 PolarHBondContact O-N 3.24Å; L237-A239 VanDerWaalsContact C-N 3.3Å; L237-R241 WeakPolarHBondContact O-CB 3.49Å; L237-R241 WeakPolarHBondContact O-CD 3.45Å; L237-R241 WeakPolarHBondContact O-CG 3.46Å; L237-R241 PolarHBondContact O-N 3.19Å
238	D	34.1	Very low	34.2	Very low	78 Å²	78	71.6 Å²	71.6	42%	0.417	36%	0.358	S	S	.	.	H	α-helix	trans	-71.5	-25.2	173.4	-69.4	-24.2	0	0	0	112.5	F137 S234 S235 F236 R241 F242	F137-D238 HydrophobicContact CE1-CB 3.61Å; F137-D238 HydrophobicContact CZ-CB 4.17Å; F137-D238 WeakPolarHBondContact CZ-O 3.47Å; S234-D238 PolarHBondContact O-N 2.77Å; S235-D238 PolarHBondContact O-N 3.08Å; F236-D238 VanDerWaalsContact C-N 3.29Å; F236-D238 PolarHBondContact O-N 3.31Å; D238-R241 IonicContact OD1-NH1 2.77Å; D238-F242 WeakPolarHBondContact O-CB 3.27Å; D238-F242 PolarHBondContact O-N 3.07Å
239	A	30.8	Very low	34.6	Very low	10 Å²	10	66.6 Å²	66.6	8%	0.083	34%	0.341	C	S	.	.	H	α-helix	trans	-72	-49.6	172	0	0	0	0	0	112.2	F137 S235 F236 L237 R241 F242 I243	F137-A239 HydrophobicContact CB-CB 4.18Å; F137-A239 HydrophobicContact CD1-CB 4.05Å; F137-A239 HydrophobicContact CD2-CB 3.35Å; F137-A239 HydrophobicContact CE1-CB 4.23Å; F137-A239 HydrophobicContact CE2-CB 3.61Å; F137-A239 HydrophobicContact CG-CB 3.58Å; F137-A239 VanDerWaalsContact CZ-CA 3.4Å; F137-A239 HydrophobicContact CZ-CB 4.01Å; S235-A239 WeakPolarHBondContact O-CB 3.27Å; S235-A239 PolarHBondContact O-N 2.7Å; F236-A239 WeakPolarHBondContact O-CA 3.14Å; F236-A239 WeakPolarHBondContact O-CB 3.06Å; F236-A239 PolarHBondContact O-N 3.29Å; F236-A239 VanDerWaalsContact O-N 3.08Å; L237-A239 VanDerWaalsContact C-N 3.3Å; A239-R241 VanDerWaalsContact C-N 3.33Å; A239-R241 PolarHBondContact O-N 3.21Å; A239-F242 PolarHBondContact O-N 2.72Å; A239-I243 WeakPolarHBondContact O-CB 3.33Å; A239-I243 VanDerWaalsContact O-CG1 3.29Å; A239-I243 WeakPolarHBondContact O-CG1 3.37Å; A239-I243 PolarHBondContact O-N 3.38Å
240	C	31.1	Very low	34.7	Very low	18 Å²	18	65.5 Å²	65.5	12%	0.122	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-46	173.4	-68.4	0	0	0	0	110.5	F236 F242 I243 E244	F236-C240 WeakPolarHBondContact CZ-SG 3.4Å; F236-C240 PolarHBondContact O-N 3.21Å; C240-F242 VanDerWaalsContact C-N 3.35Å; C240-F242 PolarHBondContact O-N 2.75Å; C240-I243 PolarHBondContact O-N 2.95Å; C240-E244 VanDerWaalsContact O-CB 3.26Å; C240-E244 WeakPolarHBondContact O-CB 3.43Å; C240-E244 VanDerWaalsContact O-CG 3.27Å; C240-E244 WeakPolarHBondContact O-CG 3.31Å; C240-E244 PolarHBondContact O-N 2.88Å
241	R	37.7	Very low	34.3	Very low	155 Å²	155	65.6 Å²	65.6	59%	0.585	33%	0.33	S	S	*	.	H	α-helix	trans	-61.8	-37.1	174.1	-75.1	169.5	176.6	172.8	-2.2	113.8	L237 D238 A239 E245	L237-R241 WeakPolarHBondContact O-CB 3.49Å; L237-R241 WeakPolarHBondContact O-CD 3.45Å; L237-R241 WeakPolarHBondContact O-CG 3.46Å; L237-R241 PolarHBondContact O-N 3.19Å; D238-R241 IonicContact OD1-NH1 2.77Å; A239-R241 VanDerWaalsContact C-N 3.33Å; A239-R241 PolarHBondContact O-N 3.21Å; R241-E245 WeakPolarHBondContact O-CB 3.44Å; R241-E245 PolarHBondContact O-N 3.4Å
242	F	40.6	Very low	34.3	Very low	31 Å²	31	66.7 Å²	66.7	14%	0.136	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-43.1	175.8	172	-104	0	0	0	111.3	K132 F137 D238 A239 C240 E245 V246	K132-F242 HydrophobicContact CB-CE1 3.96Å; K132-F242 HydrophobicContact CB-CZ 4.05Å; K132-F242 HydrophobicContact CD-CZ 4.28Å; F137-F242 HydrophobicContact CE2-CB 4.01Å; F137-F242 HydrophobicContact CE2-CD1 4.11Å; F137-F242 HydrophobicContact CE2-CG 4.26Å; F137-F242 HydrophobicContact CZ-CB 3.99Å; D238-F242 WeakPolarHBondContact O-CB 3.27Å; D238-F242 PolarHBondContact O-N 3.07Å; A239-F242 PolarHBondContact O-N 2.72Å; C240-F242 VanDerWaalsContact C-N 3.35Å; C240-F242 PolarHBondContact O-N 2.75Å; F242-E245 PolarHBondContact O-N 3.47Å; F242-V246 HydrophobicContact CD2-CG2 4.16Å; F242-V246 HydrophobicContact CE1-CG2 4.11Å; F242-V246 HydrophobicContact CE2-CG2 3.75Å; F242-V246 HydrophobicContact CZ-CG2 3.71Å; F242-V246 WeakPolarHBondContact O-CB 3.13Å; F242-V246 WeakPolarHBondContact O-CG2 3.41Å; F242-V246 PolarHBondContact O-N 3.39Å
243	I	37.7	Very low	34.4	Very low	5 Å²	5	64.7 Å²	64.7	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-38.5	177.4	-63.2	163.8	0	0	0	110	A133 L161 T207 A239 C240 M247	A133-I243 HydrophobicContact CB-CD1 4.26Å; L161-I243 HydrophobicContact CD1-CG2 3.66Å; T207-I243 HydrophobicContact CG2-CD1 4.03Å; A239-I243 WeakPolarHBondContact O-CB 3.33Å; A239-I243 VanDerWaalsContact O-CG1 3.29Å; A239-I243 WeakPolarHBondContact O-CG1 3.37Å; A239-I243 PolarHBondContact O-N 3.38Å; C240-I243 PolarHBondContact O-N 2.95Å; I243-M247 HydrophobicContact CG2-CG 4.25Å; I243-M247 HydrophobicContact CG2-SD 4.06Å; I243-M247 WeakPolarHBondContact O-CA 3.46Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 VanDerWaalsContact O-CG 3.26Å; I243-M247 WeakPolarHBondContact O-CG 3.44Å; I243-M247 PolarHBondContact O-N 3.17Å
244	E	35.3	Very low	34.6	Very low	77 Å²	77	61.8 Å²	61.8	36%	0.36	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-41.8	168.2	-79.1	172.5	178	0	0	112.1	I170 C240 M247 Y248	I170-E244 HydrophobicContact CD1-CG 3.7Å; I170-E244 HydrophobicContact CG1-CG 4.38Å; C240-E244 VanDerWaalsContact O-CB 3.26Å; C240-E244 WeakPolarHBondContact O-CB 3.43Å; C240-E244 VanDerWaalsContact O-CG 3.27Å; C240-E244 WeakPolarHBondContact O-CG 3.31Å; C240-E244 PolarHBondContact O-N 2.88Å; E244-M247 PolarHBondContact O-N 2.93Å; E244-Y248 WeakPolarHBondContact O-CA 3.34Å; E244-Y248 WeakPolarHBondContact O-CB 3.16Å; E244-Y248 PolarHBondContact O-N 3.44Å
245	E	41.1	Very low	34.6	Very low	81 Å²	81	61.3 Å²	61.3	38%	0.379	29%	0.285	S	S	.	.	H	α-helix	trans	-66.5	-44.8	178.6	-171.5	-164.5	151.4	0	0	110.7	R241 F242 K249	R241-E245 WeakPolarHBondContact O-CB 3.44Å; R241-E245 PolarHBondContact O-N 3.4Å; F242-E245 PolarHBondContact O-N 3.47Å; E245-K249 HydrophobicContact CG-CD 4.36Å; E245-K249 WeakPolarHBondContact O-CB 3.02Å; E245-K249 WeakPolarHBondContact O-CD 3.4Å; E245-K249 VanDerWaalsContact O-CG 3.23Å; E245-K249 WeakPolarHBondContact O-CG 3.47Å; E245-K249 PolarHBondContact O-N 2.96Å; E245-K249 IonicContact OE1-NZ 3.63Å; E245-K249 PolarHBondContact OE1-NZ 2.84Å
246	V	40.4	Very low	34.8	Very low	16 Å²	16	62.1 Å²	62.1	10%	0.097	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-42.5	176.6	179.4	0	0	0	0	110.3	Y124 L129 F242 F250	Y124-V246 HydrophobicContact CE1-CG1 4.38Å; Y124-V246 WeakPolarHBondContact OH-CG1 3.42Å; L129-V246 HydrophobicContact CD2-CB 4.06Å; L129-V246 HydrophobicContact CD2-CG1 3.46Å; L129-V246 VanDerWaalsContact CD2-CG1 3.46Å; F242-V246 HydrophobicContact CD2-CG2 4.16Å; F242-V246 HydrophobicContact CE1-CG2 4.11Å; F242-V246 HydrophobicContact CE2-CG2 3.75Å; F242-V246 HydrophobicContact CZ-CG2 3.71Å; F242-V246 WeakPolarHBondContact O-CB 3.13Å; F242-V246 WeakPolarHBondContact O-CG2 3.41Å; F242-V246 PolarHBondContact O-N 3.39Å; V246-F250 WeakPolarHBondContact O-CB 3.22Å; V246-F250 PolarHBondContact O-N 3.22Å
247	M	35.7	Very low	34.7	Very low	54 Å²	54	60.3 Å²	60.3	27%	0.266	28%	0.282	S	S	.	.	H	α-helix	trans	-69.5	-37.6	176.2	-80.8	-172	58.7	0	0	112.7	L161 I243 E244 F250 E251	L161-M247 HydrophobicContact CD1-CE 4.22Å; L161-M247 HydrophobicContact CD1-SD 3.16Å; L161-M247 WeakPolarHBondContact CD1-SD 3.28Å; I243-M247 HydrophobicContact CG2-CG 4.25Å; I243-M247 HydrophobicContact CG2-SD 4.06Å; I243-M247 WeakPolarHBondContact O-CA 3.46Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 VanDerWaalsContact O-CG 3.26Å; I243-M247 WeakPolarHBondContact O-CG 3.44Å; I243-M247 PolarHBondContact O-N 3.17Å; E244-M247 PolarHBondContact O-N 2.93Å; M247-F250 CarbonylContact O-C 3.45Å; M247-F250 VanDerWaalsContact O-C 3.25Å; M247-F250 WeakPolarHBondContact O-CA 3.3Å; M247-F250 PolarHBondContact O-N 2.87Å; M247-F250 VanDerWaalsContact O-N 3.11Å; M247-E251 WeakPolarHBondContact O-CA 3.23Å; M247-E251 WeakPolarHBondContact O-CB 3.4Å; M247-E251 PolarHBondContact O-N 3.07Å
248	Y	33.5	Very low	34.6	Very low	144 Å²	144	61.4 Å²	61.4	57%	0.565	29%	0.288	S	S	*	.	H	α-helix	trans	-68.9	-42.5	179	-174.4	-97.1	0	0	0	110.3	E244 F250 E251 H252	E244-Y248 WeakPolarHBondContact O-CA 3.34Å; E244-Y248 WeakPolarHBondContact O-CB 3.16Å; E244-Y248 PolarHBondContact O-N 3.44Å; Y248-F250 VanDerWaalsContact C-N 3.26Å; Y248-F250 PolarHBondContact O-N 3.07Å; Y248-E251 PolarHBondContact O-N 3.43Å; Y248-H252 AromaticContact CE1-CD2 3.93Å; Y248-H252 AromaticContact CZ-CD2 3.92Å; Y248-H252 PolarHBondContact O-N 3.25Å
249	K	40.5	Very low	34.5	Very low	67 Å²	67	64.9 Å²	64.9	29%	0.291	30%	0.302	S	S	.	.	H	α-helix	trans	-57.4	-41	167.4	-74	168.9	177.9	174.2	0	111.4	E245 I253	E245-K249 HydrophobicContact CG-CD 4.36Å; E245-K249 WeakPolarHBondContact O-CB 3.02Å; E245-K249 WeakPolarHBondContact O-CD 3.4Å; E245-K249 VanDerWaalsContact O-CG 3.23Å; E245-K249 WeakPolarHBondContact O-CG 3.47Å; E245-K249 PolarHBondContact O-N 2.96Å; E245-K249 IonicContact OE1-NZ 3.63Å; E245-K249 PolarHBondContact OE1-NZ 2.84Å; K249-I253 WeakPolarHBondContact O-CD1 3.47Å; K249-I253 VanDerWaalsContact O-CG1 3.28Å; K249-I253 WeakPolarHBondContact O-CG1 3.43Å; K249-I253 PolarHBondContact O-N 2.84Å
250	F	37.1	Very low	34.5	Very low	30 Å²	30	66.8 Å²	66.8	13%	0.132	31%	0.312	C	S	.	.	H	α-helix	trans	-82.5	-13.8	178.9	-160.3	-120.4	0	0	0	114.3	F120 Y124 V246 M247 Y248 I253 I254	F120-F250 AromaticContact CE1-CE2 3.8Å; F120-F250 HydrophobicContact CE1-CE2 3.8Å; F120-F250 AromaticContact CE1-CZ 3.73Å; F120-F250 HydrophobicContact CE1-CZ 3.73Å; F120-F250 AromaticContact CZ-CE2 3.86Å; F120-F250 HydrophobicContact CZ-CE2 3.86Å; F120-F250 HydrophobicContact CZ-CZ 4.14Å; Y124-F250 HydrophobicContact CD1-CE1 4.27Å; Y124-F250 HydrophobicContact CD1-CE2 4.49Å; Y124-F250 HydrophobicContact CD1-CZ 4.21Å; Y124-F250 HydrophobicContact CE1-CD1 4.13Å; Y124-F250 HydrophobicContact CE1-CD2 4.12Å; Y124-F250 HydrophobicContact CE1-CE1 4.2Å; Y124-F250 HydrophobicContact CE1-CE2 4.23Å; Y124-F250 HydrophobicContact CE1-CG 4.08Å; Y124-F250 HydrophobicContact CE1-CZ 4.26Å; V246-F250 WeakPolarHBondContact O-CB 3.22Å; V246-F250 PolarHBondContact O-N 3.22Å; M247-F250 CarbonylContact O-C 3.45Å; M247-F250 VanDerWaalsContact O-C 3.25Å; M247-F250 WeakPolarHBondContact O-CA 3.3Å; M247-F250 PolarHBondContact O-N 2.87Å; M247-F250 VanDerWaalsContact O-N 3.11Å; Y248-F250 VanDerWaalsContact C-N 3.26Å; Y248-F250 PolarHBondContact O-N 3.07Å; F250-I253 HydrophobicContact CD2-CD1 4.4Å; F250-I253 WeakPolarHBondContact O-CB 3.45Å; F250-I254 HydrophobicContact CD1-CD1 3.52Å; F250-I254 HydrophobicContact CD1-CG1 4.14Å; F250-I254 HydrophobicContact CE1-CD1 3.35Å; F250-I254 HydrophobicContact CE1-CG1 4.06Å; F250-I254 HydrophobicContact CG-CD1 4.46Å; F250-I254 HydrophobicContact CZ-CD1 4.16Å; F250-I254 HydrophobicContact CZ-CG1 4.49Å; F250-I254 VanDerWaalsContact O-CB 3.26Å; F250-I254 WeakPolarHBondContact O-CB 3.26Å; F250-I254 VanDerWaalsContact O-CG1 3.3Å; F250-I254 WeakPolarHBondContact O-CG1 3.49Å; F250-I254 PolarHBondContact O-N 3.31Å
251	E	31.2	Very low	34.5	Very low	64 Å²	64	76.6 Å²	76.6	30%	0.299	35%	0.353	S	S	.	.	H	α-helix	trans	-97.4	-31.9	-177.8	-176.8	173.5	-150.6	0	0	109.9	M247 Y248 I253 I254 R255	M247-E251 WeakPolarHBondContact O-CA 3.23Å; M247-E251 WeakPolarHBondContact O-CB 3.4Å; M247-E251 PolarHBondContact O-N 3.07Å; Y248-E251 PolarHBondContact O-N 3.43Å; E251-I253 PolarHBondContact O-N 2.89Å; E251-I254 PolarHBondContact O-N 3.11Å; E251-R255 HydrophobicContact CG-CG 3.72Å; E251-R255 WeakPolarHBondContact O-CA 2.97Å; E251-R255 WeakPolarHBondContact O-CB 3.32Å; E251-R255 WeakPolarHBondContact O-CG 3.4Å; E251-R255 PolarHBondContact O-N 2.68Å; E251-R255 IonicContact OE1-CZ 2.64Å; E251-R255 IonicContact OE1-NE 3.08Å; E251-R255 PolarHBondContact OE1-NE 2.73Å; E251-R255 IonicContact OE1-NH2 2.71Å; E251-R255 PolarHBondContact OE1-NH2 2.98Å; E251-R255 IonicContact OE2-NH2 3.61Å
252	H	34.4	Very low	33.9	Very low	112 Å²	112	71.5 Å²	71.5	52%	0.519	35%	0.349	S	S	.	.	H	α-helix	trans	-60.8	-35.6	159.7	-112	-65.8	0	0	0	111.4	Y248 S256	Y248-H252 AromaticContact CE1-CD2 3.93Å; Y248-H252 AromaticContact CZ-CD2 3.92Å; Y248-H252 PolarHBondContact O-N 3.25Å; H252-S256 VanDerWaalsContact O-CB 3.26Å; H252-S256 WeakPolarHBondContact O-CB 3.03Å; H252-S256 PolarHBondContact O-N 3.38Å; H252-S256 PolarHBondContact O-OG 3.44Å
253	I	34	Very low	33.3	Very low	54 Å²	54	79.5 Å²	79.5	28%	0.277	38%	0.383	S	S	.	.	H	α-helix	trans	-65.4	-69.3	166.7	-63.4	168	0	0	0	108.6	K249 F250 E251 R255 S256 Q257	K249-I253 WeakPolarHBondContact O-CD1 3.47Å; K249-I253 VanDerWaalsContact O-CG1 3.28Å; K249-I253 WeakPolarHBondContact O-CG1 3.43Å; K249-I253 PolarHBondContact O-N 2.84Å; F250-I253 HydrophobicContact CD2-CD1 4.4Å; F250-I253 WeakPolarHBondContact O-CB 3.45Å; E251-I253 PolarHBondContact O-N 2.89Å; I253-R255 PolarHBondContact O-N 3.01Å; I253-S256 PolarHBondContact O-N 2.9Å; I253-S256 PolarHBondContact O-OG 3.32Å; I253-Q257 HydrophobicContact CG2-CG 4.04Å; I253-Q257 WeakPolarHBondContact O-CG 3.26Å; I253-Q257 PolarHBondContact O-N 3.39Å
254	I	30.5	Very low	32.9	Very low	53 Å²	53	81.3 Å²	81.3	27%	0.272	39%	0.394	S	S	.	.	H	α-helix	trans	-53.1	-45.1	-174.2	-78.9	-179.8	0	0	0	114.2	F250 E251 Q257 L258	F250-I254 HydrophobicContact CD1-CD1 3.52Å; F250-I254 HydrophobicContact CD1-CG1 4.14Å; F250-I254 HydrophobicContact CE1-CD1 3.35Å; F250-I254 HydrophobicContact CE1-CG1 4.06Å; F250-I254 HydrophobicContact CG-CD1 4.46Å; F250-I254 HydrophobicContact CZ-CD1 4.16Å; F250-I254 HydrophobicContact CZ-CG1 4.49Å; F250-I254 VanDerWaalsContact O-CB 3.26Å; F250-I254 WeakPolarHBondContact O-CB 3.26Å; F250-I254 VanDerWaalsContact O-CG1 3.3Å; F250-I254 WeakPolarHBondContact O-CG1 3.49Å; F250-I254 PolarHBondContact O-N 3.31Å; E251-I254 PolarHBondContact O-N 3.11Å; I254-Q257 CarbonylContact O-C 3.14Å; I254-Q257 WeakPolarHBondContact O-CA 3.41Å; I254-Q257 WeakPolarHBondContact O-CB 3.28Å; I254-Q257 PolarHBondContact O-N 3.45Å; I254-L258 HydrophobicContact CG2-CD1 3.51Å; I254-L258 HydrophobicContact CG2-CG 3.99Å; I254-L258 VanDerWaalsContact O-CB 3.31Å; I254-L258 WeakPolarHBondContact O-CB 3.48Å; I254-L258 WeakPolarHBondContact O-CG 3.36Å; I254-L258 PolarHBondContact O-N 3.06Å
255	R	29.3	Very low	32.5	Very low	68 Å²	68	78.3 Å²	78.3	26%	0.257	38%	0.384	S	S	.	.	H	α-helix	trans	-67	-36	177.7	-67.9	-177	-175.7	-167.8	12.4	112.3	E168 E251 I253 Q257 L258 H259	E168-R255 IonicContact OE1-CZ 2.72Å; E168-R255 IonicContact OE1-NH1 3.29Å; E168-R255 PolarHBondContact OE1-NH1 3.34Å; E168-R255 IonicContact OE2-CZ 2.61Å; E168-R255 IonicContact OE2-NH1 3.51Å; E168-R255 PolarHBondContact OE2-NH1 3.09Å; E168-R255 IonicContact OE2-NH2 2.7Å; E168-R255 PolarHBondContact OE2-NH2 2.75Å; E251-R255 HydrophobicContact CG-CG 3.72Å; E251-R255 WeakPolarHBondContact O-CA 2.97Å; E251-R255 WeakPolarHBondContact O-CB 3.32Å; E251-R255 WeakPolarHBondContact O-CG 3.4Å; E251-R255 PolarHBondContact O-N 2.68Å; E251-R255 IonicContact OE1-CZ 2.64Å; E251-R255 IonicContact OE1-NE 3.08Å; E251-R255 PolarHBondContact OE1-NE 2.73Å; E251-R255 IonicContact OE1-NH2 2.71Å; E251-R255 PolarHBondContact OE1-NH2 2.98Å; E251-R255 IonicContact OE2-NH2 3.61Å; I253-R255 PolarHBondContact O-N 3.01Å; R255-Q257 PolarHBondContact O-N 3.31Å; R255-L258 PolarHBondContact O-N 3.44Å; R255-H259 WeakPolarHBondContact O-CB 3.19Å; R255-H259 PolarHBondContact O-N 2.59Å; R255-H259 VanDerWaalsContact O-N 3.09Å
256	S	33	Very low	32.1	Very low	45 Å²	45	75.8 Å²	75.8	32%	0.315	38%	0.377	S	S	.	.	H	α-helix	trans	-69.1	-14.8	169.9	67.7	0	0	0	0	113.3	H252 I253 L336	H252-S256 VanDerWaalsContact O-CB 3.26Å; H252-S256 WeakPolarHBondContact O-CB 3.03Å; H252-S256 PolarHBondContact O-N 3.38Å; H252-S256 PolarHBondContact O-OG 3.44Å; I253-S256 PolarHBondContact O-N 2.9Å; I253-S256 PolarHBondContact O-OG 3.32Å; S256-L336 WeakPolarHBondContact OG-CD1 3.37Å
257	Q	29.5	Very low	31.8	Very low	15 Å²	15	76 Å²	76	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-97.4	-28.7	177.3	-46.7	-103.2	-49.3	0	0	113.1	I253 I254 R255 G265 A266	I253-Q257 HydrophobicContact CG2-CG 4.04Å; I253-Q257 WeakPolarHBondContact O-CG 3.26Å; I253-Q257 PolarHBondContact O-N 3.39Å; I254-Q257 CarbonylContact O-C 3.14Å; I254-Q257 WeakPolarHBondContact O-CA 3.41Å; I254-Q257 WeakPolarHBondContact O-CB 3.28Å; I254-Q257 PolarHBondContact O-N 3.45Å; R255-Q257 PolarHBondContact O-N 3.31Å; Q257-G265 VanDerWaalsContact CD-N 3.34Å; Q257-A266 VanDerWaalsContact CD-N 3.27Å
258	L	28.8	Very low	31.6	Very low	112 Å²	112	74.3 Å²	74.3	59%	0.586	37%	0.373	S	S	*	.	H	α-helix	trans	-109.4	-14.8	-169.9	-68.3	-171.5	0	0	0	114.7	I254 R255 V260	I254-L258 HydrophobicContact CG2-CD1 3.51Å; I254-L258 HydrophobicContact CG2-CG 3.99Å; I254-L258 VanDerWaalsContact O-CB 3.31Å; I254-L258 WeakPolarHBondContact O-CB 3.48Å; I254-L258 WeakPolarHBondContact O-CG 3.36Å; I254-L258 PolarHBondContact O-N 3.06Å; R255-L258 PolarHBondContact O-N 3.44Å; L258-V260 PolarHBondContact O-N 2.97Å
259	H	32.7	Very low	31.7	Very low	151 Å²	151	67.8 Å²	67.8	70%	0.699	35%	0.348	S	S	*	.	S	Bend	trans	-75.4	15.9	170.2	-71.6	-31.1	0	0	0	114.2	R255	R255-H259 WeakPolarHBondContact O-CB 3.19Å; R255-H259 PolarHBondContact O-N 2.59Å; R255-H259 VanDerWaalsContact O-N 3.09Å
260	V	31	Very low	31.4	Very low	50 Å²	50	67.9 Å²	67.9	30%	0.303	35%	0.352	S	S	.	.	S	Bend	trans	-110.1	122	160.8	-173.2	0	0	0	0	108.3	L258 G262	L258-V260 PolarHBondContact O-N 2.97Å; V260-G262 WeakPolarHBondContact CG1-O 3.41Å; V260-G262 PolarHBondContact O-N 3.35Å
261	K	30.4	Very low	31.2	Very low	225 Å²	225	68.3 Å²	68.3	98%	0.978	36%	0.356	S	S	*	.	S	Bend	trans	-60.7	86.6	160.6	-76.5	-176	174.8	-179	0	108.5
262	G	24.8	Very low	31.4	Very low	48 Å²	48	67.3 Å²	67.3	50%	0.495	35%	0.353	S	S	.	.	S	Bend	trans	123.2	103.6	-177.9	0	0	0	0	0	114.2	V260	V260-G262 WeakPolarHBondContact CG1-O 3.41Å; V260-G262 PolarHBondContact O-N 3.35Å
263	K	28	Very low	31.6	Very low	198 Å²	198	63.1 Å²	63.1	86%	0.861	34%	0.336	S	S	*	.			trans	62.5	93.9	153.7	-60.2	-179.5	178.2	179.3	0	117.8
264	V	28.8	Very low	31.7	Very low	43 Å²	43	63.1 Å²	63.1	26%	0.261	34%	0.344	S	S	.	.			trans	24.5	133.8	131.7	-169.7	0	0	0	0	117.5	L117 S268	L117-V264 HydrophobicContact CD1-CG1 4.49Å; L117-V264 HydrophobicContact CD2-CG1 4Å; L117-V264 HydrophobicContact CD2-CG2 3.89Å; V264-S268 WeakPolarHBondContact O-CB 3.32Å; V264-S268 PolarHBondContact O-OG 3.31Å
265	G	26.9	Very low	31.9	Very low	14 Å²	14	68.7 Å²	68.7	14%	0.144	36%	0.362	C	S	.	.	S	Bend	trans	-113	-31.7	-168	0	0	0	0	0	119.7	Q257 S268 L336	Q257-G265 VanDerWaalsContact CD-N 3.34Å; G265-S268 WeakPolarHBondContact CA-OG 3.22Å; G265-S268 PolarHBondContact O-OG 3Å; G265-L336 WeakPolarHBondContact O-CD2 3.49Å
266	A	33.9	Very low	32.5	Very low	29 Å²	29	66.1 Å²	66.1	24%	0.24	35%	0.352	C	S	.	.	S	Bend	trans	-109.6	-53.4	-168	0	0	0	0	0	112.6	Q257 S268 V269 L336	Q257-A266 VanDerWaalsContact CD-N 3.27Å; A266-S268 PolarHBondContact O-N 3.26Å; A266-V269 VanDerWaalsContact O-CB 3.22Å; A266-V269 WeakPolarHBondContact O-CB 3.23Å; A266-V269 WeakPolarHBondContact O-CG2 3.27Å; A266-V269 PolarHBondContact O-N 2.66Å; A266-L336 HydrophobicContact CB-CD2 4.36Å
267	C	33.7	Very low	32.9	Very low	21 Å²	21	68.4 Å²	68.4	14%	0.142	36%	0.36	C	S	.	.	H	α-helix	trans	-58.2	-27.8	165.2	-66.3	0	0	0	0	111.2	G114 L117 V269 V271	G114-C267 WeakPolarHBondContact O-CB 3.1Å; L117-C267 HydrophobicContact CD1-CB 3.9Å; L117-C267 VanDerWaalsContact CD1-SG 3.56Å; C267-V269 PolarHBondContact O-N 2.84Å; C267-V271 WeakPolarHBondContact O-CG2 3.23Å
268	S	31.6	Very low	33.3	Very low	17 Å²	17	73.8 Å²	73.8	12%	0.119	39%	0.39	C	S	.	.	H	α-helix	trans	-66	-18.5	177.5	74.5	0	0	0	0	113.1	V264 G265 A266 L272	V264-S268 WeakPolarHBondContact O-CB 3.32Å; V264-S268 PolarHBondContact O-OG 3.31Å; G265-S268 WeakPolarHBondContact CA-OG 3.22Å; G265-S268 PolarHBondContact O-OG 3Å; A266-S268 PolarHBondContact O-N 3.26Å; S268-L272 VanDerWaalsContact CB-CD1 3.48Å; S268-L272 WeakPolarHBondContact O-CA 3.28Å; S268-L272 WeakPolarHBondContact O-CB 3.1Å; S268-L272 WeakPolarHBondContact O-CD1 3.25Å; S268-L272 PolarHBondContact O-N 3.02Å
269	V	35.1	Very low	33.9	Very low	7 Å²	7	77.6 Å²	77.6	4%	0.042	40%	0.397	C	S	.	.	H	α-helix	trans	-57.9	-57.9	175.9	167.7	0	0	0	0	112.5	A266 C267 C273 I300 F339	A266-V269 VanDerWaalsContact O-CB 3.22Å; A266-V269 WeakPolarHBondContact O-CB 3.23Å; A266-V269 WeakPolarHBondContact O-CG2 3.27Å; A266-V269 PolarHBondContact O-N 2.66Å; C267-V269 PolarHBondContact O-N 2.84Å; V269-C273 WeakPolarHBondContact O-CB 3.26Å; V269-C273 PolarHBondContact O-N 2.78Å; V269-C273 PolarHBondContact O-SG 3.39Å; V269-I300 HydrophobicContact CG1-CD1 3.61Å; V269-I300 HydrophobicContact CG1-CG1 3.62Å; V269-F339 HydrophobicContact CB-CE1 4.22Å; V269-F339 HydrophobicContact CB-CE2 4.12Å; V269-F339 HydrophobicContact CB-CZ 3.88Å; V269-F339 HydrophobicContact CG1-CE1 4.02Å; V269-F339 HydrophobicContact CG1-CE2 3.82Å; V269-F339 HydrophobicContact CG1-CZ 3.36Å; V269-F339 HydrophobicContact CG2-CD1 4.3Å; V269-F339 HydrophobicContact CG2-CD2 3.6Å; V269-F339 HydrophobicContact CG2-CE1 4.06Å; V269-F339 HydrophobicContact CG2-CE2 3.37Å; V269-F339 HydrophobicContact CG2-CG 4.1Å; V269-F339 HydrophobicContact CG2-CZ 3.63Å
270	N	34.9	Very low	34.6	Very low	70 Å²	70	73.5 Å²	73.5	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-69.9	-41	-177.8	-73.7	-8.9	0	0	0	111	A111 C273 A274	A111-N270 PolarHBondContact O-ND2 3.43Å; A111-N270 VanDerWaalsContact O-ND2 3.07Å; N270-C273 PolarHBondContact O-N 3.35Å; N270-A274 WeakPolarHBondContact O-CB 3.29Å; N270-A274 PolarHBondContact O-N 2.75Å
271	V	32.4	Very low	35	Very low	38 Å²	38	80.6 Å²	80.6	23%	0.23	41%	0.408	C	S	.	.	H	α-helix	trans	-64.7	-42.5	178.3	-178.3	0	0	0	0	112.3	A115 C267 R275	A115-V271 WeakPolarHBondContact O-CG2 3.45Å; C267-V271 WeakPolarHBondContact O-CG2 3.23Å; V271-R275 WeakPolarHBondContact O-CB 3.32Å; V271-R275 WeakPolarHBondContact O-CG 3.22Å; V271-R275 PolarHBondContact O-N 3.4Å
272	L	35.5	Very low	35.9	Very low	44 Å²	44	73 Å²	73	23%	0.23	39%	0.386	C	S	.	.	H	α-helix	trans	-70.2	-40.3	174.1	-86.9	97.8	0	0	0	111	S268 A274 R275 F276 W343	S268-L272 VanDerWaalsContact CB-CD1 3.48Å; S268-L272 WeakPolarHBondContact O-CA 3.28Å; S268-L272 WeakPolarHBondContact O-CB 3.1Å; S268-L272 WeakPolarHBondContact O-CD1 3.25Å; S268-L272 PolarHBondContact O-N 3.02Å; L272-A274 PolarHBondContact O-N 2.99Å; L272-R275 CarbonylContact O-C 3.42Å; L272-R275 PolarHBondContact O-N 3.16Å; L272-F276 HydrophobicContact CB-CD2 3.91Å; L272-F276 HydrophobicContact CB-CE2 3.95Å; L272-F276 HydrophobicContact CD2-CD2 4.42Å; L272-F276 HydrophobicContact CD2-CE2 3.73Å; L272-F276 HydrophobicContact CD2-CZ 4.23Å; L272-F276 HydrophobicContact CG-CE2 4.45Å; L272-F276 WeakPolarHBondContact O-CA 3.35Å; L272-F276 WeakPolarHBondContact O-CB 3.47Å; L272-F276 WeakPolarHBondContact O-CD2 3.46Å; L272-F276 WeakPolarHBondContact O-CG 3.44Å; L272-F276 PolarHBondContact O-N 3.46Å; L272-W343 HydrophobicContact CD2-CD2 4.09Å; L272-W343 HydrophobicContact CD2-CE3 3.22Å; L272-W343 HydrophobicContact CD2-CZ3 3.55Å
273	C	40	Very low	37.4	Very low	24 Å²	24	72 Å²	72	16%	0.162	37%	0.369	C	S	.	.	H	α-helix	trans	-59.8	-45.4	176.7	-70.3	0	0	0	0	111.8	V269 N270 F276 I277	V269-C273 WeakPolarHBondContact O-CB 3.26Å; V269-C273 PolarHBondContact O-N 2.78Å; V269-C273 PolarHBondContact O-SG 3.39Å; N270-C273 PolarHBondContact O-N 3.35Å; C273-F276 PolarHBondContact O-N 3.11Å; C273-I277 WeakPolarHBondContact O-CG1 3.26Å; C273-I277 PolarHBondContact O-N 2.72Å
274	A	34.6	Very low	38.6	Very low	54 Å²	54	70.2 Å²	70.2	45%	0.446	36%	0.364	S	S	.	.	H	α-helix	trans	-61.3	-46.3	174.7	0	0	0	0	0	112.2	N270 L272 F276 N278	N270-A274 WeakPolarHBondContact O-CB 3.29Å; N270-A274 PolarHBondContact O-N 2.75Å; L272-A274 PolarHBondContact O-N 2.99Å; A274-F276 PolarHBondContact O-N 2.87Å; A274-N278 PolarHBondContact O-N 3.09Å
275	R	34.4	Very low	40	Very low	169 Å²	169	74.9 Å²	74.9	64%	0.638	39%	0.388	S	S	*	.	H	α-helix	trans	-65.4	-36.1	175.4	-77.7	-177.9	164.3	168.5	-2.3	113	V271 L272 N278 Y279	V271-R275 WeakPolarHBondContact O-CB 3.32Å; V271-R275 WeakPolarHBondContact O-CG 3.22Å; V271-R275 PolarHBondContact O-N 3.4Å; L272-R275 CarbonylContact O-C 3.42Å; L272-R275 PolarHBondContact O-N 3.16Å; R275-N278 PolarHBondContact O-N 3.32Å; R275-Y279 WeakPolarHBondContact O-CB 3.38Å; R275-Y279 WeakPolarHBondContact O-CD2 3.39Å; R275-Y279 PolarHBondContact O-N 3.28Å
276	F	42	Very low	41.8	Very low	14 Å²	14	75.1 Å²	75.1	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-65.4	-46.1	178.3	-88.6	-58.2	0	0	0	111.1	L272 C273 A274 N278 Y279 F280 L293 W343 L346	L272-F276 HydrophobicContact CB-CD2 3.91Å; L272-F276 HydrophobicContact CB-CE2 3.95Å; L272-F276 HydrophobicContact CD2-CD2 4.42Å; L272-F276 HydrophobicContact CD2-CE2 3.73Å; L272-F276 HydrophobicContact CD2-CZ 4.23Å; L272-F276 HydrophobicContact CG-CE2 4.45Å; L272-F276 WeakPolarHBondContact O-CA 3.35Å; L272-F276 WeakPolarHBondContact O-CB 3.47Å; L272-F276 WeakPolarHBondContact O-CD2 3.46Å; L272-F276 WeakPolarHBondContact O-CG 3.44Å; L272-F276 PolarHBondContact O-N 3.46Å; C273-F276 PolarHBondContact O-N 3.11Å; A274-F276 PolarHBondContact O-N 2.87Å; F276-N278 VanDerWaalsContact C-N 3.31Å; F276-N278 PolarHBondContact O-N 3.5Å; F276-Y279 PolarHBondContact O-N 2.94Å; F276-F280 HydrophobicContact CD1-CE2 4.07Å; F276-F280 WeakPolarHBondContact O-CD2 3.47Å; F276-L293 HydrophobicContact CB-CD2 4.41Å; F276-W343 AromaticContact CE1-CE3 3.99Å; F276-W343 HydrophobicContact CE1-CE3 3.99Å; F276-W343 AromaticContact CE1-CZ3 3.98Å; F276-W343 HydrophobicContact CE1-CZ3 3.98Å; F276-W343 HydrophobicContact CE2-CE3 4.08Å; F276-W343 HydrophobicContact CE2-CZ3 4.45Å; F276-W343 AromaticContact CZ-CE3 3.4Å; F276-W343 HydrophobicContact CZ-CE3 3.4Å; F276-W343 VanDerWaalsContact CZ-CE3 3.4Å; F276-W343 AromaticContact CZ-CZ3 3.8Å; F276-W343 HydrophobicContact CZ-CZ3 3.8Å; F276-L346 HydrophobicContact CD1-CD1 4.27Å; F276-L346 HydrophobicContact CE1-CD1 3.51Å; F276-L346 HydrophobicContact CZ-CD1 3.74Å
277	I	42.5	Very low	43.6	Very low	93 Å²	93	78.4 Å²	78.4	48%	0.477	41%	0.406	S	S	.	.	H	α-helix	trans	-61.2	-42.5	177.2	-69.3	160.2	0	0	0	110.4	C273	C273-I277 WeakPolarHBondContact O-CG1 3.26Å; C273-I277 PolarHBondContact O-N 2.72Å
278	N	38.2	Very low	45.4	Very low	129 Å²	129	84.2 Å²	84.2	69%	0.69	43%	0.429	S	S	*	.	H	α-helix	trans	-72.5	-27.4	-179.7	-70.5	-11.6	0	0	0	114.4	A274 R275 F276	A274-N278 PolarHBondContact O-N 3.09Å; R275-N278 PolarHBondContact O-N 3.32Å; F276-N278 VanDerWaalsContact C-N 3.31Å; F276-N278 PolarHBondContact O-N 3.5Å
279	Y	41.9	Very low	47	Very low	191 Å²	191	83.6 Å²	83.6	75%	0.749	42%	0.424	S	S	*	.	H	α-helix	trans	-81.9	-18.4	-176.8	-104.1	-78.7	0	0	0	115.1	R275 F276	R275-Y279 WeakPolarHBondContact O-CB 3.38Å; R275-Y279 WeakPolarHBondContact O-CD2 3.39Å; R275-Y279 PolarHBondContact O-N 3.28Å; F276-Y279 PolarHBondContact O-N 2.94Å
280	F	46.1	Very low	48.4	Very low	65 Å²	65	85.7 Å²	85.7	29%	0.285	44%	0.435	S	S	.	.			trans	-121.6	86.1	-175	-68.3	-88.3	0	0	0	110.4	F276 A282 I283	F276-F280 HydrophobicContact CD1-CE2 4.07Å; F276-F280 WeakPolarHBondContact O-CD2 3.47Å; F280-A282 PolarHBondContact O-N 3.38Å; F280-I283 HydrophobicContact CB-CD1 3.9Å; F280-I283 HydrophobicContact CB-CG1 3.42Å; F280-I283 VanDerWaalsContact CB-CG1 3.42Å; F280-I283 HydrophobicContact CG-CG1 4.41Å; F280-I283 WeakPolarHBondContact O-CG1 3.06Å; F280-I283 PolarHBondContact O-N 3.47Å
281	Q	40.6	Very low	50.3	Low	200 Å²	200	88.5 Å²	88.5	94%	0.935	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	14.9	178.5	-71.5	-175.7	-39.9	0	0	115.1
282	A	49.3	Very low	52	Low	64 Å²	64	88.5 Å²	88.5	53%	0.529	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152	44.3	176.4	0	0	0	0	0	111.7	F280 E284	F280-A282 PolarHBondContact O-N 3.38Å; A282-E284 PolarHBondContact O-N 3Å
283	I	55.9	Low	53.4	Low	27 Å²	27	88.1 Å²	88.1	14%	0.138	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-60.3	-34.7	176.9	-71.2	161.9	0	0	0	111.6	F280 D285 D286 T289 L290 L293	F280-I283 HydrophobicContact CB-CD1 3.9Å; F280-I283 HydrophobicContact CB-CG1 3.42Å; F280-I283 VanDerWaalsContact CB-CG1 3.42Å; F280-I283 HydrophobicContact CG-CG1 4.41Å; F280-I283 WeakPolarHBondContact O-CG1 3.06Å; F280-I283 PolarHBondContact O-N 3.47Å; I283-D285 PolarHBondContact O-N 3.03Å; I283-D285 VanDerWaalsContact O-N 3.17Å; I283-D286 PolarHBondContact O-N 3Å; I283-T289 HydrophobicContact CG1-CG2 4.48Å; I283-L290 HydrophobicContact CG2-CD2 3.61Å; I283-L290 HydrophobicContact CG2-CG 3.95Å; I283-L290 WeakPolarHBondContact O-CG 3.13Å; I283-L293 HydrophobicContact CD1-CD1 4Å; I283-L293 HydrophobicContact CG1-CD1 4.34Å; I283-L293 HydrophobicContact CG2-CD1 3.69Å
284	E	53.3	Low	54.9	Low	161 Å²	161	90.6 Å²	90.6	75%	0.752	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-62.6	-26.1	-169.4	-57.4	-159.6	166.4	0	0	113.9	A282 L290	A282-E284 PolarHBondContact O-N 3Å; E284-L290 WeakPolarHBondContact O-CD1 3.34Å
285	D	57	Low	56.7	Low	142 Å²	142	90.7 Å²	90.7	76%	0.759	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-91.4	-6.6	178.7	-57	-47.9	0	0	0	113.5	I283	I283-D285 PolarHBondContact O-N 3.03Å; I283-D285 VanDerWaalsContact O-N 3.17Å
286	D	65.1	Low	58.2	Low	18 Å²	18	82.8 Å²	82.8	10%	0.096	42%	0.416	C	S	.	.			trans	-105.4	82.9	-173	-172.7	-5.6	0	0	0	111.9	I283 F288 T289 L290 R353	I283-D286 PolarHBondContact O-N 3Å; D286-F288 PolarHBondContact O-N 3.33Å; D286-F288 PolarHBondContact OD1-N 3Å; D286-T289 VanDerWaalsContact CG-CB 3.44Å; D286-T289 PolarHBondContact O-N 3.49Å; D286-T289 PolarHBondContact OD1-N 3.17Å; D286-T289 VanDerWaalsContact OD2-CB 3.27Å; D286-T289 WeakPolarHBondContact OD2-CB 3.44Å; D286-T289 PolarHBondContact OD2-OG1 3.08Å; D286-L290 WeakPolarHBondContact O-CB 3.03Å; D286-L290 PolarHBondContact O-N 3.3Å; D286-R353 IonicContact OD1-NH2 2.7Å; D286-R353 PolarHBondContact OD1-NH2 3.44Å; D286-R353 IonicContact OD2-CZ 3.91Å; D286-R353 IonicContact OD2-NH1 2.78Å; D286-R353 PolarHBondContact OD2-NH1 3.01Å; D286-R353 IonicContact OD2-NH2 3.08Å; D286-R353 PolarHBondContact OD2-NH2 3.35Å
287	C	72.3	Confident	59.1	Low	98 Å²	98	83.6 Å²	83.6	66%	0.662	43%	0.428	S	S	*	.	H	α-helix	trans	-51.4	-32.2	179.9	-62.4	0	0	0	0	114.1	K291	C287-K291 VanDerWaalsContact O-CB 3.29Å; C287-K291 WeakPolarHBondContact O-CB 3.18Å; C287-K291 PolarHBondContact O-N 3.01Å
288	F	70.8	Confident	60.5	Low	144 Å²	144	82.6 Å²	82.6	63%	0.632	43%	0.43	S	S	*	.	H	α-helix	trans	-73.2	-45.1	177	-78.2	-81.5	0	0	0	112	D286 K291 R292 L349	D286-F288 PolarHBondContact O-N 3.33Å; D286-F288 PolarHBondContact OD1-N 3Å; F288-K291 PolarHBondContact O-N 3.3Å; F288-R292 WeakPolarHBondContact O-CG 3.49Å; F288-R292 PolarHBondContact O-N 3.42Å; F288-R292 VanDerWaalsContact O-N 3.15Å; F288-L349 HydrophobicContact CB-CD1 4.36Å
289	T	64.4	Low	62	Low	4 Å²	4	77 Å²	77	3%	0.025	40%	0.401	C	S	.	.	H	α-helix	trans	-66.2	-43	175.7	-64.3	0	0	0	0	111	I283 D286 K291 R292 L293 L346	I283-T289 HydrophobicContact CG1-CG2 4.48Å; D286-T289 VanDerWaalsContact CG-CB 3.44Å; D286-T289 PolarHBondContact O-N 3.49Å; D286-T289 PolarHBondContact OD1-N 3.17Å; D286-T289 VanDerWaalsContact OD2-CB 3.27Å; D286-T289 WeakPolarHBondContact OD2-CB 3.44Å; D286-T289 PolarHBondContact OD2-OG1 3.08Å; T289-K291 PolarHBondContact O-N 2.88Å; T289-R292 PolarHBondContact O-N 3.13Å; T289-L293 HydrophobicContact CG2-CD1 3.9Å; T289-L293 HydrophobicContact CG2-CG 4.33Å; T289-L293 WeakPolarHBondContact O-CG 3.45Å; T289-L293 PolarHBondContact O-N 3.37Å; T289-L346 HydrophobicContact CG2-CD2 4.12Å
290	L	64.4	Low	63	Low	51 Å²	51	70 Å²	70	27%	0.267	38%	0.376	S	S	.	.	H	α-helix	trans	-56.1	-48.5	173	-80.4	169.2	0	0	0	112.4	I283 E284 D286 R292 L293 C294	I283-L290 HydrophobicContact CG2-CD2 3.61Å; I283-L290 HydrophobicContact CG2-CG 3.95Å; I283-L290 WeakPolarHBondContact O-CG 3.13Å; E284-L290 WeakPolarHBondContact O-CD1 3.34Å; D286-L290 WeakPolarHBondContact O-CB 3.03Å; D286-L290 PolarHBondContact O-N 3.3Å; L290-R292 VanDerWaalsContact C-N 3.32Å; L290-R292 PolarHBondContact O-N 3.42Å; L290-L293 PolarHBondContact O-N 3.34Å; L290-C294 WeakPolarHBondContact O-CB 3.18Å; L290-C294 PolarHBondContact O-N 2.75Å; L290-C294 PolarHBondContact O-SG 3.21Å
291	K	75.2	Confident	63.9	Low	128 Å²	128	71.5 Å²	71.5	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-56.8	-45.8	177.1	177.5	173.8	178.6	173.6	0	111.6	C287 F288 T289 C294 E295	C287-K291 VanDerWaalsContact O-CB 3.29Å; C287-K291 WeakPolarHBondContact O-CB 3.18Å; C287-K291 PolarHBondContact O-N 3.01Å; F288-K291 PolarHBondContact O-N 3.3Å; T289-K291 PolarHBondContact O-N 2.88Å; K291-C294 PolarHBondContact O-N 2.86Å; K291-E295 WeakPolarHBondContact CE-OE1 2.93Å; K291-E295 WeakPolarHBondContact O-CG 3.04Å; K291-E295 PolarHBondContact O-N 3.41Å
292	R	69.5	Low	65.3	Low	39 Å²	39	65.1 Å²	65.1	15%	0.147	36%	0.357	C	S	.	.	H	α-helix	trans	-65.9	-38.9	178	-70.8	-50.2	-166.4	-159	3.9	113	F288 T289 L290 C294 E295 V296 Y341 T342 T345 L346	F288-R292 WeakPolarHBondContact O-CG 3.49Å; F288-R292 PolarHBondContact O-N 3.42Å; F288-R292 VanDerWaalsContact O-N 3.15Å; T289-R292 PolarHBondContact O-N 3.13Å; L290-R292 VanDerWaalsContact C-N 3.32Å; L290-R292 PolarHBondContact O-N 3.42Å; R292-C294 VanDerWaalsContact C-N 3.32Å; R292-E295 WeakPolarHBondContact CD-OE2 3.35Å; R292-E295 IonicContact CZ-OE2 3.2Å; R292-E295 IonicContact NE-OE2 3.19Å; R292-E295 IonicContact NH1-OE1 2.81Å; R292-E295 PolarHBondContact NH1-OE1 2.95Å; R292-E295 IonicContact NH1-OE2 2.96Å; R292-E295 PolarHBondContact NH1-OE2 3.31Å; R292-E295 PolarHBondContact O-N 3Å; R292-V296 WeakPolarHBondContact O-CB 3.31Å; R292-V296 PolarHBondContact O-N 2.91Å; R292-Y341 VanDerWaalsContact NH2-CE1 3.25Å; R292-Y341 PolarHBondContact NH2-OH 3.44Å; R292-T342 HydrophobicContact CB-CG2 3.84Å; R292-T345 PolarHBondContact NH2-OG1 3.45Å; R292-L346 HydrophobicContact CB-CD2 4.2Å; R292-L346 HydrophobicContact CB-CG 4.43Å; R292-L346 HydrophobicContact CG-CD2 4.28Å
293	L	64	Low	66.3	Low	35 Å²	35	63.7 Å²	63.7	18%	0.183	34%	0.34	C	S	.	.	H	α-helix	trans	-66.2	-34.4	173.8	-70.2	171.1	0	0	0	112	F276 I283 T289 L290 G297	F276-L293 HydrophobicContact CB-CD2 4.41Å; I283-L293 HydrophobicContact CD1-CD1 4Å; I283-L293 HydrophobicContact CG1-CD1 4.34Å; I283-L293 HydrophobicContact CG2-CD1 3.69Å; T289-L293 HydrophobicContact CG2-CD1 3.9Å; T289-L293 HydrophobicContact CG2-CG 4.33Å; T289-L293 WeakPolarHBondContact O-CG 3.45Å; T289-L293 PolarHBondContact O-N 3.37Å; L290-L293 PolarHBondContact O-N 3.34Å; L293-G297 PolarHBondContact O-N 2.69Å
294	C	71.4	Confident	66.3	Low	77 Å²	77	67 Å²	67	52%	0.52	36%	0.357	S	S	.	.	H	α-helix	trans	-68.5	-41.3	174.1	-67	0	0	0	0	112.6	L290 K291 R292 G297 S298	L290-C294 WeakPolarHBondContact O-CB 3.18Å; L290-C294 PolarHBondContact O-N 2.75Å; L290-C294 PolarHBondContact O-SG 3.21Å; K291-C294 PolarHBondContact O-N 2.86Å; R292-C294 VanDerWaalsContact C-N 3.32Å; C294-G297 PolarHBondContact O-N 2.75Å; C294-S298 VanDerWaalsContact O-CB 3.29Å; C294-S298 WeakPolarHBondContact O-CB 3.17Å; C294-S298 PolarHBondContact O-N 2.98Å; C294-S298 PolarHBondContact O-OG 3.23Å
295	E	72.9	Confident	67	Low	55 Å²	55	61.6 Å²	61.6	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-45.9	173.3	-72.2	168	-177.1	0	0	110.9	K291 R292 S299 I338	K291-E295 WeakPolarHBondContact CE-OE1 2.93Å; K291-E295 WeakPolarHBondContact O-CG 3.04Å; K291-E295 PolarHBondContact O-N 3.41Å; R292-E295 WeakPolarHBondContact CD-OE2 3.35Å; R292-E295 IonicContact CZ-OE2 3.2Å; R292-E295 IonicContact NE-OE2 3.19Å; R292-E295 IonicContact NH1-OE1 2.81Å; R292-E295 PolarHBondContact NH1-OE1 2.95Å; R292-E295 IonicContact NH1-OE2 2.96Å; R292-E295 PolarHBondContact NH1-OE2 3.31Å; R292-E295 PolarHBondContact O-N 3Å; E295-S299 PolarHBondContact O-N 3.31Å; E295-S299 VanDerWaalsContact O-N 3.14Å; E295-S299 PolarHBondContact O-OG 3.45Å; E295-I338 HydrophobicContact CB-CG2 4.49Å
296	V	65.5	Low	67.6	Low	3 Å²	3	55.8 Å²	55.8	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-56.2	173.5	151.4	0	0	0	0	111.7	R292 S298 S299 I300 I338 F339 T342	R292-V296 WeakPolarHBondContact O-CB 3.31Å; R292-V296 PolarHBondContact O-N 2.91Å; V296-S298 VanDerWaalsContact C-N 3.31Å; V296-S298 PolarHBondContact O-N 2.7Å; V296-S299 WeakPolarHBondContact O-CB 3.41Å; V296-S299 PolarHBondContact O-N 3.28Å; V296-I300 HydrophobicContact CG1-CD1 4.23Å; V296-I300 WeakPolarHBondContact O-CG1 3.39Å; V296-I300 PolarHBondContact O-N 2.98Å; V296-I338 HydrophobicContact CG2-CG2 4.32Å; V296-F339 HydrophobicContact CB-CE1 4.27Å; V296-F339 HydrophobicContact CB-CZ 4.32Å; V296-F339 HydrophobicContact CG1-CD1 4.38Å; V296-F339 HydrophobicContact CG1-CE1 3.43Å; V296-F339 VanDerWaalsContact CG1-CE1 3.43Å; V296-F339 HydrophobicContact CG1-CZ 3.5Å; V296-F339 HydrophobicContact CG2-CD1 4.08Å; V296-F339 HydrophobicContact CG2-CE1 3.92Å; V296-F339 HydrophobicContact CG2-CZ 4.27Å; V296-T342 HydrophobicContact CG2-CG2 3.71Å
297	G	61.8	Low	67.5	Low	31 Å²	31	56.8 Å²	56.8	32%	0.32	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-36.1	-177.2	0	0	0	0	0	113.4	L293 C294 S299 I300 F301	L293-G297 PolarHBondContact O-N 2.69Å; C294-G297 PolarHBondContact O-N 2.75Å; G297-S299 VanDerWaalsContact C-N 3.35Å; G297-I300 PolarHBondContact O-N 3.21Å; G297-F301 PolarHBondContact O-N 3.04Å; G297-F301 VanDerWaalsContact O-N 3.08Å
298	S	71.6	Confident	67	Low	72 Å²	72	54.8 Å²	54.8	50%	0.503	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-41.6	173.5	-57.1	0	0	0	0	111.5	C294 V296 F301 V302	C294-S298 VanDerWaalsContact O-CB 3.29Å; C294-S298 WeakPolarHBondContact O-CB 3.17Å; C294-S298 PolarHBondContact O-N 2.98Å; C294-S298 PolarHBondContact O-OG 3.23Å; V296-S298 VanDerWaalsContact C-N 3.31Å; V296-S298 PolarHBondContact O-N 2.7Å; S298-F301 WeakPolarHBondContact O-CB 3.47Å; S298-F301 PolarHBondContact O-N 3.18Å; S298-V302 WeakPolarHBondContact O-CG2 3.37Å; S298-V302 PolarHBondContact O-N 3.06Å; S298-V302 VanDerWaalsContact O-N 3.09Å
299	S	68.7	Low	66.9	Low	12 Å²	12	54.7 Å²	54.7	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-43.1	177.7	-54.9	0	0	0	0	111.6	E295 V296 G297 F301 V302 M303 C335	E295-S299 PolarHBondContact O-N 3.31Å; E295-S299 VanDerWaalsContact O-N 3.14Å; E295-S299 PolarHBondContact O-OG 3.45Å; V296-S299 WeakPolarHBondContact O-CB 3.41Å; V296-S299 PolarHBondContact O-N 3.28Å; G297-S299 VanDerWaalsContact C-N 3.35Å; S299-F301 VanDerWaalsContact C-N 3.28Å; S299-F301 PolarHBondContact O-N 2.76Å; S299-V302 PolarHBondContact O-N 2.77Å; S299-M303 PolarHBondContact O-N 2.74Å; S299-C335 PolarHBondContact O-SG 2.71Å
300	I	62.9	Low	67	Low	43 Å²	43	54.9 Å²	54.9	22%	0.221	30%	0.303	C	S	.	.	H	α-helix	trans	-55.6	-44.8	173.1	-58.5	175.1	0	0	0	110.8	V269 V296 G297 M303 L304 F339	V269-I300 HydrophobicContact CG1-CD1 3.61Å; V269-I300 HydrophobicContact CG1-CG1 3.62Å; V296-I300 HydrophobicContact CG1-CD1 4.23Å; V296-I300 WeakPolarHBondContact O-CG1 3.39Å; V296-I300 PolarHBondContact O-N 2.98Å; G297-I300 PolarHBondContact O-N 3.21Å; I300-M303 PolarHBondContact O-N 3.33Å; I300-L304 WeakPolarHBondContact O-CB 3.35Å; I300-L304 PolarHBondContact O-N 2.64Å; I300-F339 HydrophobicContact CD1-CZ 3.91Å; I300-F339 HydrophobicContact CG1-CE2 4.1Å; I300-F339 HydrophobicContact CG1-CZ 3.68Å
301	F	66.1	Low	66.9	Low	98 Å²	98	53.4 Å²	53.4	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-47.3	-179	-176.8	-124.3	0	0	0	112.8	F57 G297 S298 S299 M303 L304 A305	F57-F301 HydrophobicContact CD1-CD2 4.39Å; F57-F301 HydrophobicContact CE1-CB 3.65Å; F57-F301 HydrophobicContact CE1-CD1 4.1Å; F57-F301 AromaticContact CE1-CD2 3.19Å; F57-F301 HydrophobicContact CE1-CD2 3.19Å; F57-F301 AromaticContact CE1-CE2 3.77Å; F57-F301 HydrophobicContact CE1-CE2 3.77Å; F57-F301 AromaticContact CE1-CG 3.36Å; F57-F301 HydrophobicContact CE1-CG 3.36Å; F57-F301 HydrophobicContact CE1-CZ 4.42Å; F57-F301 HydrophobicContact CZ-CB 4.17Å; F57-F301 AromaticContact CZ-CD1 3.74Å; F57-F301 HydrophobicContact CZ-CD1 3.74Å; F57-F301 AromaticContact CZ-CD2 3.4Å; F57-F301 HydrophobicContact CZ-CD2 3.4Å; F57-F301 VanDerWaalsContact CZ-CD2 3.4Å; F57-F301 AromaticContact CZ-CE1 3.88Å; F57-F301 HydrophobicContact CZ-CE1 3.88Å; F57-F301 AromaticContact CZ-CE2 3.54Å; F57-F301 HydrophobicContact CZ-CE2 3.54Å; F57-F301 AromaticContact CZ-CG 3.48Å; F57-F301 HydrophobicContact CZ-CG 3.48Å; F57-F301 VanDerWaalsContact CZ-CG 3.48Å; F57-F301 AromaticContact CZ-CZ 3.78Å; F57-F301 HydrophobicContact CZ-CZ 3.78Å; G297-F301 PolarHBondContact O-N 3.04Å; G297-F301 VanDerWaalsContact O-N 3.08Å; S298-F301 WeakPolarHBondContact O-CB 3.47Å; S298-F301 PolarHBondContact O-N 3.18Å; S299-F301 VanDerWaalsContact C-N 3.28Å; S299-F301 PolarHBondContact O-N 2.76Å; F301-M303 VanDerWaalsContact C-N 3.32Å; F301-M303 PolarHBondContact O-N 3.44Å; F301-L304 PolarHBondContact O-N 3.03Å; F301-A305 VanDerWaalsContact O-CB 3.31Å; F301-A305 WeakPolarHBondContact O-CB 3.17Å; F301-A305 PolarHBondContact O-N 3.18Å
302	V	70	Confident	66.1	Low	65 Å²	65	55 Å²	55	39%	0.394	30%	0.299	S	S	.	.	H	α-helix	trans	-60.1	-44.9	178.2	174.1	0	0	0	0	110	S298 S299 A305 A306 E331	S298-V302 WeakPolarHBondContact O-CG2 3.37Å; S298-V302 PolarHBondContact O-N 3.06Å; S298-V302 VanDerWaalsContact O-N 3.09Å; S299-V302 PolarHBondContact O-N 2.77Å; V302-A305 PolarHBondContact O-N 3.44Å; V302-A306 VanDerWaalsContact O-CB 3.28Å; V302-A306 WeakPolarHBondContact O-CB 3.48Å; V302-A306 PolarHBondContact O-N 2.99Å; V302-E331 HydrophobicContact CG1-CG 4.33Å; V302-E331 WeakPolarHBondContact CG1-OE2 3.44Å
303	M	68.7	Low	65.9	Low	35 Å²	35	53.4 Å²	53.4	17%	0.172	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-50.7	174.6	-169.7	-159.3	-62	0	0	111.9	S299 I300 F301 A305 A306 V307 C335	S299-M303 PolarHBondContact O-N 2.74Å; I300-M303 PolarHBondContact O-N 3.33Å; F301-M303 VanDerWaalsContact C-N 3.32Å; F301-M303 PolarHBondContact O-N 3.44Å; M303-A305 VanDerWaalsContact C-N 3.32Å; M303-A305 PolarHBondContact O-N 3.49Å; M303-A306 PolarHBondContact O-N 3.42Å; M303-V307 HydrophobicContact CG-CG2 4.32Å; M303-V307 WeakPolarHBondContact O-CB 3.44Å; M303-V307 VanDerWaalsContact O-CG2 3.27Å; M303-V307 WeakPolarHBondContact O-CG2 3.41Å; M303-V307 PolarHBondContact O-N 3.37Å; M303-C335 HydrophobicContact CE-CB 3.34Å; M303-C335 VanDerWaalsContact CE-SG 3.52Å
304	L	57.3	Low	65.8	Low	96 Å²	96	57.5 Å²	57.5	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-38.1	-178.3	-178.9	62	0	0	0	112.1	I300 F301 S308	I300-L304 WeakPolarHBondContact O-CB 3.35Å; I300-L304 PolarHBondContact O-N 2.64Å; F301-L304 PolarHBondContact O-N 3.03Å; L304-S308 WeakPolarHBondContact O-CB 3.37Å; L304-S308 PolarHBondContact O-N 3.09Å; L304-S308 PolarHBondContact O-OG 3.33Å
305	A	68.3	Low	65.1	Low	47 Å²	47	57.4 Å²	57.4	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-44.3	174.4	0	0	0	0	0	111.5	F301 V302 M303 S308 R309	F301-A305 VanDerWaalsContact O-CB 3.31Å; F301-A305 WeakPolarHBondContact O-CB 3.17Å; F301-A305 PolarHBondContact O-N 3.18Å; V302-A305 PolarHBondContact O-N 3.44Å; M303-A305 VanDerWaalsContact C-N 3.32Å; M303-A305 PolarHBondContact O-N 3.49Å; A305-S308 PolarHBondContact O-N 2.82Å; A305-R309 VanDerWaalsContact O-CB 3.27Å; A305-R309 WeakPolarHBondContact O-CB 3.41Å; A305-R309 PolarHBondContact O-N 2.93Å
306	A	69.7	Low	65.1	Low	20 Å²	20	60.2 Å²	60.2	17%	0.165	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-48.8	176.8	0	0	0	0	0	111.7	V302 M303 S308 R309 A310 V328 E331	V302-A306 VanDerWaalsContact O-CB 3.28Å; V302-A306 WeakPolarHBondContact O-CB 3.48Å; V302-A306 PolarHBondContact O-N 2.99Å; M303-A306 PolarHBondContact O-N 3.42Å; A306-S308 PolarHBondContact O-N 2.71Å; A306-R309 PolarHBondContact O-N 3.46Å; A306-A310 WeakPolarHBondContact O-CB 3.41Å; A306-A310 PolarHBondContact O-N 3.44Å; A306-V328 VanDerWaalsContact C-CG2 3.41Å; A306-V328 HydrophobicContact CB-CG2 3.85Å; A306-V328 WeakPolarHBondContact O-CG2 3.29Å; A306-E331 HydrophobicContact CB-CG 4.39Å
307	V	62.9	Low	65.4	Low	40 Å²	40	63 Å²	63	24%	0.242	35%	0.352	C	S	.	.	H	α-helix	trans	-58.2	-46.8	175.5	171.5	0	0	0	0	110.7	M303 R309 S311 V328	M303-V307 HydrophobicContact CG-CG2 4.32Å; M303-V307 WeakPolarHBondContact O-CB 3.44Å; M303-V307 VanDerWaalsContact O-CG2 3.27Å; M303-V307 WeakPolarHBondContact O-CG2 3.41Å; M303-V307 PolarHBondContact O-N 3.37Å; V307-R309 VanDerWaalsContact C-N 3.29Å; V307-R309 PolarHBondContact O-N 3.15Å; V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 3.13Å; V307-V328 HydrophobicContact CG2-CG1 3.6Å; V307-V328 HydrophobicContact CG2-CG2 4.4Å
308	S	60.8	Low	66.1	Low	55 Å²	55	65.3 Å²	65.3	39%	0.385	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-36.1	178.2	-64.9	0	0	0	0	112.7	L304 A305 A306 R312	L304-S308 WeakPolarHBondContact O-CB 3.37Å; L304-S308 PolarHBondContact O-N 3.09Å; L304-S308 PolarHBondContact O-OG 3.33Å; A305-S308 PolarHBondContact O-N 2.82Å; A306-S308 PolarHBondContact O-N 2.71Å; S308-R312 WeakPolarHBondContact O-CB 3.5Å; S308-R312 PolarHBondContact O-N 3.27Å
309	R	69.6	Low	66.6	Low	143 Å²	143	70.9 Å²	70.9	54%	0.54	37%	0.372	S	S	.	.	H	α-helix	trans	-72.2	-53.9	178	-179.7	171.8	128.7	55.2	6.2	111.1	A305 A306 V307 S311 R312 S313 E324	A305-R309 VanDerWaalsContact O-CB 3.27Å; A305-R309 WeakPolarHBondContact O-CB 3.41Å; A305-R309 PolarHBondContact O-N 2.93Å; A306-R309 PolarHBondContact O-N 3.46Å; V307-R309 VanDerWaalsContact C-N 3.29Å; V307-R309 PolarHBondContact O-N 3.15Å; R309-S311 VanDerWaalsContact C-N 3.33Å; R309-S311 PolarHBondContact O-N 2.82Å; R309-R312 WeakPolarHBondContact O-CB 3.4Å; R309-R312 PolarHBondContact O-N 3.05Å; R309-R312 VanDerWaalsContact O-N 3.11Å; R309-S313 PolarHBondContact O-N 3.14Å; R309-S313 PolarHBondContact O-OG 2.92Å; R309-S313 VanDerWaalsContact O-OG 3.11Å; R309-E324 IonicContact CZ-OE1 3.27Å; R309-E324 IonicContact CZ-OE2 2.74Å; R309-E324 VanDerWaalsContact CZ-OE2 3.29Å; R309-E324 IonicContact NE-OE2 2.64Å; R309-E324 IonicContact NH1-OE1 2.79Å; R309-E324 PolarHBondContact NH1-OE1 3.03Å; R309-E324 IonicContact NH1-OE2 3.69Å; R309-E324 PolarHBondContact NH1-OE2 2.84Å; R309-E324 VanDerWaalsContact NH1-OE2 3.08Å; R309-E324 IonicContact NH2-OE1 2.71Å; R309-E324 PolarHBondContact NH2-OE1 3.17Å; R309-E324 IonicContact NH2-OE2 3.33Å
310	A	65	Low	67.1	Low	7 Å²	7	74.5 Å²	74.5	6%	0.058	39%	0.39	C	S	.	.	H	α-helix	trans	-59.9	-41.8	178.3	0	0	0	0	0	112	A306 R312 S313 Y314 E324 V325 V328	A306-A310 WeakPolarHBondContact O-CB 3.41Å; A306-A310 PolarHBondContact O-N 3.44Å; A310-R312 VanDerWaalsContact C-N 3.35Å; A310-R312 PolarHBondContact O-N 3.14Å; A310-S313 PolarHBondContact O-N 3.39Å; A310-Y314 WeakPolarHBondContact O-CB 3.41Å; A310-Y314 PolarHBondContact O-N 3.1Å; A310-E324 HydrophobicContact CB-CB 3.91Å; A310-V325 HydrophobicContact CB-CG2 4.48Å; A310-V328 HydrophobicContact CB-CG2 3.64Å
311	S	62.5	Low	67.6	Low	20 Å²	20	73.4 Å²	73.4	14%	0.14	39%	0.386	C	S	.	.	H	α-helix	trans	-58.2	-44.7	174.2	177.3	0	0	0	0	111.9	V307 R309 C315	V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 3.13Å; R309-S311 VanDerWaalsContact C-N 3.33Å; R309-S311 PolarHBondContact O-N 2.82Å; S311-C315 WeakPolarHBondContact O-CB 3.46Å; S311-C315 PolarHBondContact O-N 2.96Å; S311-C315 PolarHBondContact O-SG 3.02Å
312	R	59.2	Low	68	Low	163 Å²	163	73.3 Å²	73.3	62%	0.615	39%	0.39	S	S	*	.	H	α-helix	trans	-64.2	-46.4	175.5	175.2	177.6	-76.7	146.8	-9	111.6	S308 R309 A310 Y314 C315 I316	S308-R312 WeakPolarHBondContact O-CB 3.5Å; S308-R312 PolarHBondContact O-N 3.27Å; R309-R312 WeakPolarHBondContact O-CB 3.4Å; R309-R312 PolarHBondContact O-N 3.05Å; R309-R312 VanDerWaalsContact O-N 3.11Å; A310-R312 VanDerWaalsContact C-N 3.35Å; A310-R312 PolarHBondContact O-N 3.14Å; R312-Y314 VanDerWaalsContact C-N 3.35Å; R312-Y314 PolarHBondContact O-N 3.12Å; R312-C315 PolarHBondContact O-N 2.92Å; R312-I316 HydrophobicContact CG-CD1 3.58Å; R312-I316 HydrophobicContact CG-CG1 4.38Å; R312-I316 WeakPolarHBondContact O-CB 3.21Å; R312-I316 WeakPolarHBondContact O-CG1 3.06Å; R312-I316 PolarHBondContact O-N 3.17Å
313	S	64.3	Low	68.6	Low	5 Å²	5	75 Å²	75	4%	0.035	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-39.8	-178.4	-60.2	0	0	0	0	112.6	R309 A310 G317 L318 E324	R309-S313 PolarHBondContact O-N 3.14Å; R309-S313 PolarHBondContact O-OG 2.92Å; R309-S313 VanDerWaalsContact O-OG 3.11Å; A310-S313 PolarHBondContact O-N 3.39Å; S313-G317 PolarHBondContact O-N 3.13Å; S313-L318 PolarHBondContact O-N 2.91Å; S313-E324 WeakPolarHBondContact CB-OE2 3.34Å; S313-E324 VanDerWaalsContact OG-CD 3.24Å; S313-E324 PolarHBondContact OG-OE1 3.36Å; S313-E324 PolarHBondContact OG-OE2 3.23Å
314	Y	62.1	Low	68.7	Low	121 Å²	121	74.8 Å²	74.8	48%	0.475	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-49.2	172.3	-176.1	-89.5	0	0	0	111.5	A310 R312 I316 G317	A310-Y314 WeakPolarHBondContact O-CB 3.41Å; A310-Y314 PolarHBondContact O-N 3.1Å; R312-Y314 VanDerWaalsContact C-N 3.35Å; R312-Y314 PolarHBondContact O-N 3.12Å; Y314-I316 VanDerWaalsContact C-N 3.26Å; Y314-I316 PolarHBondContact O-N 2.84Å; Y314-G317 PolarHBondContact O-N 2.79Å
315	C	57.5	Low	69.2	Low	75 Å²	75	71.8 Å²	71.8	51%	0.507	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-25.9	179.8	-72.1	0	0	0	0	114.3	N103 S311 R312	N103-C315 PolarHBondContact ND2-SG 3.28Å; N103-C315 VanDerWaalsContact ND2-SG 3.42Å; S311-C315 WeakPolarHBondContact O-CB 3.46Å; S311-C315 PolarHBondContact O-N 2.96Å; S311-C315 PolarHBondContact O-SG 3.02Å; R312-C315 PolarHBondContact O-N 2.92Å
316	I	72.4	Confident	69.4	Low	113 Å²	113	72.5 Å²	72.5	58%	0.579	38%	0.383	S	S	*	.	H	α-helix	trans	-85.2	-12.2	174.9	-67.2	173	0	0	0	111.5	R312 Y314 L318	R312-I316 HydrophobicContact CG-CD1 3.58Å; R312-I316 HydrophobicContact CG-CG1 4.38Å; R312-I316 WeakPolarHBondContact O-CB 3.21Å; R312-I316 WeakPolarHBondContact O-CG1 3.06Å; R312-I316 PolarHBondContact O-N 3.17Å; Y314-I316 VanDerWaalsContact C-N 3.26Å; Y314-I316 PolarHBondContact O-N 2.84Å; I316-L318 HydrophobicContact CB-CG 4.27Å; I316-L318 HydrophobicContact CG2-CD2 3.82Å; I316-L318 HydrophobicContact CG2-CG 3.97Å
317	G	72.9	Confident	69.6	Low	61 Å²	61	75.1 Å²	75.1	63%	0.629	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	33.6	-175.2	0	0	0	0	0	112.9	S313 Y314	S313-G317 PolarHBondContact O-N 3.13Å; Y314-G317 PolarHBondContact O-N 2.79Å
318	L	75.8	Confident	69.9	Low	80 Å²	80	74.6 Å²	74.6	42%	0.419	39%	0.393	S	S	.	.			trans	-63.2	138.9	177.7	-68.3	-176.4	0	0	0	110.8	S313 I316 N320 S321	S313-L318 PolarHBondContact O-N 2.91Å; I316-L318 HydrophobicContact CB-CG 4.27Å; I316-L318 HydrophobicContact CG2-CD2 3.82Å; I316-L318 HydrophobicContact CG2-CG 3.97Å; L318-N320 PolarHBondContact O-N 3.35Å; L318-S321 VanDerWaalsContact O-CB 3.22Å; L318-S321 WeakPolarHBondContact O-CB 3.35Å; L318-S321 PolarHBondContact O-N 3.44Å; L318-S321 VanDerWaalsContact O-N 3.1Å; L318-S321 PolarHBondContact O-OG 3.31Å
319	K	81.1	Confident	70.3	Confident	190 Å²	190	75.4 Å²	75.4	83%	0.826	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	133.3	171.4	-179.1	173.1	-178	178	0	109.7	S321	K319-S321 VanDerWaalsContact C-N 3.33Å
320	N	80.7	Confident	70.5	Confident	88 Å²	88	74.8 Å²	74.8	47%	0.471	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	23.6	-174.9	-50	-9.1	0	0	0	114.6	L318 D322 L323	L318-N320 PolarHBondContact O-N 3.35Å; N320-D322 WeakPolarHBondContact CA-OD1 3.48Å; N320-D322 PolarHBondContact O-N 3.09Å; N320-L323 HydrophobicContact CB-CD1 3.93Å; N320-L323 HydrophobicContact CB-CG 4.15Å; N320-L323 WeakPolarHBondContact O-CB 3.45Å; N320-L323 PolarHBondContact O-N 3.27Å; N320-L323 VanDerWaalsContact O-N 3.07Å
321	S	72.9	Confident	70.8	Confident	19 Å²	19	76.5 Å²	76.5	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-61.9	-24.8	175.4	47.5	0	0	0	0	113.5	L318 K319 E324 V325	L318-S321 VanDerWaalsContact O-CB 3.22Å; L318-S321 WeakPolarHBondContact O-CB 3.35Å; L318-S321 PolarHBondContact O-N 3.44Å; L318-S321 VanDerWaalsContact O-N 3.1Å; L318-S321 PolarHBondContact O-OG 3.31Å; K319-S321 VanDerWaalsContact C-N 3.33Å; S321-E324 WeakPolarHBondContact O-CB 3.45Å; S321-E324 PolarHBondContact O-N 2.99Å; S321-V325 PolarHBondContact O-N 3.44Å
322	D	73.8	Confident	71	Confident	97 Å²	97	76.5 Å²	76.5	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-55.6	-42.9	167.5	53.1	-61.9	0	0	0	112.7	N320 E324 V325 S326	N320-D322 WeakPolarHBondContact CA-OD1 3.48Å; N320-D322 PolarHBondContact O-N 3.09Å; D322-E324 VanDerWaalsContact C-N 3.25Å; D322-E324 PolarHBondContact O-N 2.76Å; D322-V325 WeakPolarHBondContact O-CB 3.47Å; D322-V325 PolarHBondContact O-N 3.26Å; D322-S326 PolarHBondContact O-N 3.49Å
323	L	82.5	Confident	71.5	Confident	100 Å²	100	72.9 Å²	72.9	52%	0.524	39%	0.39	S	S	.	.	H	α-helix	trans	-65.4	-28.9	176.9	-58.2	-175.8	0	0	0	112.5	N320 T327	N320-L323 HydrophobicContact CB-CD1 3.93Å; N320-L323 HydrophobicContact CB-CG 4.15Å; N320-L323 WeakPolarHBondContact O-CB 3.45Å; N320-L323 PolarHBondContact O-N 3.27Å; N320-L323 VanDerWaalsContact O-N 3.07Å; L323-T327 PolarHBondContact O-N 2.71Å; L323-T327 PolarHBondContact O-OG1 3.42Å
324	E	70.7	Confident	71.9	Confident	31 Å²	31	78 Å²	78	15%	0.145	41%	0.409	C	S	.	.	H	α-helix	trans	-72.5	-33.8	173.4	-56.8	-162.9	178.9	0	0	111.8	R309 A310 S313 S321 D322 T327 V328	R309-E324 IonicContact CZ-OE1 3.27Å; R309-E324 IonicContact CZ-OE2 2.74Å; R309-E324 VanDerWaalsContact CZ-OE2 3.29Å; R309-E324 IonicContact NE-OE2 2.64Å; R309-E324 IonicContact NH1-OE1 2.79Å; R309-E324 PolarHBondContact NH1-OE1 3.03Å; R309-E324 IonicContact NH1-OE2 3.69Å; R309-E324 PolarHBondContact NH1-OE2 2.84Å; R309-E324 VanDerWaalsContact NH1-OE2 3.08Å; R309-E324 IonicContact NH2-OE1 2.71Å; R309-E324 PolarHBondContact NH2-OE1 3.17Å; R309-E324 IonicContact NH2-OE2 3.33Å; A310-E324 HydrophobicContact CB-CB 3.91Å; S313-E324 WeakPolarHBondContact CB-OE2 3.34Å; S313-E324 VanDerWaalsContact OG-CD 3.24Å; S313-E324 PolarHBondContact OG-OE1 3.36Å; S313-E324 PolarHBondContact OG-OE2 3.23Å; S321-E324 WeakPolarHBondContact O-CB 3.45Å; S321-E324 PolarHBondContact O-N 2.99Å; D322-E324 VanDerWaalsContact C-N 3.25Å; D322-E324 PolarHBondContact O-N 2.76Å; E324-T327 WeakPolarHBondContact O-CB 3.37Å; E324-T327 PolarHBondContact O-N 3.07Å; E324-V328 PolarHBondContact O-N 2.9Å
325	V	69.7	Low	72.1	Confident	33 Å²	33	72.2 Å²	72.2	20%	0.2	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-45	171.9	178.5	0	0	0	0	110.4	A310 S321 D322 T327 V328 E329	A310-V325 HydrophobicContact CB-CG2 4.48Å; S321-V325 PolarHBondContact O-N 3.44Å; D322-V325 WeakPolarHBondContact O-CB 3.47Å; D322-V325 PolarHBondContact O-N 3.26Å; V325-T327 PolarHBondContact O-N 3.46Å; V325-V328 WeakPolarHBondContact O-CA 3.39Å; V325-V328 WeakPolarHBondContact O-CB 3.5Å; V325-V328 PolarHBondContact O-N 3.02Å; V325-E329 PolarHBondContact O-N 2.86Å
326	S	72.4	Confident	72.4	Confident	62 Å²	62	69.5 Å²	69.5	43%	0.434	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-27.3	174	-59.6	0	0	0	0	113.6	D322 E329 F330	D322-S326 PolarHBondContact O-N 3.49Å; S326-E329 WeakPolarHBondContact CA-OE2 3.43Å; S326-E329 PolarHBondContact O-N 3Å; S326-F330 PolarHBondContact O-N 3.46Å; S326-F330 VanDerWaalsContact O-N 3.17Å
327	T	73.3	Confident	72.3	Confident	75 Å²	75	70 Å²	70	46%	0.46	37%	0.368	S	S	.	.	H	α-helix	trans	-68	-39.8	170.9	-53.6	0	0	0	0	111	L323 E324 V325 E329 F330 E331	L323-T327 PolarHBondContact O-N 2.71Å; L323-T327 PolarHBondContact O-OG1 3.42Å; E324-T327 WeakPolarHBondContact O-CB 3.37Å; E324-T327 PolarHBondContact O-N 3.07Å; V325-T327 PolarHBondContact O-N 3.46Å; T327-E329 VanDerWaalsContact C-N 3.33Å; T327-E329 PolarHBondContact O-N 2.99Å; T327-F330 PolarHBondContact O-N 3.23Å; T327-E331 WeakPolarHBondContact O-CG 3.39Å; T327-E331 PolarHBondContact O-N 3.38Å
328	V	69.4	Low	72.2	Confident	28 Å²	28	68.3 Å²	68.3	17%	0.17	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-37.8	173.6	168.6	0	0	0	0	112	A306 V307 A310 E324 V325 E331 N332	A306-V328 VanDerWaalsContact C-CG2 3.41Å; A306-V328 HydrophobicContact CB-CG2 3.85Å; A306-V328 WeakPolarHBondContact O-CG2 3.29Å; V307-V328 HydrophobicContact CG2-CG1 3.6Å; V307-V328 HydrophobicContact CG2-CG2 4.4Å; A310-V328 HydrophobicContact CB-CG2 3.64Å; E324-V328 PolarHBondContact O-N 2.9Å; V325-V328 WeakPolarHBondContact O-CA 3.39Å; V325-V328 WeakPolarHBondContact O-CB 3.5Å; V325-V328 PolarHBondContact O-N 3.02Å; V328-E331 PolarHBondContact O-N 3.15Å; V328-N332 VanDerWaalsContact O-CB 3.29Å; V328-N332 WeakPolarHBondContact O-CB 3.42Å; V328-N332 PolarHBondContact O-N 3.17Å
329	E	69.5	Low	71.6	Confident	72 Å²	72	65.3 Å²	65.3	34%	0.336	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-42.8	175.5	-69.3	164.9	176.2	0	0	111.7	V325 S326 T327 L333	V325-E329 PolarHBondContact O-N 2.86Å; S326-E329 WeakPolarHBondContact CA-OE2 3.43Å; S326-E329 PolarHBondContact O-N 3Å; T327-E329 VanDerWaalsContact C-N 3.33Å; T327-E329 PolarHBondContact O-N 2.99Å; E329-L333 PolarHBondContact O-N 3.05Å; E329-L333 VanDerWaalsContact O-N 3.1Å
330	F	73.4	Confident	70.8	Confident	131 Å²	131	63.3 Å²	63.3	58%	0.575	32%	0.316	S	S	*	.	H	α-helix	trans	-63.2	-48.7	173.9	177.2	-93.5	0	0	0	112.5	S326 T327 N332 L333 Y334	S326-F330 PolarHBondContact O-N 3.46Å; S326-F330 VanDerWaalsContact O-N 3.17Å; T327-F330 PolarHBondContact O-N 3.23Å; F330-N332 VanDerWaalsContact C-N 3.31Å; F330-N332 PolarHBondContact O-N 3.37Å; F330-L333 PolarHBondContact O-N 3.01Å; F330-Y334 PolarHBondContact O-N 3.04Å
331	E	71.5	Confident	70.4	Confident	43 Å²	43	65.1 Å²	65.1	20%	0.201	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-37	178.7	-71.7	-62.7	163.8	0	0	112.1	V302 A306 T327 V328 Y334 C335	V302-E331 HydrophobicContact CG1-CG 4.33Å; V302-E331 WeakPolarHBondContact CG1-OE2 3.44Å; A306-E331 HydrophobicContact CB-CG 4.39Å; T327-E331 WeakPolarHBondContact O-CG 3.39Å; T327-E331 PolarHBondContact O-N 3.38Å; V328-E331 PolarHBondContact O-N 3.15Å; E331-Y334 PolarHBondContact O-N 3.44Å; E331-C335 WeakPolarHBondContact O-CB 3.17Å; E331-C335 PolarHBondContact O-N 2.84Å; E331-C335 PolarHBondContact O-SG 2.99Å
332	N	66.5	Low	70.3	Confident	19 Å²	19	64.3 Å²	64.3	10%	0.102	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-51.2	173.4	-174.8	25.6	0	0	0	110.6	V328 F330 Y334 C335 L336	V328-N332 VanDerWaalsContact O-CB 3.29Å; V328-N332 WeakPolarHBondContact O-CB 3.42Å; V328-N332 PolarHBondContact O-N 3.17Å; F330-N332 VanDerWaalsContact C-N 3.31Å; F330-N332 PolarHBondContact O-N 3.37Å; N332-Y334 VanDerWaalsContact C-N 3.31Å; N332-Y334 PolarHBondContact O-N 2.89Å; N332-C335 WeakPolarHBondContact O-CB 3.22Å; N332-C335 PolarHBondContact O-N 3.38Å; N332-C335 VanDerWaalsContact O-N 3.14Å; N332-L336 WeakPolarHBondContact O-CG 3.42Å; N332-L336 PolarHBondContact O-N 2.62Å
333	L	68.6	Low	69.8	Low	87 Å²	87	65.6 Å²	65.6	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-58.2	-41.9	177.1	-172.5	70.5	0	0	0	112.2	E329 F330 L336 M337	E329-L333 PolarHBondContact O-N 3.05Å; E329-L333 VanDerWaalsContact O-N 3.1Å; F330-L333 PolarHBondContact O-N 3.01Å; L333-L336 WeakPolarHBondContact O-CB 3.3Å; L333-L336 PolarHBondContact O-N 2.86Å; L333-M337 WeakPolarHBondContact O-CG 3.39Å; L333-M337 PolarHBondContact O-N 2.83Å; L333-M337 VanDerWaalsContact O-N 3.13Å
334	Y	73.5	Confident	69.3	Low	112 Å²	112	65.3 Å²	65.3	44%	0.439	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-46.1	175.4	-179.2	-101.3	0	0	0	111.7	F330 E331 N332 L336 M337 I338	F330-Y334 PolarHBondContact O-N 3.04Å; E331-Y334 PolarHBondContact O-N 3.44Å; N332-Y334 VanDerWaalsContact C-N 3.31Å; N332-Y334 PolarHBondContact O-N 2.89Å; Y334-L336 PolarHBondContact O-N 3.24Å; Y334-M337 WeakPolarHBondContact O-CB 3.47Å; Y334-M337 PolarHBondContact O-N 3.15Å; Y334-M337 VanDerWaalsContact O-N 3.15Å; Y334-I338 HydrophobicContact CD1-CG1 4.19Å; Y334-I338 HydrophobicContact CE1-CD1 4.25Å; Y334-I338 HydrophobicContact CE1-CG1 3.73Å; Y334-I338 HydrophobicContact CE2-CD1 4.39Å; Y334-I338 HydrophobicContact CE2-CG1 4.43Å; Y334-I338 PolarHBondContact O-N 2.84Å
335	C	67.2	Low	69.5	Low	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-48.4	174.1	-67.1	0	0	0	0	111.3	S299 M303 E331 N332 M337 I338 F339	S299-C335 PolarHBondContact O-SG 2.71Å; M303-C335 HydrophobicContact CE-CB 3.34Å; M303-C335 VanDerWaalsContact CE-SG 3.52Å; E331-C335 WeakPolarHBondContact O-CB 3.17Å; E331-C335 PolarHBondContact O-N 2.84Å; E331-C335 PolarHBondContact O-SG 2.99Å; N332-C335 WeakPolarHBondContact O-CB 3.22Å; N332-C335 PolarHBondContact O-N 3.38Å; N332-C335 VanDerWaalsContact O-N 3.14Å; C335-M337 PolarHBondContact O-N 3.48Å; C335-I338 PolarHBondContact O-N 2.89Å; C335-F339 HydrophobicContact CB-CD2 4.37Å; C335-F339 HydrophobicContact CB-CE2 4.46Å; C335-F339 WeakPolarHBondContact O-CD2 3.25Å; C335-F339 PolarHBondContact O-N 3.42Å
336	L	63.1	Low	69.3	Low	18 Å²	18	64.1 Å²	64.1	9%	0.094	30%	0.302	C	S	.	.	H	α-helix	trans	-52.7	-40.7	177.2	-60.2	-169.9	0	0	0	112.3	S256 G265 A266 N332 L333 Y334 R340	S256-L336 WeakPolarHBondContact OG-CD1 3.37Å; G265-L336 WeakPolarHBondContact O-CD2 3.49Å; A266-L336 HydrophobicContact CB-CD2 4.36Å; N332-L336 WeakPolarHBondContact O-CG 3.42Å; N332-L336 PolarHBondContact O-N 2.62Å; L333-L336 WeakPolarHBondContact O-CB 3.3Å; L333-L336 PolarHBondContact O-N 2.86Å; Y334-L336 PolarHBondContact O-N 3.24Å; L336-R340 VanDerWaalsContact O-CB 3.3Å; L336-R340 WeakPolarHBondContact O-CB 3.27Å; L336-R340 PolarHBondContact O-N 3.17Å
337	M	71	Confident	69	Low	123 Å²	123	66.9 Å²	66.9	61%	0.606	30%	0.304	S	S	*	.	H	α-helix	trans	-65.8	-46.4	176.4	-67.5	177.3	62	0	0	111.9	L333 Y334 C335 R340 Y341	L333-M337 WeakPolarHBondContact O-CG 3.39Å; L333-M337 PolarHBondContact O-N 2.83Å; L333-M337 VanDerWaalsContact O-N 3.13Å; Y334-M337 WeakPolarHBondContact O-CB 3.47Å; Y334-M337 PolarHBondContact O-N 3.15Å; Y334-M337 VanDerWaalsContact O-N 3.15Å; C335-M337 PolarHBondContact O-N 3.48Å; M337-R340 PolarHBondContact O-N 3.42Å; M337-Y341 WeakPolarHBondContact O-CB 3.38Å; M337-Y341 PolarHBondContact O-N 2.85Å
338	I	70.1	Confident	69	Low	27 Å²	27	65.7 Å²	65.7	14%	0.138	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-43.5	176.7	-63.7	-60.9	0	0	0	111.6	E295 V296 Y334 C335 Y341 T342	E295-I338 HydrophobicContact CB-CG2 4.49Å; V296-I338 HydrophobicContact CG2-CG2 4.32Å; Y334-I338 HydrophobicContact CD1-CG1 4.19Å; Y334-I338 HydrophobicContact CE1-CD1 4.25Å; Y334-I338 HydrophobicContact CE1-CG1 3.73Å; Y334-I338 HydrophobicContact CE2-CD1 4.39Å; Y334-I338 HydrophobicContact CE2-CG1 4.43Å; Y334-I338 PolarHBondContact O-N 2.84Å; C335-I338 PolarHBondContact O-N 2.89Å; I338-Y341 PolarHBondContact O-N 2.99Å; I338-T342 WeakPolarHBondContact O-CB 3.29Å; I338-T342 PolarHBondContact O-N 2.95Å; I338-T342 PolarHBondContact O-OG1 3.17Å
339	F	63.7	Low	69	Low	16 Å²	16	66.5 Å²	66.5	7%	0.07	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-49.2	176	-86.4	-77.6	0	0	0	112.1	V269 V296 I300 C335 T342 W343	V269-F339 HydrophobicContact CB-CE1 4.22Å; V269-F339 HydrophobicContact CB-CE2 4.12Å; V269-F339 HydrophobicContact CB-CZ 3.88Å; V269-F339 HydrophobicContact CG1-CE1 4.02Å; V269-F339 HydrophobicContact CG1-CE2 3.82Å; V269-F339 HydrophobicContact CG1-CZ 3.36Å; V269-F339 HydrophobicContact CG2-CD1 4.3Å; V269-F339 HydrophobicContact CG2-CD2 3.6Å; V269-F339 HydrophobicContact CG2-CE1 4.06Å; V269-F339 HydrophobicContact CG2-CE2 3.37Å; V269-F339 HydrophobicContact CG2-CG 4.1Å; V269-F339 HydrophobicContact CG2-CZ 3.63Å; V296-F339 HydrophobicContact CB-CE1 4.27Å; V296-F339 HydrophobicContact CB-CZ 4.32Å; V296-F339 HydrophobicContact CG1-CD1 4.38Å; V296-F339 HydrophobicContact CG1-CE1 3.43Å; V296-F339 VanDerWaalsContact CG1-CE1 3.43Å; V296-F339 HydrophobicContact CG1-CZ 3.5Å; V296-F339 HydrophobicContact CG2-CD1 4.08Å; V296-F339 HydrophobicContact CG2-CE1 3.92Å; V296-F339 HydrophobicContact CG2-CZ 4.27Å; I300-F339 HydrophobicContact CD1-CZ 3.91Å; I300-F339 HydrophobicContact CG1-CE2 4.1Å; I300-F339 HydrophobicContact CG1-CZ 3.68Å; C335-F339 HydrophobicContact CB-CD2 4.37Å; C335-F339 HydrophobicContact CB-CE2 4.46Å; C335-F339 WeakPolarHBondContact O-CD2 3.25Å; C335-F339 PolarHBondContact O-N 3.42Å; F339-T342 PolarHBondContact O-N 2.71Å; F339-W343 WeakPolarHBondContact O-CB 3.13Å; F339-W343 PolarHBondContact O-N 3.47Å
340	R	63.3	Low	68.7	Low	148 Å²	148	69 Å²	69	56%	0.558	31%	0.311	S	S	*	.	H	α-helix	trans	-63.3	-43.4	179.3	-177.2	175.4	177.5	172.5	-0	111.9	L336 M337 L344	L336-R340 VanDerWaalsContact O-CB 3.3Å; L336-R340 WeakPolarHBondContact O-CB 3.27Å; L336-R340 PolarHBondContact O-N 3.17Å; M337-R340 PolarHBondContact O-N 3.42Å; R340-L344 HydrophobicContact CG-CD1 4.12Å; R340-L344 WeakPolarHBondContact O-CB 3.43Å; R340-L344 VanDerWaalsContact O-CG 3.25Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.27Å
341	Y	73.2	Confident	68.6	Low	127 Å²	127	65.9 Å²	65.9	50%	0.498	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-39.9	178	177	-110.9	0	0	0	112.3	R292 M337 I338 T345	R292-Y341 VanDerWaalsContact NH2-CE1 3.25Å; R292-Y341 PolarHBondContact NH2-OH 3.44Å; M337-Y341 WeakPolarHBondContact O-CB 3.38Å; M337-Y341 PolarHBondContact O-N 2.85Å; I338-Y341 PolarHBondContact O-N 2.99Å; Y341-T345 WeakPolarHBondContact O-CB 3.48Å; Y341-T345 PolarHBondContact O-N 2.7Å; Y341-T345 PolarHBondContact O-OG1 2.89Å
342	T	69.5	Low	68.7	Low	1 Å²	1	69.3 Å²	69.3	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-49.5	173.8	-67.1	0	0	0	0	111.4	R292 V296 I338 F339 L344 T345 L346	R292-T342 HydrophobicContact CB-CG2 3.84Å; V296-T342 HydrophobicContact CG2-CG2 3.71Å; I338-T342 WeakPolarHBondContact O-CB 3.29Å; I338-T342 PolarHBondContact O-N 2.95Å; I338-T342 PolarHBondContact O-OG1 3.17Å; F339-T342 PolarHBondContact O-N 2.71Å; T342-L344 PolarHBondContact O-N 3.2Å; T342-T345 PolarHBondContact O-N 3.32Å; T342-L346 HydrophobicContact CG2-CD1 3.7Å; T342-L346 HydrophobicContact CG2-CG 4.24Å; T342-L346 WeakPolarHBondContact O-CB 3.41Å; T342-L346 WeakPolarHBondContact O-CG 3.21Å; T342-L346 PolarHBondContact O-N 2.96Å
343	W	64.1	Low	68.8	Low	124 Å²	124	73.9 Å²	73.9	47%	0.47	33%	0.334	S	S	.	.	H	α-helix	trans	-55.8	-48.9	175.9	178.3	-94.2	0	0	0	111.8	L272 F276 F339 T345 L346 Y347	L272-W343 HydrophobicContact CD2-CD2 4.09Å; L272-W343 HydrophobicContact CD2-CE3 3.22Å; L272-W343 HydrophobicContact CD2-CZ3 3.55Å; F276-W343 AromaticContact CE1-CE3 3.99Å; F276-W343 HydrophobicContact CE1-CE3 3.99Å; F276-W343 AromaticContact CE1-CZ3 3.98Å; F276-W343 HydrophobicContact CE1-CZ3 3.98Å; F276-W343 HydrophobicContact CE2-CE3 4.08Å; F276-W343 HydrophobicContact CE2-CZ3 4.45Å; F276-W343 AromaticContact CZ-CE3 3.4Å; F276-W343 HydrophobicContact CZ-CE3 3.4Å; F276-W343 VanDerWaalsContact CZ-CE3 3.4Å; F276-W343 AromaticContact CZ-CZ3 3.8Å; F276-W343 HydrophobicContact CZ-CZ3 3.8Å; F339-W343 WeakPolarHBondContact O-CB 3.13Å; F339-W343 PolarHBondContact O-N 3.47Å; W343-T345 VanDerWaalsContact C-N 3.34Å; W343-T345 PolarHBondContact O-N 2.82Å; W343-L346 PolarHBondContact O-N 3.45Å; W343-Y347 WeakPolarHBondContact O-CB 3.34Å; W343-Y347 PolarHBondContact O-N 3.01Å
344	L	71.7	Confident	68.6	Low	95 Å²	95	78 Å²	78	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-62.4	-40	177.8	-71.9	170.2	0	0	0	112.2	R340 T342 A348	R340-L344 HydrophobicContact CG-CD1 4.12Å; R340-L344 WeakPolarHBondContact O-CB 3.43Å; R340-L344 VanDerWaalsContact O-CG 3.25Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.27Å; T342-L344 PolarHBondContact O-N 3.2Å; L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.46Å; L344-A348 PolarHBondContact O-N 2.81Å
345	T	74.3	Confident	68.6	Low	29 Å²	29	82 Å²	82	18%	0.178	36%	0.358	C	S	.	.	H	α-helix	trans	-65.9	-49.5	177.3	-57	0	0	0	0	111.4	R292 Y341 T342 W343 Y347 A348 L349	R292-T345 PolarHBondContact NH2-OG1 3.45Å; Y341-T345 WeakPolarHBondContact O-CB 3.48Å; Y341-T345 PolarHBondContact O-N 2.7Å; Y341-T345 PolarHBondContact O-OG1 2.89Å; T342-T345 PolarHBondContact O-N 3.32Å; W343-T345 VanDerWaalsContact C-N 3.34Å; W343-T345 PolarHBondContact O-N 2.82Å; T345-Y347 VanDerWaalsContact C-N 3.33Å; T345-Y347 PolarHBondContact O-N 3.45Å; T345-A348 PolarHBondContact O-N 2.88Å; T345-L349 HydrophobicContact CG2-CD1 4.02Å; T345-L349 HydrophobicContact CG2-CG 4.42Å; T345-L349 WeakPolarHBondContact O-CB 3.45Å; T345-L349 WeakPolarHBondContact O-CG 3.34Å; T345-L349 PolarHBondContact O-N 3.25Å
346	L	65.4	Low	68.7	Low	9 Å²	9	86.6 Å²	86.6	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-64.5	-38.1	-180	-67.1	174.8	0	0	0	111.5	F276 T289 R292 T342 W343 L349 Y350	F276-L346 HydrophobicContact CD1-CD1 4.27Å; F276-L346 HydrophobicContact CE1-CD1 3.51Å; F276-L346 HydrophobicContact CZ-CD1 3.74Å; T289-L346 HydrophobicContact CG2-CD2 4.12Å; R292-L346 HydrophobicContact CB-CD2 4.2Å; R292-L346 HydrophobicContact CB-CG 4.43Å; R292-L346 HydrophobicContact CG-CD2 4.28Å; T342-L346 HydrophobicContact CG2-CD1 3.7Å; T342-L346 HydrophobicContact CG2-CG 4.24Å; T342-L346 WeakPolarHBondContact O-CB 3.41Å; T342-L346 WeakPolarHBondContact O-CG 3.21Å; T342-L346 PolarHBondContact O-N 2.96Å; W343-L346 PolarHBondContact O-N 3.45Å; L346-L349 HydrophobicContact CD2-CD1 4.43Å; L346-L349 PolarHBondContact O-N 2.91Å; L346-Y350 WeakPolarHBondContact O-CB 3.4Å; L346-Y350 PolarHBondContact O-N 3.38Å
347	Y	66.2	Low	68.6	Low	121 Å²	121	88.6 Å²	88.6	48%	0.475	40%	0.4	S	S	.	.	H	α-helix	trans	-65.8	-41.5	174	-175.4	-107.7	0	0	0	112.5	W343 T345 Y350 L351	W343-Y347 WeakPolarHBondContact O-CB 3.34Å; W343-Y347 PolarHBondContact O-N 3.01Å; T345-Y347 VanDerWaalsContact C-N 3.33Å; T345-Y347 PolarHBondContact O-N 3.45Å; Y347-Y350 PolarHBondContact O-N 3.45Å; Y347-L351 HydrophobicContact CD1-CD1 4.04Å; Y347-L351 HydrophobicContact CE1-CD1 3.54Å; Y347-L351 HydrophobicContact CE1-CG 4.2Å; Y347-L351 WeakPolarHBondContact O-CG 3.3Å; Y347-L351 PolarHBondContact O-N 2.94Å
348	A	74.8	Confident	68.4	Low	50 Å²	50	84.2 Å²	84.2	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-42.5	174.2	0	0	0	0	0	111.9	L344 T345 L351 M352	L344-A348 VanDerWaalsContact O-CB 3.3Å; L344-A348 WeakPolarHBondContact O-CB 3.46Å; L344-A348 PolarHBondContact O-N 2.81Å; T345-A348 PolarHBondContact O-N 2.88Å; A348-L351 PolarHBondContact O-N 2.99Å; A348-M352 VanDerWaalsContact O-CG 3.23Å; A348-M352 WeakPolarHBondContact O-CG 3.36Å; A348-M352 PolarHBondContact O-N 3.42Å
349	L	69.4	Low	68.6	Low	44 Å²	44	85.5 Å²	85.5	23%	0.23	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-43.2	174	-73.7	169.9	0	0	0	111.7	F288 T345 L346 M352 R353	F288-L349 HydrophobicContact CB-CD1 4.36Å; T345-L349 HydrophobicContact CG2-CD1 4.02Å; T345-L349 HydrophobicContact CG2-CG 4.42Å; T345-L349 WeakPolarHBondContact O-CB 3.45Å; T345-L349 WeakPolarHBondContact O-CG 3.34Å; T345-L349 PolarHBondContact O-N 3.25Å; L346-L349 HydrophobicContact CD2-CD1 4.43Å; L346-L349 PolarHBondContact O-N 2.91Å; L349-M352 PolarHBondContact O-N 2.83Å; L349-R353 WeakPolarHBondContact O-CG 3.32Å; L349-R353 PolarHBondContact O-N 3.25Å
350	Y	63.7	Low	68.7	Low	124 Å²	124	86.1 Å²	86.1	49%	0.486	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-46.1	174.2	170.5	-105.8	0	0	0	112.2	L346 Y347 M352 R353 R354	L346-Y350 WeakPolarHBondContact O-CB 3.4Å; L346-Y350 PolarHBondContact O-N 3.38Å; Y347-Y350 PolarHBondContact O-N 3.45Å; Y350-M352 VanDerWaalsContact C-N 3.34Å; Y350-M352 PolarHBondContact O-N 2.93Å; Y350-R353 PolarHBondContact O-N 3.37Å; Y350-R354 WeakPolarHBondContact O-CB 3.42Å; Y350-R354 PolarHBondContact O-N 2.88Å
351	L	69.7	Low	68.9	Low	67 Å²	67	82.8 Å²	82.8	35%	0.351	41%	0.41	S	S	.	.	H	α-helix	trans	-62.8	-38.8	175.3	-70.5	178.1	0	0	0	112.4	Y347 A348 R355	Y347-L351 HydrophobicContact CD1-CD1 4.04Å; Y347-L351 HydrophobicContact CE1-CD1 3.54Å; Y347-L351 HydrophobicContact CE1-CG 4.2Å; Y347-L351 WeakPolarHBondContact O-CG 3.3Å; Y347-L351 PolarHBondContact O-N 2.94Å; A348-L351 PolarHBondContact O-N 2.99Å; L351-R355 WeakPolarHBondContact O-CG 3.42Å; L351-R355 PolarHBondContact O-N 3.33Å
352	M	74.9	Confident	69	Low	115 Å²	115	84 Å²	84	57%	0.567	42%	0.424	S	S	*	.	H	α-helix	trans	-67.4	-44.7	175.9	-67.2	-122.6	-88.7	0	0	111.8	A348 L349 Y350 R354 R355 I356	A348-M352 VanDerWaalsContact O-CG 3.23Å; A348-M352 WeakPolarHBondContact O-CG 3.36Å; A348-M352 PolarHBondContact O-N 3.42Å; L349-M352 PolarHBondContact O-N 2.83Å; Y350-M352 VanDerWaalsContact C-N 3.34Å; Y350-M352 PolarHBondContact O-N 2.93Å; M352-R354 VanDerWaalsContact C-N 3.33Å; M352-R354 PolarHBondContact O-N 3.12Å; M352-R355 WeakPolarHBondContact O-CB 3.23Å; M352-R355 PolarHBondContact O-N 3.42Å; M352-R355 VanDerWaalsContact O-N 3.12Å; M352-I356 WeakPolarHBondContact O-CG1 3.46Å; M352-I356 PolarHBondContact O-N 2.89Å
353	R	67.1	Low	69.3	Low	115 Å²	115	86.5 Å²	86.5	43%	0.434	45%	0.445	S	S	.	.	H	α-helix	trans	-59.1	-42.7	174	-74.9	-176.2	-177.9	167.5	9.7	111.9	D286 L349 Y350 R355 I356 A357	D286-R353 IonicContact OD1-NH2 2.7Å; D286-R353 PolarHBondContact OD1-NH2 3.44Å; D286-R353 IonicContact OD2-CZ 3.91Å; D286-R353 IonicContact OD2-NH1 2.78Å; D286-R353 PolarHBondContact OD2-NH1 3.01Å; D286-R353 IonicContact OD2-NH2 3.08Å; D286-R353 PolarHBondContact OD2-NH2 3.35Å; L349-R353 WeakPolarHBondContact O-CG 3.32Å; L349-R353 PolarHBondContact O-N 3.25Å; Y350-R353 PolarHBondContact O-N 3.37Å; R353-R355 VanDerWaalsContact C-N 3.34Å; R353-R355 PolarHBondContact O-N 2.91Å; R353-I356 PolarHBondContact O-N 3.31Å; R353-A357 WeakPolarHBondContact O-CB 3.42Å; R353-A357 PolarHBondContact O-N 2.84Å
354	R	65.8	Low	69.5	Low	172 Å²	172	88.1 Å²	88.1	65%	0.649	46%	0.463	S	S	*	.	H	α-helix	trans	-63.3	-36.8	174.7	-177.2	176.1	166.3	-174.8	-4.4	112.6	Y350 M352 G358	Y350-R354 WeakPolarHBondContact O-CB 3.42Å; Y350-R354 PolarHBondContact O-N 2.88Å; M352-R354 VanDerWaalsContact C-N 3.33Å; M352-R354 PolarHBondContact O-N 3.12Å; R354-G358 PolarHBondContact O-N 3.31Å
355	R	72.9	Confident	68.9	Low	196 Å²	196	85.1 Å²	85.1	74%	0.74	46%	0.455	S	S	*	.	H	α-helix	trans	-66.9	-44.7	173.3	-76.6	177.5	173.4	-171.7	-2.3	112.2	L351 M352 R353 G358 A359	L351-R355 WeakPolarHBondContact O-CG 3.42Å; L351-R355 PolarHBondContact O-N 3.33Å; M352-R355 WeakPolarHBondContact O-CB 3.23Å; M352-R355 PolarHBondContact O-N 3.42Å; M352-R355 VanDerWaalsContact O-N 3.12Å; R353-R355 VanDerWaalsContact C-N 3.34Å; R353-R355 PolarHBondContact O-N 2.91Å; R355-G358 PolarHBondContact O-N 3.45Å; R355-A359 PolarHBondContact O-N 3.25Å
356	I	68.9	Low	68.1	Low	97 Å²	97	92.4 Å²	92.4	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-62.9	-48.8	177.4	-66.4	163.9	0	0	0	110.2	M352 R353 G358 A359 V360	M352-I356 WeakPolarHBondContact O-CG1 3.46Å; M352-I356 PolarHBondContact O-N 2.89Å; R353-I356 PolarHBondContact O-N 3.31Å; I356-G358 VanDerWaalsContact C-N 3.29Å; I356-G358 PolarHBondContact O-N 3.02Å; I356-A359 PolarHBondContact O-N 3.04Å; I356-A359 VanDerWaalsContact O-N 3.09Å; I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 WeakPolarHBondContact O-CG2 3.33Å; I356-V360 PolarHBondContact O-N 3.42Å
357	A	61.3	Low	67.5	Low	60 Å²	60	95.5 Å²	95.5	50%	0.496	50%	0.501	S	S	.	.	H	α-helix	trans	-58.8	-40	176.2	0	0	0	0	0	112.2	R353 V360 A361	R353-A357 WeakPolarHBondContact O-CB 3.42Å; R353-A357 PolarHBondContact O-N 2.84Å; A357-V360 PolarHBondContact O-N 3.2Å; A357-A361 WeakPolarHBondContact O-CB 3.35Å; A357-A361 PolarHBondContact O-N 3.09Å
358	G	67.4	Low	66.8	Low	31 Å²	31	97.3 Å²	97.3	32%	0.32	52%	0.517	S	S	.	.	H	α-helix	trans	-62.2	-43.2	172.6	0	0	0	0	0	113.1	R354 R355 I356 A361 I362	R354-G358 PolarHBondContact O-N 3.31Å; R355-G358 PolarHBondContact O-N 3.45Å; I356-G358 VanDerWaalsContact C-N 3.29Å; I356-G358 PolarHBondContact O-N 3.02Å; G358-A361 PolarHBondContact O-N 2.94Å; G358-I362 WeakPolarHBondContact O-CD1 3.24Å; G358-I362 VanDerWaalsContact O-CG1 3.24Å; G358-I362 WeakPolarHBondContact O-CG1 3.43Å; G358-I362 PolarHBondContact O-N 3.34Å
359	A	73	Confident	65.5	Low	55 Å²	55	100.6 Å²	100.6	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-65.9	-42.1	176.9	0	0	0	0	0	112.6	R355 I356 I362 A363	R355-A359 PolarHBondContact O-N 3.25Å; I356-A359 PolarHBondContact O-N 3.04Å; I356-A359 VanDerWaalsContact O-N 3.09Å; A359-I362 PolarHBondContact O-N 2.94Å; A359-A363 VanDerWaalsContact O-CB 3.29Å; A359-A363 WeakPolarHBondContact O-CB 3.25Å; A359-A363 PolarHBondContact O-N 3.44Å
360	V	66	Low	64.1	Low	29 Å²	29	100.4 Å²	100.4	18%	0.176	54%	0.535	C	S	.	.	H	α-helix	trans	-63.7	-40.7	175.5	170.6	0	0	0	0	111.3	I356 A357 A363 N364 G365 Y366	I356-V360 HydrophobicContact CG2-CG2 4.32Å; I356-V360 WeakPolarHBondContact O-CG2 3.33Å; I356-V360 PolarHBondContact O-N 3.42Å; A357-V360 PolarHBondContact O-N 3.2Å; V360-A363 PolarHBondContact O-N 3.49Å; V360-N364 PolarHBondContact O-N 2.88Å; V360-G365 WeakPolarHBondContact CA-O 3.48Å; V360-G365 PolarHBondContact O-N 3.45Å; V360-G365 VanDerWaalsContact O-O 3.11Å; V360-Y366 HydrophobicContact CG1-CD2 4.01Å; V360-Y366 HydrophobicContact CG1-CE2 4.03Å; V360-Y366 HydrophobicContact CG1-CG 4.4Å; V360-Y366 HydrophobicContact CG2-CD1 3.76Å; V360-Y366 HydrophobicContact CG2-CD2 4.4Å; V360-Y366 HydrophobicContact CG2-CE1 3.76Å; V360-Y366 HydrophobicContact CG2-CE2 4.39Å; V360-Y366 HydrophobicContact CG2-CG 4.1Å
361	A	68.2	Low	63	Low	77 Å²	77	101 Å²	101	64%	0.636	55%	0.553	S	S	*	*	H	α-helix	trans	-65.5	-41.5	175.4	0	0	0	0	0	112.4	A357 G358 N364	A357-A361 WeakPolarHBondContact O-CB 3.35Å; A357-A361 PolarHBondContact O-N 3.09Å; G358-A361 PolarHBondContact O-N 2.94Å; A361-N364 PolarHBondContact O-N 3Å
362	I	75.8	Confident	61.6	Low	153 Å²	153	105.8 Å²	105.8	79%	0.785	58%	0.579	S	S	*	*	H	α-helix	trans	-66.7	-38	176	-69.4	164	0	0	0	111.4	G358 A359 N364	G358-I362 WeakPolarHBondContact O-CD1 3.24Å; G358-I362 VanDerWaalsContact O-CG1 3.24Å; G358-I362 WeakPolarHBondContact O-CG1 3.43Å; G358-I362 PolarHBondContact O-N 3.34Å; A359-I362 PolarHBondContact O-N 2.94Å; I362-N364 PolarHBondContact O-N 2.68Å
363	A	75.1	Confident	59.8	Low	54 Å²	54	105 Å²	105	45%	0.446	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	0.5	178.8	0	0	0	0	0	114.1	A359 V360 G365	A359-A363 VanDerWaalsContact O-CB 3.29Å; A359-A363 WeakPolarHBondContact O-CB 3.25Å; A359-A363 PolarHBondContact O-N 3.44Å; V360-A363 PolarHBondContact O-N 3.49Å; A363-G365 WeakPolarHBondContact CB-O 3.48Å; A363-G365 PolarHBondContact O-N 3.07Å
364	N	68.5	Low	58.2	Low	158 Å²	158	109.7 Å²	109.7	85%	0.845	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.7	36.8	-174.8	-164.1	39	0	0	0	113.4	V360 A361 I362	V360-N364 PolarHBondContact O-N 2.88Å; A361-N364 PolarHBondContact O-N 3Å; I362-N364 PolarHBondContact O-N 2.68Å
365	G	57.7	Low	56.8	Low	32 Å²	32	105.9 Å²	105.9	33%	0.33	59%	0.589	S	S	.	*	S	Bend	trans	149.7	173.7	-172.2	0	0	0	0	0	111.5	V360 A363 P367	V360-G365 WeakPolarHBondContact CA-O 3.48Å; V360-G365 PolarHBondContact O-N 3.45Å; V360-G365 VanDerWaalsContact O-O 3.11Å; A363-G365 WeakPolarHBondContact CB-O 3.48Å; A363-G365 PolarHBondContact O-N 3.07Å; G365-P367 WeakPolarHBondContact O-CD 3.3Å
366	Y	58	Low	54.9	Low	181 Å²	181	112.5 Å²	112.5	71%	0.71	62%	0.615	S	S	*	*			trans	-71.5	121.1	169.1	-81.2	-95.3	0	0	0	108.8	V360 I368	V360-Y366 HydrophobicContact CG1-CD2 4.01Å; V360-Y366 HydrophobicContact CG1-CE2 4.03Å; V360-Y366 HydrophobicContact CG1-CG 4.4Å; V360-Y366 HydrophobicContact CG2-CD1 3.76Å; V360-Y366 HydrophobicContact CG2-CD2 4.4Å; V360-Y366 HydrophobicContact CG2-CE1 3.76Å; V360-Y366 HydrophobicContact CG2-CE2 4.39Å; V360-Y366 HydrophobicContact CG2-CG 4.1Å; Y366-I368 PolarHBondContact O-N 2.86Å; Y366-I368 VanDerWaalsContact O-N 3.11Å
367	P	53.5	Low	54.2	Low	74 Å²	74	113.3 Å²	113.3	48%	0.481	62%	0.62	S	S	.	*			trans	-61.6	119.1	165.5	26.5	-31.5	0	0	0	107.3	G365 V369	G365-P367 WeakPolarHBondContact O-CD 3.3Å; P367-V369 PolarHBondContact O-N 3.11Å
368	I	50.5	Low	53.8	Low	159 Å²	159	116.1 Å²	116.1	82%	0.815	63%	0.627	S	S	*	*	S	Bend	trans	-60.5	-4.7	-174.4	-77.9	170.5	0	0	0	113.5	Y366 S370	Y366-I368 PolarHBondContact O-N 2.86Å; Y366-I368 VanDerWaalsContact O-N 3.11Å; I368-S370 PolarHBondContact O-N 2.9Å
369	V	47.3	Very low	53.1	Low	119 Å²	119	120.8 Å²	120.8	72%	0.721	64%	0.644	S	S	*	*			trans	-96.5	81.3	171.9	-165.3	0	0	0	0	109.7	P367	P367-V369 PolarHBondContact O-N 3.11Å
370	S	40.3	Very low	51.9	Low	41 Å²	41	124.6 Å²	124.6	29%	0.287	66%	0.655	S	S	.	*			trans	-63.6	133.9	168.3	159.3	0	0	0	0	109.8	I368 L372 E373	I368-S370 PolarHBondContact O-N 2.9Å; S370-L372 PolarHBondContact O-N 3.35Å; S370-E373 WeakPolarHBondContact CB-OE2 3.49Å; S370-E373 WeakPolarHBondContact O-CA 2.87Å; S370-E373 WeakPolarHBondContact O-CB 3.33Å; S370-E373 PolarHBondContact O-N 3.36Å; S370-E373 PolarHBondContact OG-OE2 2.95Å
371	P	40.9	Very low	51	Low	135 Å²	135	130.6 Å²	130.6	88%	0.877	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-12.7	-171.2	-24	34.7	0	0	0	115.7
372	L	39.9	Very low	49.9	Very low	169 Å²	169	134.2 Å²	134.2	89%	0.885	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	3.2	176.4	-68.9	166.2	0	0	0	112	S370	S370-L372 PolarHBondContact O-N 3.35Å
373	E	38.5	Very low	48	Very low	97 Å²	97	132.9 Å²	132.9	45%	0.453	68%	0.681	S	S	.	*			trans	-133.7	76.7	-155.3	-98.1	172	170.1	0	0	111.7	S370 N375	S370-E373 WeakPolarHBondContact CB-OE2 3.49Å; S370-E373 WeakPolarHBondContact O-CA 2.87Å; S370-E373 WeakPolarHBondContact O-CB 3.33Å; S370-E373 PolarHBondContact O-N 3.36Å; S370-E373 PolarHBondContact OG-OE2 2.95Å; E373-N375 HydrophobicContact CB-CB 4.32Å; E373-N375 VanDerWaalsContact CB-OD1 3.3Å; E373-N375 WeakPolarHBondContact CB-OD1 3.46Å; E373-N375 VanDerWaalsContact CG-OD1 3.25Å; E373-N375 WeakPolarHBondContact CG-OD1 3.29Å; E373-N375 PolarHBondContact O-ND2 2.92Å
374	K	32.2	Very low	46	Very low	214 Å²	214	138.9 Å²	138.9	93%	0.93	70%	0.7	S	S	*	*	S	Bend		-87	56.9	118.9	-69.9	-176.3	176.5	-177.2	0	106.7
375	N	37.5	Very low	44.1	Very low	92 Å²	92	137.3 Å²	137.3	49%	0.492	69%	0.687	S	S	.	*				57.6	92.3	96.1	-89.4	-36.8	0	0	0	106.9	E373	E373-N375 HydrophobicContact CB-CB 4.32Å; E373-N375 VanDerWaalsContact CB-OD1 3.3Å; E373-N375 WeakPolarHBondContact CB-OD1 3.46Å; E373-N375 VanDerWaalsContact CG-OD1 3.25Å; E373-N375 WeakPolarHBondContact CG-OD1 3.29Å; E373-N375 PolarHBondContact O-ND2 2.92Å
376	W	32.8	Very low	42.8	Very low	335 Å²	335	146.9 Å²	146.9	100%	1.269	72%	0.72	S	S	*	*			trans	-45.6	0	-171.3	-100.1	76.3	0	0	0	112.7

Retrieved 376 of 376 residues in 336.5 ms (Link to these results)

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