A0A087XEM4_POEFO Loading...

FAST kinase domains 2

AlphaFold DB , UniProt , Accession A0A087XEM4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 665 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	28.3	Very low	30.4	Very low	241 Å²	241	141.5 Å²	141.5	100%	1.187	71%	0.709	S	S	*	*				0	123.6	0	-140.2	163.6	178.4	0	0	106.5	I3	M1-I3 PolarHBondContact O-N 3.46Å
2	N	23.7	Very low	30.3	Very low	163 Å²	163	145.8 Å²	145.8	87%	0.872	71%	0.711	S	S	*	*			trans	-80.4	117	-135.6	-67.1	-20.8	0	0	0	115.5
3	I	36	Very low	30.5	Very low	157 Å²	157	139.9 Å²	139.9	81%	0.805	69%	0.693	S	S	*	*			trans	-68.3	129.3	141.5	-67.4	159.9	0	0	0	105.7	M1	M1-I3 PolarHBondContact O-N 3.46Å
4	W	24.2	Very low	30.7	Very low	232 Å²	232	135.9 Å²	135.9	88%	0.879	68%	0.675	S	S	*	*			trans	-178.9	132.4	157.4	-108	46.6	0	0	0	111
5	V	25.9	Very low	31	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.685	67%	0.672	S	S	*	*			trans	78.7	116.3	150.9	-175.8	0	0	0	0	116.1
6	T	30.6	Very low	31	Very low	68 Å²	68	137.1 Å²	137.1	42%	0.417	67%	0.67	S	S	.	*			cis	-163.3	110.1	15.5	34.1	0	0	0	0	110.5	D8 I9	T6-D8 HydrophobicContact CG2-CB 4.14Å; T6-I9 HydrophobicContact CG2-CG1 4.43Å; T6-I9 WeakPolarHBondContact OG1-CD1 3.45Å
7	N	29.7	Very low	30.7	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	66%	0.663	S	S	*	*	S	Bend	trans	-74.3	-7.4	150.9	-111.9	-41.4	0	0	0	110.8	I9 I10	N7-I9 VanDerWaalsContact C-N 3.31Å; N7-I9 PolarHBondContact O-N 3.29Å; N7-I10 PolarHBondContact O-N 3.21Å
8	D	30.4	Very low	30.7	Very low	108 Å²	108	130.3 Å²	130.3	58%	0.578	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-10.9	-175.9	-63.5	-54.9	0	0	0	115.3	T6 W12	T6-D8 HydrophobicContact CG2-CB 4.14Å; D8-W12 VanDerWaalsContact O-CD1 3.29Å
9	I	35.7	Very low	30.7	Very low	115 Å²	115	132.8 Å²	132.8	59%	0.59	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-26	177.7	-66.8	174.2	0	0	0	112.1	T6 N7 K11	T6-I9 HydrophobicContact CG2-CG1 4.43Å; T6-I9 WeakPolarHBondContact OG1-CD1 3.45Å; N7-I9 VanDerWaalsContact C-N 3.31Å; N7-I9 PolarHBondContact O-N 3.29Å; I9-K11 VanDerWaalsContact C-N 3.28Å; I9-K11 PolarHBondContact O-N 3.49Å
10	I	32.6	Very low	30.4	Very low	117 Å²	117	136.3 Å²	136.3	60%	0.6	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-23.2	-176.7	-66.5	168.7	0	0	0	111.7	N7	N7-I10 PolarHBondContact O-N 3.21Å
11	K	37.6	Very low	30.2	Very low	110 Å²	110	139.7 Å²	139.7	48%	0.478	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.1	-21.8	-172	-67.5	-178	176.8	-170.1	0	114.6	I9 S13 Q159 E163	I9-K11 VanDerWaalsContact C-N 3.28Å; I9-K11 PolarHBondContact O-N 3.49Å; K11-S13 PolarHBondContact O-N 3.47Å; K11-S13 VanDerWaalsContact O-N 3.12Å; K11-Q159 VanDerWaalsContact NZ-NE2 3.16Å; K11-E163 WeakPolarHBondContact CE-OE1 3.41Å; K11-E163 IonicContact NZ-OE1 3.31Å; K11-E163 PolarHBondContact NZ-OE1 3.41Å
12	W	29.5	Very low	30.1	Very low	193 Å²	193	132.2 Å²	132.2	73%	0.731	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-3.6	178.9	-100.1	73.8	0	0	0	114.6	D8 R15	D8-W12 VanDerWaalsContact O-CD1 3.29Å; W12-R15 WeakPolarHBondContact O-CD 3.4Å; W12-R15 WeakPolarHBondContact O-CG 3.44Å; W12-R15 PolarHBondContact O-NE 2.8Å
13	S	32.7	Very low	30.1	Very low	69 Å²	69	136.5 Å²	136.5	48%	0.483	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.8	17.1	-170.4	61.7	0	0	0	0	117.1	K11 R15	K11-S13 PolarHBondContact O-N 3.47Å; K11-S13 VanDerWaalsContact O-N 3.12Å; S13-R15 PolarHBondContact O-N 2.84Å; S13-R15 VanDerWaalsContact O-N 3.11Å
14	L	33.5	Very low	29.6	Very low	83 Å²	83	138.6 Å²	138.6	44%	0.435	65%	0.649	S	S	.	*	S	Bend	trans	-54.1	-13.2	141.6	-71.1	162.7	0	0	0	110.9	L158	L14-L158 HydrophobicContact CD2-CB 4.46Å
15	R	34.2	Very low	29.5	Very low	169 Å²	169	138.6 Å²	138.6	64%	0.638	65%	0.649	S	S	*	*			trans	14.6	102.1	161	-105.3	160.6	-139.2	-155.2	12.3	114.3	W12 S13	W12-R15 WeakPolarHBondContact O-CD 3.4Å; W12-R15 WeakPolarHBondContact O-CG 3.44Å; W12-R15 PolarHBondContact O-NE 2.8Å; S13-R15 PolarHBondContact O-N 2.84Å; S13-R15 VanDerWaalsContact O-N 3.11Å
16	L	31	Very low	29.4	Very low	122 Å²	122	139.9 Å²	139.9	64%	0.639	66%	0.657	S	S	*	*	S	Bend	trans	72.4	58.6	165.6	-59.9	154	0	0	0	112.9	C18 P22	L16-C18 PolarHBondContact O-N 3.45Å; L16-P22 HydrophobicContact CD1-CG 3.97Å; L16-P22 HydrophobicContact CD2-CG 4.3Å
17	C	26.8	Very low	29	Very low	81 Å²	81	142 Å²	142	55%	0.547	67%	0.674	S	S	.	*			trans	-2.8	116.2	144.9	-58.6	0	0	0	0	113.4	R19	C17-R19 PolarHBondContact O-N 3.36Å; C17-R19 VanDerWaalsContact O-N 3.1Å
18	C	30.3	Very low	28.5	Very low	72 Å²	72	143.2 Å²	143.2	49%	0.486	68%	0.679	S	S	.	*	S	Bend	trans	18.9	83.9	155.6	-61.6	0	0	0	0	115.5	L16 D151	L16-C18 PolarHBondContact O-N 3.45Å; C18-D151 PolarHBondContact SG-OD1 2.65Å
19	R	31.5	Very low	28.2	Very low	177 Å²	177	143.8 Å²	143.8	67%	0.668	69%	0.689	S	S	*	*	S	Bend	trans	65.9	99.9	167.7	-60.6	-172.9	176.6	-150.5	2	117.3	C17 L83 T85	C17-R19 PolarHBondContact O-N 3.36Å; C17-R19 VanDerWaalsContact O-N 3.1Å; R19-L83 PolarHBondContact NH2-O 3.31Å; R19-T85 PolarHBondContact NH2-OG1 3.22Å
20	R	23.8	Very low	27.5	Very low	202 Å²	202	144.9 Å²	144.9	76%	0.762	70%	0.701	S	S	*	*				-171	123.2	127.2	-101.1	169.2	-168.5	-169.9	5	108.4	P22	R20-P22 WeakPolarHBondContact O-CD 3.41Å
21	F	26.2	Very low	26.9	Very low	208 Å²	208	147.2 Å²	147.2	91%	0.912	71%	0.713	S	S	*	*			trans	-68.4	131	179.8	-74.2	-87.4	0	0	0	111.5
22	P	26.5	Very low	26.2	Very low	85 Å²	85	146.1 Å²	146.1	55%	0.552	73%	0.725	S	S	*	*			trans	-107.5	111.2	157.8	29.6	-14.5	0	0	0	109.3	L16 R20 K24	L16-P22 HydrophobicContact CD1-CG 3.97Å; L16-P22 HydrophobicContact CD2-CG 4.3Å; R20-P22 WeakPolarHBondContact O-CD 3.41Å; P22-K24 PolarHBondContact O-N 3.35Å
23	W	23.6	Very low	25.7	Very low	252 Å²	252	141.9 Å²	141.9	96%	0.955	73%	0.725	S	S	*	*			trans	-67.2	118.5	158.4	-90.7	32.2	0	0	0	108.4
24	K	25.3	Very low	25.2	Very low	201 Å²	201	146 Å²	146	87%	0.874	74%	0.74	S	S	*	*			trans	-122.6	121.3	158.7	-93.2	-171.4	175.3	-176.2	0	109.5	P22	P22-K24 PolarHBondContact O-N 3.35Å
25	R	22.1	Very low	24.7	Very low	233 Å²	233	150.5 Å²	150.5	88%	0.879	76%	0.756	S	S	*	*			trans	-56.5	129.3	170.3	-88.3	175.2	162.4	-177.2	-6	110.4
26	T	23	Very low	24	Very low	139 Å²	139	149.2 Å²	149.2	85%	0.853	76%	0.761	S	S	*	*			trans	-98.4	112.1	154.4	36	0	0	0	0	108.4
27	S	22.3	Very low	23.6	Very low	113 Å²	113	149.1 Å²	149.1	79%	0.79	77%	0.771	S	S	*	*			trans	-81.4	127.9	167	40.9	0	0	0	0	109.8
28	I	21	Very low	23.2	Very low	158 Å²	158	150.7 Å²	150.7	81%	0.81	78%	0.783	S	S	*	*			trans	-135.4	143.7	163.5	-65.7	-176.5	0	0	0	107.3
29	P	22.6	Very low	22.8	Very low	120 Å²	120	155.8 Å²	155.8	78%	0.779	80%	0.804	S	S	*	*			trans	-87	161.2	-154.2	8.4	8.9	0	0	0	114.5
30	V	20.9	Very low	22.2	Very low	139 Å²	139	152.3 Å²	152.3	84%	0.842	81%	0.807	S	S	*	*			trans	-77	134.7	170.3	171.8	0	0	0	0	110.3
31	L	21.5	Very low	22	Very low	165 Å²	165	153.4 Å²	153.4	86%	0.864	81%	0.811	S	S	*	*			trans	-146.4	128	142.3	-147.5	82	0	0	0	110
32	A	21.2	Very low	21.9	Very low	87 Å²	87	150.2 Å²	150.2	72%	0.719	80%	0.804	S	S	*	*			trans	19.4	150.4	146.1	0	0	0	0	0	119.9
33	S	20.4	Very low	21.6	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	82%	0.816	S	S	*	*			cis	178.7	170.8	1.7	167.6	0	0	0	0	104.4
34	I	22.3	Very low	21.5	Very low	156 Å²	156	147.8 Å²	147.8	80%	0.8	81%	0.814	S	S	*	*			trans	111.3	91.1	165.6	-56.2	159.1	0	0	0	112.2
35	K	21.5	Very low	21.3	Very low	177 Å²	177	143.3 Å²	143.3	77%	0.77	80%	0.803	S	S	*	*				89.8	107	76.9	-129.3	-179.4	-177.1	-174.3	0	113.1
36	D	20.6	Very low	21.4	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	80%	0.799	S	S	*	*			trans	49.4	112.3	142.8	-57	-22.5	0	0	0	121
37	S	21.9	Very low	21.3	Very low	120 Å²	120	137 Å²	137	84%	0.839	79%	0.792	S	S	*	*				-157.3	120.9	118.3	62.2	0	0	0	0	111.3
38	S	19.5	Very low	21.3	Very low	114 Å²	114	141.9 Å²	141.9	80%	0.797	79%	0.793	S	S	*	*			trans	-50.9	140.4	179.2	50.2	0	0	0	0	117.3
39	L	21.1	Very low	21.4	Very low	179 Å²	179	137.5 Å²	137.5	94%	0.937	79%	0.788	S	S	*	*			trans	-147	105	142.6	-94.9	165.1	0	0	0	109.6
40	S	19.1	Very low	21.3	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	79%	0.787	S	S	*	*			trans	-68.4	143.2	164.4	61.8	0	0	0	0	109.8
41	R	20.6	Very low	21.5	Very low	225 Å²	225	140.6 Å²	140.6	85%	0.849	79%	0.792	S	S	*	*				165.6	136.5	74.5	-126	179.6	166	172.4	-5.6	102.7
42	N	22.4	Very low	21.6	Very low	142 Å²	142	139 Å²	139	76%	0.759	78%	0.784	S	S	*	*				-157.1	126	50.9	-87.4	-21.8	0	0	0	108.1
43	G	20.6	Very low	21.7	Very low	77 Å²	77	142 Å²	142	79%	0.794	79%	0.787	S	S	*	*			trans	-91.5	126.5	179.6	0	0	0	0	0	112
44	F	21.2	Very low	21.8	Very low	209 Å²	209	145.4 Å²	145.4	92%	0.917	79%	0.792	S	S	*	*			trans	-89.2	107.9	156.9	-91.7	-88.7	0	0	0	108	G46	F44-G46 PolarHBondContact O-N 2.97Å
45	T	21.8	Very low	21.8	Very low	107 Å²	107	142.8 Å²	142.8	66%	0.656	79%	0.787	S	S	*	*			trans	-85.7	82.2	172.2	43.7	0	0	0	0	109.7	F47	T45-F47 PolarHBondContact O-N 3.22Å
46	G	23.3	Very low	21.8	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	79%	0.791	S	S	*	*			trans	-87.3	88.2	166.4	0	0	0	0	0	110.2	F44 W48	F44-G46 PolarHBondContact O-N 2.97Å; G46-W48 PolarHBondContact O-N 3.49Å
47	F	21.8	Very low	21.9	Very low	162 Å²	162	141.7 Å²	141.7	71%	0.711	80%	0.797	S	S	*	*			trans	-84.6	94	172.2	-141.6	-101.1	0	0	0	107.9	T45	T45-F47 PolarHBondContact O-N 3.22Å
48	W	22.4	Very low	22	Very low	216 Å²	216	140.6 Å²	140.6	82%	0.818	79%	0.79	S	S	*	*			trans	178.8	94.6	144.8	-104.4	53.4	0	0	0	106.8	G46	G46-W48 PolarHBondContact O-N 3.49Å
49	G	22.8	Very low	22.2	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	78%	0.782	S	S	*	*			trans	176.5	59	-175.4	0	0	0	0	0	108.3	R51	G49-R51 VanDerWaalsContact C-N 3.27Å; G49-R51 PolarHBondContact O-N 2.95Å
50	G	21.8	Very low	22.3	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	78%	0.778	S	S	*	*			trans	-60.5	94.2	174	0	0	0	0	0	109.1	L52	G50-L52 PolarHBondContact O-N 2.88Å
51	R	24.6	Very low	22.5	Very low	249 Å²	249	138.2 Å²	138.2	94%	0.94	78%	0.78	S	S	*	*			trans	-59.6	89	158.4	-74.5	-174.4	-171	-144.4	2.2	107.1	G49	G49-R51 VanDerWaalsContact C-N 3.27Å; G49-R51 PolarHBondContact O-N 2.95Å
52	L	23.4	Very low	22.6	Very low	133 Å²	133	132.2 Å²	132.2	70%	0.696	77%	0.772	S	S	*	*			trans	-81.8	125	149.2	-95.2	99.8	0	0	0	106.7	G50 Q54	G50-L52 PolarHBondContact O-N 2.88Å; L52-Q54 PolarHBondContact O-N 2.9Å
53	N	23	Very low	22.6	Very low	149 Å²	149	132.4 Å²	132.4	80%	0.797	78%	0.779	S	S	*	*			trans	-48.3	94.8	152.3	-84.2	-33.2	0	0	0	108.1	S55	N53-S55 VanDerWaalsContact C-N 3.33Å; N53-S55 PolarHBondContact O-N 3.48Å; N53-S55 VanDerWaalsContact O-N 3.07Å
54	Q	23	Very low	22.7	Very low	177 Å²	177	133.7 Å²	133.7	83%	0.827	77%	0.772	S	S	*	*			trans	-74.7	96	165.5	-79.4	-175.5	0.1	0	0	106.7	L52 C56	L52-Q54 PolarHBondContact O-N 2.9Å; Q54-C56 PolarHBondContact O-N 3.1Å
55	S	21.7	Very low	22.7	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	77%	0.769	S	S	*	*			trans	-53.2	118.1	150	42.9	0	0	0	0	107.2	N53 L57	N53-S55 VanDerWaalsContact C-N 3.33Å; N53-S55 PolarHBondContact O-N 3.48Å; N53-S55 VanDerWaalsContact O-N 3.07Å; S55-L57 PolarHBondContact O-N 3.41Å
56	C	22.6	Very low	22.8	Very low	127 Å²	127	138.5 Å²	138.5	86%	0.858	78%	0.777	S	S	*	*			trans	-58	104.9	167.6	-76.6	0	0	0	0	108.2	Q54 S58	Q54-C56 PolarHBondContact O-N 3.1Å; C56-S58 VanDerWaalsContact C-N 3.27Å; C56-S58 PolarHBondContact O-N 2.91Å
57	L	22.3	Very low	22.7	Very low	168 Å²	168	145.7 Å²	145.7	88%	0.88	78%	0.782	S	S	*	*			trans	-71	91.3	164	-77.9	165.6	0	0	0	107.4	S55 G59	S55-L57 PolarHBondContact O-N 3.41Å; L57-G59 PolarHBondContact O-N 2.67Å
58	S	23	Very low	22.7	Very low	98 Å²	98	143.9 Å²	143.9	69%	0.685	79%	0.789	S	S	*	*			trans	-61.7	122.8	163.5	-165.4	0	0	0	0	108	C56 T60	C56-S58 VanDerWaalsContact C-N 3.27Å; C56-S58 PolarHBondContact O-N 2.91Å; S58-T60 PolarHBondContact O-N 2.96Å
59	G	23.8	Very low	22.6	Very low	62 Å²	62	145.2 Å²	145.2	64%	0.639	80%	0.796	S	S	*	*			trans	-62.7	117.9	174.2	0	0	0	0	0	110.2	L57 L61	L57-G59 PolarHBondContact O-N 2.67Å; G59-L61 PolarHBondContact O-N 3.28Å
60	T	22.7	Very low	22.5	Very low	138 Å²	138	145.3 Å²	145.3	85%	0.847	80%	0.797	S	S	*	*			trans	-62.5	109.3	170.2	-43.4	0	0	0	0	108.9	S58 S62	S58-T60 PolarHBondContact O-N 2.96Å; T60-S62 PolarHBondContact O-N 3.35Å
61	L	23.2	Very low	22.4	Very low	146 Å²	146	149.8 Å²	149.8	76%	0.764	80%	0.798	S	S	*	*			trans	-77.5	108	162.6	-86.1	154.9	0	0	0	107	G59	G59-L61 PolarHBondContact O-N 3.28Å
62	S	23.4	Very low	22.3	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	79%	0.787	S	S	*	*			trans	-63.4	134.4	168.4	49	0	0	0	0	109.5	T60 T64	T60-S62 PolarHBondContact O-N 3.35Å; S62-T64 PolarHBondContact O-N 3.21Å
63	T	22.6	Very low	22.3	Very low	146 Å²	146	147.6 Å²	147.6	90%	0.896	79%	0.792	S	S	*	*			trans	-80.6	107.3	176.1	-0.9	0	0	0	0	107.7
64	T	22.5	Very low	22.3	Very low	105 Å²	105	147.9 Å²	147.9	64%	0.644	79%	0.793	S	S	*	*			trans	-105	112.6	167.7	-24.2	0	0	0	0	108.2	S62 F66	S62-T64 PolarHBondContact O-N 3.21Å; T64-F66 HydrophobicContact CG2-CD2 4.46Å; T64-F66 HydrophobicContact CG2-CE2 3.79Å; T64-F66 HydrophobicContact CG2-CZ 4.36Å
65	R	21.8	Very low	22.3	Very low	231 Å²	231	148.9 Å²	148.9	87%	0.872	80%	0.798	S	S	*	*			trans	-68.6	127.1	170.5	-74.9	175.9	177.3	158.9	-1.9	108.4
66	F	22.4	Very low	22.4	Very low	186 Å²	186	147.6 Å²	147.6	82%	0.816	80%	0.801	S	S	*	*			trans	-123.5	120	159.2	-77.7	-81.7	0	0	0	108.5	T64	T64-F66 HydrophobicContact CG2-CD2 4.46Å; T64-F66 HydrophobicContact CG2-CE2 3.79Å; T64-F66 HydrophobicContact CG2-CZ 4.36Å
67	Y	22.1	Very low	22.5	Very low	227 Å²	227	149.5 Å²	149.5	89%	0.89	80%	0.801	S	S	*	*			trans	-79.3	132.6	160.3	-87	-90.7	0	0	0	107.7
68	S	21.8	Very low	22.7	Very low	123 Å²	123	151.6 Å²	151.6	86%	0.86	80%	0.804	S	S	*	*			trans	-147.6	134.3	147.5	65.1	0	0	0	0	110.4
69	Y	20.1	Very low	22.7	Very low	245 Å²	245	154.3 Å²	154.3	96%	0.961	81%	0.81	S	S	*	*			trans	-99.6	142.5	177.7	-156.6	-93.4	0	0	0	106.9
70	G	20.6	Very low	22.7	Very low	68 Å²	68	155 Å²	155	70%	0.701	82%	0.817	S	S	*	*			trans	138.7	79	164.9	0	0	0	0	0	117.3
71	E	20.6	Very low	22.9	Very low	169 Å²	169	156.5 Å²	156.5	79%	0.79	82%	0.82	S	S	*	*			trans	11.9	117.2	137.1	-111.1	-174.8	-175.6	0	0	120.6
72	K	21.9	Very low	22.9	Very low	164 Å²	164	154.4 Å²	154.4	71%	0.713	82%	0.817	S	S	*	*				154.2	136.8	103.3	-92.5	177.3	-171.5	178.3	0	114.2
73	H	23.4	Very low	23.1	Very low	171 Å²	171	154.3 Å²	154.3	79%	0.792	81%	0.809	S	S	*	*			trans	75.7	106.5	158.1	-77.2	-68.7	0	0	0	122.4
74	N	22.3	Very low	23.2	Very low	156 Å²	156	150.6 Å²	150.6	83%	0.834	79%	0.792	S	S	*	*			trans	5.2	120.5	139.7	-84.2	-11.7	0	0	0	118.8
75	E	23.8	Very low	23.4	Very low	197 Å²	197	149.5 Å²	149.5	92%	0.921	79%	0.786	S	S	*	*				-162.2	138	107.1	-109.6	-180	178	0	0	109.9
76	G	24.2	Very low	23.6	Very low	74 Å²	74	146.9 Å²	146.9	76%	0.763	78%	0.783	S	S	*	*			trans	-89.3	125.7	-162	0	0	0	0	0	114.6
77	L	24.4	Very low	24.1	Very low	166 Å²	166	143.4 Å²	143.4	87%	0.869	77%	0.774	S	S	*	*			trans	-130	104.7	152.2	-133.8	83.6	0	0	0	107.3	D79	L77-D79 PolarHBondContact O-N 2.93Å
78	K	26.2	Very low	24.3	Very low	213 Å²	213	137.2 Å²	137.2	93%	0.926	76%	0.763	S	S	*	*			trans	-89.4	102.4	176	-90.3	-174.8	175.1	178.7	0	109.3	G80	K78-G80 PolarHBondContact O-N 3.28Å
79	D	23.5	Very low	24.7	Very low	155 Å²	155	137.8 Å²	137.8	83%	0.829	76%	0.756	S	S	*	*			trans	-67.7	108.9	160.3	-81.7	-32.9	0	0	0	110.1	L77	L77-D79 PolarHBondContact O-N 2.93Å
80	G	24.3	Very low	24.9	Very low	75 Å²	75	129.8 Å²	129.8	77%	0.773	74%	0.736	S	S	*	*			trans	-99	81.6	176.2	0	0	0	0	0	112	K78 S82	K78-G80 PolarHBondContact O-N 3.28Å; G80-S82 PolarHBondContact O-N 3.41Å
81	N	26.3	Very low	25.7	Very low	170 Å²	170	131.5 Å²	131.5	91%	0.909	73%	0.733	S	S	*	*			trans	-90.1	95.5	169.1	-104.4	-23.9	0	0	0	110.5
82	S	23.7	Very low	26.1	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	73%	0.729	S	S	*	*			trans	-148.7	107.2	163.6	53.5	0	0	0	0	110.1	G80 A84	G80-S82 PolarHBondContact O-N 3.41Å; S82-A84 PolarHBondContact O-N 3.49Å
83	L	27.6	Very low	26.5	Very low	98 Å²	98	130 Å²	130	51%	0.513	73%	0.732	S	S	.	*			trans	-67.3	73.4	164	-85.7	128.3	0	0	0	109.7	R19 N334 I335	R19-L83 PolarHBondContact NH2-O 3.31Å; L83-N334 HydrophobicContact CD1-CB 4.37Å; L83-N334 WeakPolarHBondContact CD1-ND2 3.29Å; L83-N334 WeakPolarHBondContact CD2-ND2 3.39Å; L83-I335 HydrophobicContact CD2-CD1 3.97Å
84	A	23.1	Very low	27.1	Very low	67 Å²	67	129 Å²	129	55%	0.554	73%	0.732	S	S	*	*			trans	-68.6	130.8	151.7	0	0	0	0	0	106.6	S82 E86	S82-A84 PolarHBondContact O-N 3.49Å; A84-E86 PolarHBondContact O-N 3.27Å
85	T	27.8	Very low	27.7	Very low	82 Å²	82	126.9 Å²	126.9	50%	0.503	72%	0.721	S	S	.	*			trans	-60.7	96.4	164	-52.4	0	0	0	0	106.1	R19 N87	R19-T85 PolarHBondContact NH2-OG1 3.22Å; T85-N87 PolarHBondContact O-N 3.4Å
86	E	24.9	Very low	28	Very low	176 Å²	176	126.5 Å²	126.5	82%	0.822	72%	0.716	S	S	*	*			trans	-67.2	79.4	172.7	-74.1	-171.7	160.9	0	0	108.3	A84 S88	A84-E86 PolarHBondContact O-N 3.27Å; E86-S88 PolarHBondContact O-N 3.48Å; E86-S88 VanDerWaalsContact O-N 3.1Å
87	N	34.4	Very low	28.3	Very low	114 Å²	114	129.4 Å²	129.4	61%	0.61	72%	0.72	S	S	*	*			trans	-77.8	74.8	157.4	-74	-1.9	0	0	0	106.7	T85 L89	T85-N87 PolarHBondContact O-N 3.4Å; N87-L89 PolarHBondContact O-N 2.82Å; N87-L89 VanDerWaalsContact O-N 3.1Å
88	S	24.9	Very low	28.5	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	72%	0.719	S	S	*	*			trans	-78.1	81.5	164.9	57.9	0	0	0	0	108.3	E86 S90	E86-S88 PolarHBondContact O-N 3.48Å; E86-S88 VanDerWaalsContact O-N 3.1Å; S88-S90 PolarHBondContact O-N 3.27Å; S88-S90 VanDerWaalsContact O-N 3.16Å
89	L	29.7	Very low	28.7	Very low	136 Å²	136	123.2 Å²	123.2	71%	0.712	71%	0.711	S	S	*	*			trans	-68.6	100.5	143.9	-82	158.7	0	0	0	104.5	N87 T91	N87-L89 PolarHBondContact O-N 2.82Å; N87-L89 VanDerWaalsContact O-N 3.1Å; L89-T91 PolarHBondContact O-N 3.01Å
90	S	26	Very low	29.1	Very low	77 Å²	77	124.9 Å²	124.9	54%	0.538	71%	0.714	S	S	.	*			trans	-49.7	126	174.5	31.4	0	0	0	0	109.2	S88 D92	S88-S90 PolarHBondContact O-N 3.27Å; S88-S90 VanDerWaalsContact O-N 3.16Å; S90-D92 PolarHBondContact O-N 2.65Å
91	T	36.2	Very low	29.3	Very low	104 Å²	104	129.1 Å²	129.1	64%	0.638	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-5.6	175.2	16.9	0	0	0	0	114.1	L89	L89-T91 PolarHBondContact O-N 3.01Å
92	D	29.9	Very low	29.9	Very low	133 Å²	133	127 Å²	127	71%	0.711	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-15.8	-175	-76.8	-18.7	0	0	0	114.6	S90	S90-D92 PolarHBondContact O-N 2.65Å
93	E	29.7	Very low	30.6	Very low	167 Å²	167	129.7 Å²	129.7	78%	0.78	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-88.1	-7.2	176.7	-71.1	-135.8	144.7	0	0	114.3	N95	E93-N95 PolarHBondContact O-N 3.16Å
94	L	37.2	Very low	31.3	Very low	151 Å²	151	136.8 Å²	136.8	79%	0.791	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-77.4	-6.1	177.8	-158.2	69	0	0	0	113.3
95	N	34.6	Very low	32.7	Very low	111 Å²	111	138 Å²	138	59%	0.594	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-125.1	12.5	-169.9	-63.6	-37.6	0	0	0	115.5	E93	E93-N95 PolarHBondContact O-N 3.16Å
96	K	29.3	Very low	34.7	Very low	190 Å²	190	136 Å²	136	83%	0.826	72%	0.724	S	S	*	*	S	Bend	trans	-131.1	46.1	-178.4	-88.8	-170.2	178.6	178.6	0	114.8
97	T	30.1	Very low	37.3	Very low	135 Å²	135	132.4 Å²	132.4	83%	0.828	72%	0.715	S	S	*	*	S	Bend	trans	-152.1	66.9	157.6	33.1	0	0	0	0	110.2
98	T	28.8	Very low	39.9	Very low	140 Å²	140	127.8 Å²	127.8	86%	0.859	69%	0.69	S	S	*	*			trans	-149	100.7	151.6	-29.6	0	0	0	0	107.1	E100	T98-E100 PolarHBondContact O-N 3.14Å
99	S	29.8	Very low	42.8	Very low	109 Å²	109	125.2 Å²	125.2	76%	0.762	67%	0.669	S	S	*	*			trans	-60.2	126.5	168.2	56.6	0	0	0	0	108.7
100	E	32.4	Very low	45.5	Very low	189 Å²	189	123.5 Å²	123.5	88%	0.883	66%	0.657	S	S	*	*	S	Bend	trans	50.2	72.5	148.2	-59.9	-177.7	173.2	0	0	116.8	T98	T98-E100 PolarHBondContact O-N 3.14Å
101	Q	29.3	Very low	48.6	Very low	165 Å²	165	123 Å²	123	77%	0.771	65%	0.648	S	S	*	*			trans	-150.2	105.9	145.3	-114.6	166.8	13.4	0	0	110.3	Q103	Q101-Q103 PolarHBondContact O-N 3.33Å
102	S	38.4	Very low	51.2	Low	126 Å²	126	118.4 Å²	118.4	88%	0.881	62%	0.619	S	S	*	*			trans	-49.7	98.4	168.3	156.6	0	0	0	0	110.8
103	Q	38.3	Very low	54	Low	158 Å²	158	120 Å²	120	74%	0.738	62%	0.615	S	S	*	*			trans	-109.2	112.7	168.3	-69.6	-171.3	2.8	0	0	109.1	Q101 T105	Q101-Q103 PolarHBondContact O-N 3.33Å; Q103-T105 PolarHBondContact O-N 3.15Å
104	R	42.7	Very low	56.9	Low	246 Å²	246	120.2 Å²	120.2	93%	0.928	61%	0.609	S	S	*	*			trans	-45.5	108.5	168.5	-80.9	175.9	169.8	172.7	-3.8	109.3	S106	R104-S106 PolarHBondContact O-N 3.23Å
105	T	52.9	Low	59.5	Low	93 Å²	93	113.5 Å²	113.5	57%	0.571	57%	0.574	S	S	*	*			trans	-62.1	121.2	175.7	-36.5	0	0	0	0	107.8	Q103 L109	Q103-T105 PolarHBondContact O-N 3.15Å; T105-L109 HydrophobicContact CG2-CB 4.06Å; T105-L109 HydrophobicContact CG2-CD1 4.23Å
106	S	68.4	Low	62.2	Low	40 Å²	40	112.1 Å²	112.1	28%	0.28	57%	0.574	S	S	.	*			trans	-58.4	139.7	-177.6	64.9	0	0	0	0	110.3	R104 F108 L109	R104-S106 PolarHBondContact O-N 3.23Å; S106-F108 PolarHBondContact O-N 3.17Å; S106-L109 WeakPolarHBondContact O-CB 3.41Å; S106-L109 PolarHBondContact O-N 2.88Å; S106-L109 WeakPolarHBondContact OG-CD1 3.43Å; S106-L109 VanDerWaalsContact OG-CG 3.26Å; S106-L109 WeakPolarHBondContact OG-CG 3.28Å
107	P	80.8	Confident	65.2	Low	100 Å²	100	103.6 Å²	103.6	65%	0.649	54%	0.538	S	S	*	.	H	α-helix	trans	-51.6	-33.6	-178.3	-28.3	33.8	0	0	0	114	L109 E110 L111	P107-L109 PolarHBondContact O-N 3.28Å; P107-E110 PolarHBondContact O-N 3.46Å; P107-L111 WeakPolarHBondContact O-CG 3.41Å; P107-L111 PolarHBondContact O-N 3.09Å; P107-L111 VanDerWaalsContact O-N 3.14Å
108	F	88.1	Confident	68.3	Low	17 Å²	17	97.1 Å²	97.1	8%	0.075	50%	0.498	C	S	.	.	H	α-helix	trans	-59	-41.9	175.2	179.7	-93.4	0	0	0	113.5	S106 E110 L111 L112 L124 Y128 P130 Q134	S106-F108 PolarHBondContact O-N 3.17Å; F108-E110 VanDerWaalsContact C-N 3.34Å; F108-E110 PolarHBondContact O-N 3.3Å; F108-L111 PolarHBondContact O-N 3.19Å; F108-L112 HydrophobicContact CE1-CB 4.46Å; F108-L112 HydrophobicContact CE1-CD2 4.17Å; F108-L112 WeakPolarHBondContact O-CB 3.39Å; F108-L112 PolarHBondContact O-N 3.21Å; F108-L124 HydrophobicContact CD2-CD2 4.2Å; F108-L124 HydrophobicContact CD2-CG 4.23Å; F108-L124 HydrophobicContact CE2-CD2 3.83Å; F108-L124 HydrophobicContact CE2-CG 3.79Å; F108-L124 HydrophobicContact CZ-CD2 4.15Å; F108-L124 HydrophobicContact CZ-CG 4.49Å; F108-Y128 HydrophobicContact CD2-CD2 4.48Å; F108-Y128 HydrophobicContact CD2-CG 4.23Å; F108-P130 HydrophobicContact CE1-CB 4.36Å; F108-P130 HydrophobicContact CZ-CB 3.96Å; F108-Q134 HydrophobicContact CD1-CB 4.35Å; F108-Q134 HydrophobicContact CD1-CG 4.01Å; F108-Q134 HydrophobicContact CE1-CB 3.9Å; F108-Q134 HydrophobicContact CE1-CG 4.07Å
109	L	85.6	Confident	71.4	Confident	43 Å²	43	91.2 Å²	91.2	23%	0.225	46%	0.462	C	S	.	.	H	α-helix	trans	-69	-34.8	-178.7	-72.4	174.5	0	0	0	112.2	T105 S106 P107 L112 R113 Q134	T105-L109 HydrophobicContact CG2-CB 4.06Å; T105-L109 HydrophobicContact CG2-CD1 4.23Å; S106-L109 WeakPolarHBondContact O-CB 3.41Å; S106-L109 PolarHBondContact O-N 2.88Å; S106-L109 WeakPolarHBondContact OG-CD1 3.43Å; S106-L109 VanDerWaalsContact OG-CG 3.26Å; S106-L109 WeakPolarHBondContact OG-CG 3.28Å; P107-L109 PolarHBondContact O-N 3.28Å; L109-L112 PolarHBondContact O-N 2.94Å; L109-R113 WeakPolarHBondContact O-CG 3.34Å; L109-R113 PolarHBondContact O-N 3.34Å; L109-Q134 HydrophobicContact CD2-CG 4.31Å
110	E	87.8	Confident	74.5	Confident	99 Å²	99	88.6 Å²	88.6	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-67.3	-43.3	175.2	-164.4	-175.7	161	0	0	110.8	P107 F108 R113 R114	P107-E110 PolarHBondContact O-N 3.46Å; F108-E110 VanDerWaalsContact C-N 3.34Å; F108-E110 PolarHBondContact O-N 3.3Å; E110-R113 PolarHBondContact O-N 3.29Å; E110-R114 WeakPolarHBondContact O-CG 3.29Å; E110-R114 PolarHBondContact O-N 3.27Å; E110-R114 IonicContact OE1-CZ 2.78Å; E110-R114 IonicContact OE1-NE 3.91Å; E110-R114 IonicContact OE1-NH2 2.65Å; E110-R114 PolarHBondContact OE1-NH2 3.47Å
111	L	89.9	Confident	77.5	Confident	66 Å²	66	79.6 Å²	79.6	35%	0.346	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-43.7	173.9	-67.7	172.4	0	0	0	111.8	P107 F108 R113 R114 C115 L124 Y128	P107-L111 WeakPolarHBondContact O-CG 3.41Å; P107-L111 PolarHBondContact O-N 3.09Å; P107-L111 VanDerWaalsContact O-N 3.14Å; F108-L111 PolarHBondContact O-N 3.19Å; L111-R113 VanDerWaalsContact C-N 3.28Å; L111-R113 PolarHBondContact O-N 2.93Å; L111-R114 WeakPolarHBondContact O-CB 3.47Å; L111-R114 PolarHBondContact O-N 3.41Å; L111-C115 PolarHBondContact O-N 2.97Å; L111-C115 PolarHBondContact O-SG 2.8Å; L111-L124 HydrophobicContact CB-CD1 3.77Å; L111-L124 HydrophobicContact CB-CD2 4.01Å; L111-L124 HydrophobicContact CD1-CD1 3.96Å; L111-L124 HydrophobicContact CG-CD1 4.48Å; L111-Y128 HydrophobicContact CD1-CE2 4.04Å
112	L	91.5	Very high	80.6	Confident	8 Å²	8	71.8 Å²	71.8	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-60.9	-36.9	177.6	-176.5	65.7	0	0	0	112	F108 L109 R114 C115 V121 L124 Q137 R141	F108-L112 HydrophobicContact CE1-CB 4.46Å; F108-L112 HydrophobicContact CE1-CD2 4.17Å; F108-L112 WeakPolarHBondContact O-CB 3.39Å; F108-L112 PolarHBondContact O-N 3.21Å; L109-L112 PolarHBondContact O-N 2.94Å; L112-R114 PolarHBondContact O-N 3.33Å; L112-C115 WeakPolarHBondContact O-CB 3.38Å; L112-C115 PolarHBondContact O-N 2.96Å; L112-V121 HydrophobicContact CD1-CB 4.38Å; L112-V121 HydrophobicContact CD1-CG1 3.73Å; L112-V121 HydrophobicContact CD1-CG2 3.93Å; L112-L124 HydrophobicContact CB-CD2 3.92Å; L112-L124 HydrophobicContact CD1-CD2 4.2Å; L112-Q137 HydrophobicContact CD2-CB 3.94Å; L112-R141 HydrophobicContact CD1-CB 4.06Å; L112-R141 HydrophobicContact CD1-CG 4.06Å; L112-R141 HydrophobicContact CG-CB 4.25Å; L112-R141 HydrophobicContact CG-CG 4.25Å; L112-R141 PolarHBondContact O-NE 3.32Å
113	R	88.8	Confident	83.2	Confident	167 Å²	167	69.2 Å²	69.2	63%	0.63	34%	0.338	S	S	*	.	H	α-helix	trans	-65	-26	175	-82.6	178.6	142.9	179.6	-4	113.1	L109 E110 L111 R141	L109-R113 WeakPolarHBondContact O-CG 3.34Å; L109-R113 PolarHBondContact O-N 3.34Å; E110-R113 PolarHBondContact O-N 3.29Å; L111-R113 VanDerWaalsContact C-N 3.28Å; L111-R113 PolarHBondContact O-N 2.93Å; R113-R141 VanDerWaalsContact O-CZ 3.26Å; R113-R141 PolarHBondContact O-NH2 3.1Å
114	R	89.9	Confident	85.8	Confident	172 Å²	172	62.5 Å²	62.5	65%	0.649	31%	0.307	S	S	*	.	H	α-helix	trans	-83.7	-20.5	177.8	-64.2	176.8	-172.2	-161.5	4	113	E110 L111 L112 S116	E110-R114 WeakPolarHBondContact O-CG 3.29Å; E110-R114 PolarHBondContact O-N 3.27Å; E110-R114 IonicContact OE1-CZ 2.78Å; E110-R114 IonicContact OE1-NE 3.91Å; E110-R114 IonicContact OE1-NH2 2.65Å; E110-R114 PolarHBondContact OE1-NH2 3.47Å; L111-R114 WeakPolarHBondContact O-CB 3.47Å; L111-R114 PolarHBondContact O-N 3.41Å; L112-R114 PolarHBondContact O-N 3.33Å; R114-S116 PolarHBondContact O-N 3.11Å
115	C	92.1	Very high	88.1	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.061	26%	0.263	C	S	.	.			trans	-57.7	124.7	176.6	-63.8	0	0	0	0	111.6	L111 L112 D120 V121 R141	L111-C115 PolarHBondContact O-N 2.97Å; L111-C115 PolarHBondContact O-SG 2.8Å; L112-C115 WeakPolarHBondContact O-CB 3.38Å; L112-C115 PolarHBondContact O-N 2.96Å; C115-D120 HydrophobicContact CB-CB 3.77Å; C115-V121 HydrophobicContact CB-CG2 3.62Å; C115-R141 HydrophobicContact CB-CG 4.46Å; C115-R141 PolarHBondContact O-NE 2.97Å; C115-R141 PolarHBondContact O-NH2 3.38Å
116	S	90.4	Very high	89.9	Confident	83 Å²	83	49.5 Å²	49.5	58%	0.58	26%	0.258	S	S	*	.			trans	-103	-9.8	-175.5	68.4	0	0	0	0	113.7	R114 D120 S145 M149	R114-S116 PolarHBondContact O-N 3.11Å; S116-D120 WeakPolarHBondContact CA-OD2 3.06Å; S116-D120 PolarHBondContact N-OD2 3.06Å; S116-D120 PolarHBondContact OG-OD2 2.7Å; S116-S145 WeakPolarHBondContact O-CB 3.17Å; S116-M149 VanDerWaalsContact O-CE 3.31Å; S116-M149 WeakPolarHBondContact O-CE 3.47Å
117	S	93.7	Very high	90.8	Very high	10 Å²	10	55.2 Å²	55.2	7%	0.07	28%	0.277	C	S	.	.	S	Bend	trans	-139.3	160.4	-179.8	77.6	0	0	0	0	112.1	S119 D120 V121 E157	S117-S119 VanDerWaalsContact C-N 3.29Å; S117-S119 PolarHBondContact O-N 2.98Å; S117-S119 PolarHBondContact OG-N 3.28Å; S117-D120 PolarHBondContact N-OD2 3.45Å; S117-D120 PolarHBondContact O-N 3.43Å; S117-D120 PolarHBondContact OG-N 3.06Å; S117-D120 PolarHBondContact OG-OD1 3.36Å; S117-D120 PolarHBondContact OG-OD2 3.39Å; S117-V121 PolarHBondContact O-N 2.94Å; S117-E157 WeakPolarHBondContact CB-OE1 3.38Å; S117-E157 PolarHBondContact OG-OE1 3.16Å
118	P	95.2	Very high	91.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-52.6	-42.2	165.3	-26.5	35.2	0	0	0	113.8	D120 V121 L122 M142 S145 T146 E157 M161	P118-D120 PolarHBondContact O-N 3.44Å; P118-V121 WeakPolarHBondContact O-CB 3.2Å; P118-V121 PolarHBondContact O-N 3.48Å; P118-L122 WeakPolarHBondContact O-CG 3.35Å; P118-L122 PolarHBondContact O-N 3.07Å; P118-L122 VanDerWaalsContact O-N 3.09Å; P118-M142 HydrophobicContact CB-CB 4.14Å; P118-M142 HydrophobicContact CB-CE 3.81Å; P118-M142 HydrophobicContact CB-CG 4.26Å; P118-M142 HydrophobicContact CG-CB 4.42Å; P118-S145 VanDerWaalsContact CD-OG 3.23Å; P118-S145 WeakPolarHBondContact CD-OG 3.39Å; P118-T146 HydrophobicContact CG-CG2 3.61Å; P118-E157 VanDerWaalsContact CD-CG 3.4Å; P118-E157 WeakPolarHBondContact CD-OE1 3.46Å; P118-E157 HydrophobicContact CG-CG 3.93Å; P118-M161 HydrophobicContact CB-CB 4.1Å; P118-M161 HydrophobicContact CB-CG 3.97Å; P118-M161 HydrophobicContact CB-SD 4.02Å
119	S	94.1	Very high	90.9	Very high	15 Å²	15	59.4 Å²	59.4	11%	0.105	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-40.7	178.6	-55.8	0	0	0	0	111.7	S117 V121 L122 D123 E157	S117-S119 VanDerWaalsContact C-N 3.29Å; S117-S119 PolarHBondContact O-N 2.98Å; S117-S119 PolarHBondContact OG-N 3.28Å; S119-V121 PolarHBondContact O-N 3.23Å; S119-L122 WeakPolarHBondContact O-CA 3.26Å; S119-L122 WeakPolarHBondContact O-CB 3.37Å; S119-L122 PolarHBondContact O-N 3.03Å; S119-D123 PolarHBondContact O-N 3.45Å; S119-E157 WeakPolarHBondContact CB-OE1 3.33Å; S119-E157 PolarHBondContact N-OE1 2.96Å; S119-E157 PolarHBondContact OG-OE1 3.16Å
120	D	93.7	Very high	90.9	Very high	55 Å²	55	58 Å²	58	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-59.1	-37.1	176	-60.6	-11.3	0	0	0	111.7	C115 S116 S117 P118 L124	C115-D120 HydrophobicContact CB-CB 3.77Å; S116-D120 WeakPolarHBondContact CA-OD2 3.06Å; S116-D120 PolarHBondContact N-OD2 3.06Å; S116-D120 PolarHBondContact OG-OD2 2.7Å; S117-D120 PolarHBondContact N-OD2 3.45Å; S117-D120 PolarHBondContact O-N 3.43Å; S117-D120 PolarHBondContact OG-N 3.06Å; S117-D120 PolarHBondContact OG-OD1 3.36Å; S117-D120 PolarHBondContact OG-OD2 3.39Å; P118-D120 PolarHBondContact O-N 3.44Å; D120-L124 WeakPolarHBondContact O-CB 3.43Å; D120-L124 PolarHBondContact O-N 3.3Å
121	V	95.1	Very high	90.7	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.2	-40.2	176.7	178.7	0	0	0	0	110.1	L112 C115 S117 P118 S119 L124 T125 C138 R141 M142	L112-V121 HydrophobicContact CD1-CB 4.38Å; L112-V121 HydrophobicContact CD1-CG1 3.73Å; L112-V121 HydrophobicContact CD1-CG2 3.93Å; C115-V121 HydrophobicContact CB-CG2 3.62Å; S117-V121 PolarHBondContact O-N 2.94Å; P118-V121 WeakPolarHBondContact O-CB 3.2Å; P118-V121 PolarHBondContact O-N 3.48Å; S119-V121 PolarHBondContact O-N 3.23Å; V121-L124 WeakPolarHBondContact O-CB 3.03Å; V121-L124 PolarHBondContact O-N 2.98Å; V121-T125 HydrophobicContact CG1-CG2 4.38Å; V121-T125 WeakPolarHBondContact O-CG2 3.33Å; V121-T125 PolarHBondContact O-N 3.32Å; V121-T125 PolarHBondContact O-OG1 2.86Å; V121-C138 HydrophobicContact CG1-CB 3.8Å; V121-R141 HydrophobicContact CG2-CB 4.24Å; V121-R141 HydrophobicContact CG2-CG 3.81Å; V121-M142 HydrophobicContact CB-CG 3.64Å; V121-M142 HydrophobicContact CB-SD 4.49Å; V121-M142 HydrophobicContact CG1-CG 3.73Å; V121-M142 HydrophobicContact CG1-SD 4.23Å; V121-M142 HydrophobicContact CG2-CG 3.9Å
122	L	94.8	Very high	90.3	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-41.7	178	-65.7	174.7	0	0	0	111.9	P118 S119 L124 T125 S126 M142 M161 H164 F167 L170	P118-L122 WeakPolarHBondContact O-CG 3.35Å; P118-L122 PolarHBondContact O-N 3.07Å; P118-L122 VanDerWaalsContact O-N 3.09Å; S119-L122 WeakPolarHBondContact O-CA 3.26Å; S119-L122 WeakPolarHBondContact O-CB 3.37Å; S119-L122 PolarHBondContact O-N 3.03Å; L122-L124 VanDerWaalsContact C-N 3.27Å; L122-L124 PolarHBondContact O-N 3.22Å; L122-T125 WeakPolarHBondContact CA-OG1 3.43Å; L122-T125 CarbonylContact O-C 3.6Å; L122-T125 PolarHBondContact O-N 2.9Å; L122-T125 VanDerWaalsContact O-N 3.1Å; L122-T125 PolarHBondContact O-OG1 2.97Å; L122-S126 PolarHBondContact O-N 3.46Å; L122-M142 HydrophobicContact CD1-CE 4.02Å; L122-M142 HydrophobicContact CD2-CE 3.99Å; L122-M142 HydrophobicContact CD2-SD 4.31Å; L122-M142 HydrophobicContact CG-CE 3.89Å; L122-M161 HydrophobicContact CD1-CG 3.96Å; L122-H164 HydrophobicContact CD1-CB 3.71Å; L122-F167 HydrophobicContact CD1-CB 3.85Å; L122-F167 HydrophobicContact CD1-CD2 4.13Å; L122-F167 HydrophobicContact CD1-CG 4.37Å; L122-F167 HydrophobicContact CD2-CB 4.29Å; L122-F167 HydrophobicContact CD2-CD2 4.18Å; L122-L170 HydrophobicContact CD2-CB 4.33Å; L122-L170 HydrophobicContact CD2-CD2 3.79Å
123	D	93.4	Very high	89.5	Confident	73 Å²	73	65.3 Å²	65.3	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-34.5	171.3	-79.7	-29.4	0	0	0	112.6	S119 S126 K127 H164	S119-D123 PolarHBondContact O-N 3.45Å; D123-S126 PolarHBondContact O-OG 3.5Å; D123-K127 WeakPolarHBondContact O-CG 3.37Å; D123-H164 IonicContact OD1-NE2 2.79Å; D123-H164 PolarHBondContact OD1-NE2 3.09Å
124	L	93.4	Very high	89.5	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-69.5	-40.4	173.5	-175.2	67.2	0	0	0	111.1	F108 L111 L112 D120 V121 L122 S126 K127 Y128	F108-L124 HydrophobicContact CD2-CD2 4.2Å; F108-L124 HydrophobicContact CD2-CG 4.23Å; F108-L124 HydrophobicContact CE2-CD2 3.83Å; F108-L124 HydrophobicContact CE2-CG 3.79Å; F108-L124 HydrophobicContact CZ-CD2 4.15Å; F108-L124 HydrophobicContact CZ-CG 4.49Å; L111-L124 HydrophobicContact CB-CD1 3.77Å; L111-L124 HydrophobicContact CB-CD2 4.01Å; L111-L124 HydrophobicContact CD1-CD1 3.96Å; L111-L124 HydrophobicContact CG-CD1 4.48Å; L112-L124 HydrophobicContact CB-CD2 3.92Å; L112-L124 HydrophobicContact CD1-CD2 4.2Å; D120-L124 WeakPolarHBondContact O-CB 3.43Å; D120-L124 PolarHBondContact O-N 3.3Å; V121-L124 WeakPolarHBondContact O-CB 3.03Å; V121-L124 PolarHBondContact O-N 2.98Å; L122-L124 VanDerWaalsContact C-N 3.27Å; L122-L124 PolarHBondContact O-N 3.22Å; L124-S126 VanDerWaalsContact C-N 3.28Å; L124-S126 PolarHBondContact O-N 3.13Å; L124-K127 PolarHBondContact O-N 3.4Å; L124-Y128 HydrophobicContact CD1-CD2 3.7Å; L124-Y128 HydrophobicContact CD1-CE2 3.98Å; L124-Y128 HydrophobicContact CG-CD2 4.45Å; L124-Y128 PolarHBondContact O-N 2.74Å
125	T	91.2	Very high	89.5	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-72.9	-19.2	-179.9	65.5	0	0	0	0	113.8	V121 L122 Y128 P130 L170	V121-T125 HydrophobicContact CG1-CG2 4.38Å; V121-T125 WeakPolarHBondContact O-CG2 3.33Å; V121-T125 PolarHBondContact O-N 3.32Å; V121-T125 PolarHBondContact O-OG1 2.86Å; L122-T125 WeakPolarHBondContact CA-OG1 3.43Å; L122-T125 CarbonylContact O-C 3.6Å; L122-T125 PolarHBondContact O-N 2.9Å; L122-T125 VanDerWaalsContact O-N 3.1Å; L122-T125 PolarHBondContact O-OG1 2.97Å; T125-Y128 CarbonylContact C-O 3.46Å; T125-Y128 WeakPolarHBondContact CA-O 3.33Å; T125-P130 HydrophobicContact CG2-CG 4.34Å; T125-L170 HydrophobicContact CG2-CD1 4.32Å
126	S	89.1	Confident	89.4	Confident	64 Å²	64	50 Å²	50	45%	0.448	27%	0.266	S	S	.	.	H	α-helix	trans	-73	-36	170.7	75.3	0	0	0	0	111.4	L122 D123 L124	L122-S126 PolarHBondContact O-N 3.46Å; D123-S126 PolarHBondContact O-OG 3.5Å; L124-S126 VanDerWaalsContact C-N 3.28Å; L124-S126 PolarHBondContact O-N 3.13Å
127	K	87.9	Confident	89.5	Confident	159 Å²	159	49.8 Å²	49.8	69%	0.691	26%	0.256	S	S	*	.	H	α-helix	trans	-82.1	-33.2	179.7	-66.2	172.4	-173.9	171.4	0	113.2	D123 L124	D123-K127 WeakPolarHBondContact O-CG 3.37Å; L124-K127 PolarHBondContact O-N 3.4Å
128	Y	86.7	Confident	89.5	Confident	122 Å²	122	49.3 Å²	49.3	48%	0.478	25%	0.252	S	S	.	.	S	Bend	trans	-132.1	130.5	-177.5	-58.5	-84.3	0	0	0	110.7	F108 L111 L124 T125 P130	F108-Y128 HydrophobicContact CD2-CD2 4.48Å; F108-Y128 HydrophobicContact CD2-CG 4.23Å; L111-Y128 HydrophobicContact CD1-CE2 4.04Å; L124-Y128 HydrophobicContact CD1-CD2 3.7Å; L124-Y128 HydrophobicContact CD1-CE2 3.98Å; L124-Y128 HydrophobicContact CG-CD2 4.45Å; L124-Y128 PolarHBondContact O-N 2.74Å; T125-Y128 CarbonylContact C-O 3.46Å; T125-Y128 WeakPolarHBondContact CA-O 3.33Å; Y128-P130 WeakPolarHBondContact O-CD 3.4Å
129	A	84.3	Confident	89.4	Confident	83 Å²	83	49.3 Å²	49.3	69%	0.686	25%	0.252	S	S	*	.			trans	-74.9	113.8	173.1	0	0	0	0	0	110.3
130	P	85.3	Confident	89.3	Confident	13 Å²	13	50 Å²	50	8%	0.084	26%	0.257	C	S	.	.			trans	-69.7	141.1	177.7	29.5	-34.5	0	0	0	110.9	F108 T125 Y128 Q134 I135 L170	F108-P130 HydrophobicContact CE1-CB 4.36Å; F108-P130 HydrophobicContact CZ-CB 3.96Å; T125-P130 HydrophobicContact CG2-CG 4.34Å; Y128-P130 WeakPolarHBondContact O-CD 3.4Å; P130-Q134 HydrophobicContact CB-CB 3.9Å; P130-I135 HydrophobicContact CB-CG1 4.17Å; P130-I135 HydrophobicContact CG-CG1 3.95Å; P130-L170 HydrophobicContact CG-CD1 4.47Å
131	T	84.8	Confident	89.3	Confident	78 Å²	78	50.4 Å²	50.4	48%	0.479	26%	0.255	S	S	.	.			trans	-67	164	169.4	62	0	0	0	0	111.7	R133 Q134 I135	T131-R133 PolarHBondContact O-N 3.03Å; T131-R133 VanDerWaalsContact O-N 3.13Å; T131-Q134 PolarHBondContact O-N 3.35Å; T131-Q134 VanDerWaalsContact OG1-CG 3.27Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.47Å; T131-Q134 PolarHBondContact OG1-N 3.11Å; T131-Q134 PolarHBondContact OG1-OE1 2.83Å; T131-I135 PolarHBondContact O-N 3.33Å; T131-I135 VanDerWaalsContact O-N 3.15Å
132	N	80.3	Confident	89.3	Confident	68 Å²	68	50.4 Å²	50.4	36%	0.364	26%	0.255	S	S	.	.	H	α-helix	trans	-51.5	-39	179.5	-67.8	-20.6	0	0	0	113.5	S177 Y180	N132-S177 WeakPolarHBondContact OD1-CB 3.46Å; N132-Y180 VanDerWaalsContact ND2-CD2 3.26Å; N132-Y180 WeakPolarHBondContact ND2-CD2 3.25Å
133	R	75.5	Confident	89.3	Confident	182 Å²	182	51.5 Å²	51.5	69%	0.687	26%	0.259	S	S	*	.	H	α-helix	trans	-73.8	-33.9	176.9	-68.1	-175.9	178.1	177.2	-1.4	112.8	T131 I135	T131-R133 PolarHBondContact O-N 3.03Å; T131-R133 VanDerWaalsContact O-N 3.13Å; R133-I135 VanDerWaalsContact C-N 3.3Å; R133-I135 PolarHBondContact O-N 3.29Å
134	Q	87.9	Confident	89.2	Confident	22 Å²	22	51.6 Å²	51.6	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-73.2	-20.9	-179.4	-74.9	164.7	-25.4	0	0	113	F108 L109 P130 T131 Q137 C138	F108-Q134 HydrophobicContact CD1-CB 4.35Å; F108-Q134 HydrophobicContact CD1-CG 4.01Å; F108-Q134 HydrophobicContact CE1-CB 3.9Å; F108-Q134 HydrophobicContact CE1-CG 4.07Å; L109-Q134 HydrophobicContact CD2-CG 4.31Å; P130-Q134 HydrophobicContact CB-CB 3.9Å; T131-Q134 PolarHBondContact O-N 3.35Å; T131-Q134 VanDerWaalsContact OG1-CG 3.27Å; T131-Q134 WeakPolarHBondContact OG1-CG 3.47Å; T131-Q134 PolarHBondContact OG1-N 3.11Å; T131-Q134 PolarHBondContact OG1-OE1 2.83Å; Q134-Q137 WeakPolarHBondContact O-CB 3.48Å; Q134-Q137 PolarHBondContact O-N 3.13Å; Q134-C138 PolarHBondContact O-N 3.37Å; Q134-C138 PolarHBondContact O-SG 3.23Å
135	I	90.7	Very high	89.1	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-44.6	178.5	-67.3	164.8	0	0	0	111.4	P130 T131 R133 Q137 C138 L139 L170 R173 A174 S177 M181	P130-I135 HydrophobicContact CB-CG1 4.17Å; P130-I135 HydrophobicContact CG-CG1 3.95Å; T131-I135 PolarHBondContact O-N 3.33Å; T131-I135 VanDerWaalsContact O-N 3.15Å; R133-I135 VanDerWaalsContact C-N 3.3Å; R133-I135 PolarHBondContact O-N 3.29Å; I135-Q137 VanDerWaalsContact C-N 3.26Å; I135-Q137 PolarHBondContact O-N 3.03Å; I135-C138 WeakPolarHBondContact O-CB 3.46Å; I135-C138 PolarHBondContact O-N 2.92Å; I135-L139 HydrophobicContact CG2-CD1 4.33Å; I135-L139 WeakPolarHBondContact O-CG 3.32Å; I135-L139 PolarHBondContact O-N 2.96Å; I135-L170 HydrophobicContact CG2-CD1 4.24Å; I135-R173 HydrophobicContact CD1-CB 3.89Å; I135-A174 HydrophobicContact CG2-CB 3.62Å; I135-S177 VanDerWaalsContact CD1-OG 3.23Å; I135-S177 WeakPolarHBondContact CD1-OG 3.36Å; I135-M181 HydrophobicContact CB-CE 4.02Å; I135-M181 HydrophobicContact CG2-CE 3.88Å
136	S	90.4	Very high	89.1	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-42.8	173.8	169.4	0	0	0	0	111.6	L139 S140 D185 S189	S136-L139 PolarHBondContact O-N 3.42Å; S136-S140 VanDerWaalsContact O-CB 3.3Å; S136-S140 WeakPolarHBondContact O-CB 3.48Å; S136-S140 PolarHBondContact O-N 2.86Å; S136-S140 PolarHBondContact O-OG 3.34Å; S136-D185 WeakPolarHBondContact CB-OD1 3.47Å; S136-D185 WeakPolarHBondContact OG-CA 3.38Å; S136-D185 WeakPolarHBondContact OG-CB 3.5Å; S136-D185 PolarHBondContact OG-O 3.42Å; S136-D185 PolarHBondContact OG-OD1 2.99Å; S136-S189 WeakPolarHBondContact CA-OG 3.34Å; S136-S189 WeakPolarHBondContact CB-OG 3.38Å; S136-S189 PolarHBondContact OG-OG 3.31Å
137	Q	91.3	Very high	89.1	Confident	77 Å²	77	54 Å²	54	36%	0.36	26%	0.258	S	S	.	.	H	α-helix	trans	-68.9	-36.4	179	-63.7	167.9	-18.5	0	0	112.4	L112 Q134 I135 R141	L112-Q137 HydrophobicContact CD2-CB 3.94Å; Q134-Q137 WeakPolarHBondContact O-CB 3.48Å; Q134-Q137 PolarHBondContact O-N 3.13Å; I135-Q137 VanDerWaalsContact C-N 3.26Å; I135-Q137 PolarHBondContact O-N 3.03Å; Q137-R141 VanDerWaalsContact O-CB 3.24Å; Q137-R141 WeakPolarHBondContact O-CB 3.43Å; Q137-R141 PolarHBondContact O-N 3.36Å
138	C	94.1	Very high	89.1	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-52.8	173.1	-66.3	0	0	0	0	110.4	V121 Q134 I135 S140 R141 M142 L170	V121-C138 HydrophobicContact CG1-CB 3.8Å; Q134-C138 PolarHBondContact O-N 3.37Å; Q134-C138 PolarHBondContact O-SG 3.23Å; I135-C138 WeakPolarHBondContact O-CB 3.46Å; I135-C138 PolarHBondContact O-N 2.92Å; C138-S140 VanDerWaalsContact C-N 3.33Å; C138-S140 PolarHBondContact O-N 3.12Å; C138-R141 PolarHBondContact O-N 2.91Å; C138-R141 VanDerWaalsContact O-N 3.14Å; C138-M142 VanDerWaalsContact O-CG 3.27Å; C138-M142 WeakPolarHBondContact O-CG 3.36Å; C138-M142 PolarHBondContact O-N 2.96Å; C138-L170 HydrophobicContact CB-CD1 4.48Å; C138-L170 HydrophobicContact CB-CD2 4.44Å
139	L	94.3	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-44.1	178.7	-65.8	173.6	0	0	0	111.9	I135 S136 R141 M142 W143 L170 L171 A174 V193	I135-L139 HydrophobicContact CG2-CD1 4.33Å; I135-L139 WeakPolarHBondContact O-CG 3.32Å; I135-L139 PolarHBondContact O-N 2.96Å; S136-L139 PolarHBondContact O-N 3.42Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 3.23Å; L139-M142 HydrophobicContact CD2-SD 4.45Å; L139-M142 PolarHBondContact O-N 3.16Å; L139-W143 WeakPolarHBondContact O-CB 3.43Å; L139-W143 PolarHBondContact O-N 2.94Å; L139-L170 HydrophobicContact CD2-CD2 4.1Å; L139-L170 HydrophobicContact CD2-CG 4.41Å; L139-L171 HydrophobicContact CD2-CD2 4.24Å; L139-A174 HydrophobicContact CD1-CB 4.09Å; L139-V193 HydrophobicContact CD1-CG1 3.97Å; L139-V193 HydrophobicContact CD2-CG1 4.07Å
140	S	91.7	Very high	89.6	Confident	30 Å²	30	48.8 Å²	48.8	21%	0.21	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-38.5	177	-61.3	0	0	0	0	112	S136 C138 F144 S192	S136-S140 VanDerWaalsContact O-CB 3.3Å; S136-S140 WeakPolarHBondContact O-CB 3.48Å; S136-S140 PolarHBondContact O-N 2.86Å; S136-S140 PolarHBondContact O-OG 3.34Å; C138-S140 VanDerWaalsContact C-N 3.33Å; C138-S140 PolarHBondContact O-N 3.12Å; S140-F144 VanDerWaalsContact O-CB 3.28Å; S140-F144 WeakPolarHBondContact O-CB 3.48Å; S140-F144 PolarHBondContact O-N 3.43Å; S140-S192 WeakPolarHBondContact CA-OG 3.41Å
141	R	94.1	Very high	89.7	Confident	63 Å²	63	52.4 Å²	52.4	24%	0.238	25%	0.25	C	C	.	.	H	α-helix	trans	-68.6	-45.3	176.8	-177.9	59.8	-177.2	-163.5	-1.3	111.8	L112 R113 C115 V121 Q137 C138 L139 W143 F144 S145	L112-R141 HydrophobicContact CD1-CB 4.06Å; L112-R141 HydrophobicContact CD1-CG 4.06Å; L112-R141 HydrophobicContact CG-CB 4.25Å; L112-R141 HydrophobicContact CG-CG 4.25Å; L112-R141 PolarHBondContact O-NE 3.32Å; R113-R141 VanDerWaalsContact O-CZ 3.26Å; R113-R141 PolarHBondContact O-NH2 3.1Å; C115-R141 HydrophobicContact CB-CG 4.46Å; C115-R141 PolarHBondContact O-NE 2.97Å; C115-R141 PolarHBondContact O-NH2 3.38Å; V121-R141 HydrophobicContact CG2-CB 4.24Å; V121-R141 HydrophobicContact CG2-CG 3.81Å; Q137-R141 VanDerWaalsContact O-CB 3.24Å; Q137-R141 WeakPolarHBondContact O-CB 3.43Å; Q137-R141 PolarHBondContact O-N 3.36Å; C138-R141 PolarHBondContact O-N 2.91Å; C138-R141 VanDerWaalsContact O-N 3.14Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 3.23Å; R141-W143 VanDerWaalsContact C-N 3.33Å; R141-W143 PolarHBondContact O-N 3.28Å; R141-F144 PolarHBondContact O-N 3.17Å; R141-S145 WeakPolarHBondContact O-CB 3.49Å; R141-S145 PolarHBondContact O-N 3.42Å; R141-S145 PolarHBondContact O-OG 3.09Å
142	M	94.9	Very high	89.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-53.8	-54.4	174.4	-67.9	173.7	75.4	0	0	109.3	P118 V121 L122 C138 L139 F144 S145 T146 M161 F167 L170 L196	P118-M142 HydrophobicContact CB-CB 4.14Å; P118-M142 HydrophobicContact CB-CE 3.81Å; P118-M142 HydrophobicContact CB-CG 4.26Å; P118-M142 HydrophobicContact CG-CB 4.42Å; V121-M142 HydrophobicContact CB-CG 3.64Å; V121-M142 HydrophobicContact CB-SD 4.49Å; V121-M142 HydrophobicContact CG1-CG 3.73Å; V121-M142 HydrophobicContact CG1-SD 4.23Å; V121-M142 HydrophobicContact CG2-CG 3.9Å; L122-M142 HydrophobicContact CD1-CE 4.02Å; L122-M142 HydrophobicContact CD2-CE 3.99Å; L122-M142 HydrophobicContact CD2-SD 4.31Å; L122-M142 HydrophobicContact CG-CE 3.89Å; C138-M142 VanDerWaalsContact O-CG 3.27Å; C138-M142 WeakPolarHBondContact O-CG 3.36Å; C138-M142 PolarHBondContact O-N 2.96Å; L139-M142 HydrophobicContact CD2-SD 4.45Å; L139-M142 PolarHBondContact O-N 3.16Å; M142-F144 PolarHBondContact O-N 3.01Å; M142-S145 PolarHBondContact O-N 2.88Å; M142-S145 PolarHBondContact O-OG 3.32Å; M142-T146 WeakPolarHBondContact O-CG2 3.29Å; M142-T146 PolarHBondContact O-N 3.32Å; M142-M161 HydrophobicContact CE-CG 3.61Å; M142-M161 HydrophobicContact CE-SD 3.57Å; M142-M161 VanDerWaalsContact CE-SD 3.57Å; M142-F167 HydrophobicContact CE-CD2 3.88Å; M142-F167 HydrophobicContact CE-CE2 3.85Å; M142-L170 HydrophobicContact SD-CD2 3.67Å; M142-L196 HydrophobicContact CB-CD1 4.02Å; M142-L196 HydrophobicContact CB-CD2 4.27Å
143	W	93.3	Very high	90.4	Very high	23 Å²	23	57.6 Å²	57.6	9%	0.087	27%	0.266	C	S	.	.	H	α-helix	trans	-52.8	-52.6	174.9	162.3	-83.5	0	0	0	113.1	L139 R141 S145 T146 L191 N195 L196	L139-W143 WeakPolarHBondContact O-CB 3.43Å; L139-W143 PolarHBondContact O-N 2.94Å; R141-W143 VanDerWaalsContact C-N 3.33Å; R141-W143 PolarHBondContact O-N 3.28Å; W143-S145 VanDerWaalsContact C-N 3.28Å; W143-S145 PolarHBondContact O-N 3.36Å; W143-T146 WeakPolarHBondContact O-CB 3.49Å; W143-T146 PolarHBondContact O-N 2.72Å; W143-T146 PolarHBondContact O-OG1 3.12Å; W143-L191 HydrophobicContact CH2-CD1 3.56Å; W143-L191 HydrophobicContact CH2-CD2 4.08Å; W143-L191 HydrophobicContact CH2-CG 3.6Å; W143-L191 HydrophobicContact CZ2-CD1 4.26Å; W143-L191 HydrophobicContact CZ2-CD2 4.07Å; W143-L191 HydrophobicContact CZ2-CG 4.1Å; W143-L191 HydrophobicContact CZ3-CD1 4.16Å; W143-L191 HydrophobicContact CZ3-CG 3.93Å; W143-L191 WeakPolarHBondContact CZ3-O 3.22Å; W143-N195 HydrophobicContact CE3-CB 3.68Å; W143-N195 HydrophobicContact CH2-CB 3.28Å; W143-N195 WeakPolarHBondContact CH2-ND2 3.29Å; W143-N195 HydrophobicContact CZ2-CB 4.37Å; W143-N195 VanDerWaalsContact CZ3-CA 3.47Å; W143-N195 HydrophobicContact CZ3-CB 2.89Å; W143-N195 WeakPolarHBondContact CZ3-ND2 3.33Å; W143-L196 HydrophobicContact CB-CG 4.43Å
144	F	91.3	Very high	91.2	Very high	76 Å²	76	52.3 Å²	52.3	33%	0.333	25%	0.246	S	C	.	.	H	α-helix	trans	-68.1	-34	-170	-175	-96.5	0	0	0	111.3	S140 R141 M142 T146 K147 K148	S140-F144 VanDerWaalsContact O-CB 3.28Å; S140-F144 WeakPolarHBondContact O-CB 3.48Å; S140-F144 PolarHBondContact O-N 3.43Å; R141-F144 PolarHBondContact O-N 3.17Å; M142-F144 PolarHBondContact O-N 3.01Å; F144-T146 VanDerWaalsContact C-N 3.27Å; F144-T146 PolarHBondContact O-N 3.43Å; F144-K147 HydrophobicContact CD2-CD 4.33Å; F144-K147 WeakPolarHBondContact O-CB 3.41Å; F144-K147 PolarHBondContact O-N 3.15Å; F144-K147 VanDerWaalsContact O-N 3.15Å; F144-K148 HydrophobicContact CE1-CD 4.5Å; F144-K148 VanDerWaalsContact CE1-CE 3.43Å
145	S	92.9	Very high	91.3	Very high	7 Å²	7	56.9 Å²	56.9	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-38.8	173.2	71.3	0	0	0	0	111.9	S116 P118 R141 M142 W143 K147 K148	S116-S145 WeakPolarHBondContact O-CB 3.17Å; P118-S145 VanDerWaalsContact CD-OG 3.23Å; P118-S145 WeakPolarHBondContact CD-OG 3.39Å; R141-S145 WeakPolarHBondContact O-CB 3.49Å; R141-S145 PolarHBondContact O-N 3.42Å; R141-S145 PolarHBondContact O-OG 3.09Å; M142-S145 PolarHBondContact O-N 2.88Å; M142-S145 PolarHBondContact O-OG 3.32Å; W143-S145 VanDerWaalsContact C-N 3.28Å; W143-S145 PolarHBondContact O-N 3.36Å; S145-K147 VanDerWaalsContact C-N 3.25Å; S145-K147 PolarHBondContact O-N 2.95Å; S145-K148 PolarHBondContact O-N 2.92Å
146	T	91.3	Very high	91.4	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-66	-23.2	177	72.1	0	0	0	0	114.3	P118 M142 W143 F144 K148 M149 L158 L196	P118-T146 HydrophobicContact CG-CG2 3.61Å; M142-T146 WeakPolarHBondContact O-CG2 3.29Å; M142-T146 PolarHBondContact O-N 3.32Å; W143-T146 WeakPolarHBondContact O-CB 3.49Å; W143-T146 PolarHBondContact O-N 2.72Å; W143-T146 PolarHBondContact O-OG1 3.12Å; F144-T146 VanDerWaalsContact C-N 3.27Å; F144-T146 PolarHBondContact O-N 3.43Å; T146-K148 VanDerWaalsContact C-N 3.28Å; T146-K148 PolarHBondContact O-N 3.45Å; T146-M149 PolarHBondContact O-N 3.42Å; T146-L158 HydrophobicContact CG2-CD2 4.27Å; T146-L196 HydrophobicContact CG2-CD2 4.14Å
147	K	88.2	Confident	91.6	Very high	123 Å²	123	64.7 Å²	64.7	54%	0.535	29%	0.294	S	S	.	.	H	α-helix	trans	-70.7	-24.1	178.9	-73.7	-178.3	160.3	179.7	0	113.3	F144 S145	F144-K147 HydrophobicContact CD2-CD 4.33Å; F144-K147 WeakPolarHBondContact O-CB 3.41Å; F144-K147 PolarHBondContact O-N 3.15Å; F144-K147 VanDerWaalsContact O-N 3.15Å; S145-K147 VanDerWaalsContact C-N 3.25Å; S145-K147 PolarHBondContact O-N 2.95Å
148	K	87.7	Confident	91.7	Very high	160 Å²	160	61.7 Å²	61.7	70%	0.696	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-6.5	-179.2	-62.8	-174.7	176.2	-174.6	0	112.9	F144 S145 T146	F144-K148 HydrophobicContact CE1-CD 4.5Å; F144-K148 VanDerWaalsContact CE1-CE 3.43Å; S145-K148 PolarHBondContact O-N 2.92Å; T146-K148 VanDerWaalsContact C-N 3.28Å; T146-K148 PolarHBondContact O-N 3.45Å
149	M	89.6	Confident	91.7	Very high	39 Å²	39	65 Å²	65	19%	0.192	30%	0.296	C	S	.	.	S	Bend	trans	-88.4	149.4	-176.3	-65	174.1	-179.9	0	0	111.3	S116 T146 Q153 R154 E157	S116-M149 VanDerWaalsContact O-CE 3.31Å; S116-M149 WeakPolarHBondContact O-CE 3.47Å; T146-M149 PolarHBondContact O-N 3.42Å; M149-Q153 HydrophobicContact CB-CB 4.08Å; M149-R154 HydrophobicContact CB-CB 4.15Å; M149-E157 HydrophobicContact CE-CG 4.04Å; M149-E157 HydrophobicContact SD-CB 4.12Å; M149-E157 HydrophobicContact SD-CG 4.05Å
150	S	91.7	Very high	91.7	Very high	57 Å²	57	67.7 Å²	67.7	40%	0.399	31%	0.309	S	S	.	.			trans	-64	160.1	166	64.4	0	0	0	0	111.2	E152 Q153 R154	S150-E152 PolarHBondContact O-N 3.27Å; S150-Q153 PolarHBondContact O-N 3.05Å; S150-Q153 WeakPolarHBondContact OG-CB 3.32Å; S150-Q153 VanDerWaalsContact OG-CG 3.25Å; S150-Q153 WeakPolarHBondContact OG-CG 3.47Å; S150-Q153 PolarHBondContact OG-N 3.36Å; S150-Q153 PolarHBondContact OG-OE1 2.82Å; S150-R154 VanDerWaalsContact O-CB 3.31Å; S150-R154 WeakPolarHBondContact O-CB 3.44Å; S150-R154 PolarHBondContact O-N 2.78Å
151	D	88	Confident	91.9	Very high	88 Å²	88	66.2 Å²	66.2	47%	0.471	30%	0.3	S	S	.	.	H	α-helix	trans	-59.1	-30.1	-178.9	-81.7	-26.7	0	0	0	113.7	C18 R155	C18-D151 PolarHBondContact SG-OD1 2.65Å; D151-R155 WeakPolarHBondContact O-CG 3.31Å; D151-R155 PolarHBondContact O-N 2.65Å; D151-R155 PolarHBondContact O-NE 3.29Å
152	E	89.4	Confident	91.9	Very high	139 Å²	139	67.2 Å²	67.2	65%	0.65	31%	0.306	S	S	*	.	H	α-helix	trans	-76.4	-48.9	177.3	-174.6	166.7	-158	0	0	111.6	S150 R154 R155 Y156	S150-E152 PolarHBondContact O-N 3.27Å; E152-R154 VanDerWaalsContact C-N 3.3Å; E152-R154 PolarHBondContact O-N 3.22Å; E152-R155 PolarHBondContact O-N 3.11Å; E152-R155 VanDerWaalsContact O-N 3.15Å; E152-Y156 PolarHBondContact O-N 3.37Å; E152-Y156 VanDerWaalsContact O-N 3.07Å
153	Q	90.6	Very high	91.8	Very high	117 Å²	117	72.1 Å²	72.1	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-57.5	-45.3	175	-73.6	167.6	-34	0	0	111.3	M149 S150 R155 Y156 E157	M149-Q153 HydrophobicContact CB-CB 4.08Å; S150-Q153 PolarHBondContact O-N 3.05Å; S150-Q153 WeakPolarHBondContact OG-CB 3.32Å; S150-Q153 VanDerWaalsContact OG-CG 3.25Å; S150-Q153 WeakPolarHBondContact OG-CG 3.47Å; S150-Q153 PolarHBondContact OG-N 3.36Å; S150-Q153 PolarHBondContact OG-OE1 2.82Å; Q153-R155 VanDerWaalsContact C-N 3.31Å; Q153-R155 PolarHBondContact O-N 2.95Å; Q153-Y156 PolarHBondContact O-N 3.2Å; Q153-E157 WeakPolarHBondContact O-CB 3.2Å; Q153-E157 PolarHBondContact O-N 2.61Å
154	R	91.5	Very high	91.9	Very high	70 Å²	70	72.7 Å²	72.7	26%	0.264	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-41.5	178.1	-178	175.3	179.5	-171.2	0.6	111.9	M149 S150 E152 L158 N195	M149-R154 HydrophobicContact CB-CB 4.15Å; S150-R154 VanDerWaalsContact O-CB 3.31Å; S150-R154 WeakPolarHBondContact O-CB 3.44Å; S150-R154 PolarHBondContact O-N 2.78Å; E152-R154 VanDerWaalsContact C-N 3.3Å; E152-R154 PolarHBondContact O-N 3.22Å; R154-L158 HydrophobicContact CG-CD1 3.98Å; R154-L158 HydrophobicContact CG-CG 4.38Å; R154-L158 WeakPolarHBondContact O-CB 3.38Å; R154-L158 WeakPolarHBondContact O-CG 3.41Å; R154-L158 PolarHBondContact O-N 3.08Å; R154-N195 PolarHBondContact NH2-O 3.11Å
155	R	90.6	Very high	91.9	Very high	118 Å²	118	73.9 Å²	73.9	45%	0.445	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-47.8	178.7	-83.5	179.2	-80.2	135.6	-9.4	111.7	D151 E152 Q153 Q159	D151-R155 WeakPolarHBondContact O-CG 3.31Å; D151-R155 PolarHBondContact O-N 2.65Å; D151-R155 PolarHBondContact O-NE 3.29Å; E152-R155 PolarHBondContact O-N 3.11Å; E152-R155 VanDerWaalsContact O-N 3.15Å; Q153-R155 VanDerWaalsContact C-N 3.31Å; Q153-R155 PolarHBondContact O-N 2.95Å; R155-Q159 PolarHBondContact O-N 3.22Å; R155-Q159 VanDerWaalsContact O-N 3.16Å
156	Y	93	Very high	91.9	Very high	148 Å²	148	75.5 Å²	75.5	58%	0.58	35%	0.354	S	S	*	.	H	α-helix	trans	-62.1	-46.6	178.5	-178.9	-104.7	0	0	0	111.4	E152 Q153 L158 Q159 L160	E152-Y156 PolarHBondContact O-N 3.37Å; E152-Y156 VanDerWaalsContact O-N 3.07Å; Q153-Y156 PolarHBondContact O-N 3.2Å; Y156-L158 PolarHBondContact O-N 3.25Å; Y156-Q159 WeakPolarHBondContact O-CB 3.44Å; Y156-Q159 PolarHBondContact O-N 2.9Å; Y156-Q159 VanDerWaalsContact O-N 3.12Å; Y156-L160 HydrophobicContact CD1-CD1 3.94Å; Y156-L160 HydrophobicContact CD1-CG 4.39Å; Y156-L160 HydrophobicContact CE1-CD1 3.4Å; Y156-L160 HydrophobicContact CE1-CG 4.01Å; Y156-L160 PolarHBondContact O-N 3.02Å
157	E	94.3	Very high	92	Very high	21 Å²	21	75.8 Å²	75.8	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-66.4	-39.5	-178.4	-177.4	57.2	-152	0	0	113	S117 P118 S119 M149 Q153 Q159 L160 M161	S117-E157 WeakPolarHBondContact CB-OE1 3.38Å; S117-E157 PolarHBondContact OG-OE1 3.16Å; P118-E157 VanDerWaalsContact CD-CG 3.4Å; P118-E157 WeakPolarHBondContact CD-OE1 3.46Å; P118-E157 HydrophobicContact CG-CG 3.93Å; S119-E157 WeakPolarHBondContact CB-OE1 3.33Å; S119-E157 PolarHBondContact N-OE1 2.96Å; S119-E157 PolarHBondContact OG-OE1 3.16Å; M149-E157 HydrophobicContact CE-CG 4.04Å; M149-E157 HydrophobicContact SD-CB 4.12Å; M149-E157 HydrophobicContact SD-CG 4.05Å; Q153-E157 WeakPolarHBondContact O-CB 3.2Å; Q153-E157 PolarHBondContact O-N 2.61Å; E157-Q159 VanDerWaalsContact C-N 3.27Å; E157-Q159 PolarHBondContact O-N 3.26Å; E157-L160 PolarHBondContact O-N 2.9Å; E157-M161 WeakPolarHBondContact O-CB 3.49Å; E157-M161 PolarHBondContact O-N 3.02Å
158	L	93.1	Very high	92.2	Very high	15 Å²	15	74.8 Å²	74.8	8%	0.079	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-37	173.2	-73.5	174.1	0	0	0	111.3	L14 T146 R154 Y156 M161 F162 L196	L14-L158 HydrophobicContact CD2-CB 4.46Å; T146-L158 HydrophobicContact CG2-CD2 4.27Å; R154-L158 HydrophobicContact CG-CD1 3.98Å; R154-L158 HydrophobicContact CG-CG 4.38Å; R154-L158 WeakPolarHBondContact O-CB 3.38Å; R154-L158 WeakPolarHBondContact O-CG 3.41Å; R154-L158 PolarHBondContact O-N 3.08Å; Y156-L158 PolarHBondContact O-N 3.25Å; L158-M161 HydrophobicContact CD2-CE 3.85Å; L158-M161 HydrophobicContact CD2-SD 4.17Å; L158-M161 WeakPolarHBondContact O-CB 3.09Å; L158-M161 PolarHBondContact O-N 3.18Å; L158-F162 WeakPolarHBondContact O-CD2 3.33Å; L158-F162 PolarHBondContact O-N 3.26Å; L158-F162 VanDerWaalsContact O-N 3.07Å; L158-L196 HydrophobicContact CD2-CD2 4.11Å
159	Q	93.8	Very high	92.4	Very high	69 Å²	69	70.1 Å²	70.1	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-62.4	-47.1	174.4	-176	-175.6	-20.9	0	0	111.3	K11 R155 Y156 E157 M161 F162 E163	K11-Q159 VanDerWaalsContact NZ-NE2 3.16Å; R155-Q159 PolarHBondContact O-N 3.22Å; R155-Q159 VanDerWaalsContact O-N 3.16Å; Y156-Q159 WeakPolarHBondContact O-CB 3.44Å; Y156-Q159 PolarHBondContact O-N 2.9Å; Y156-Q159 VanDerWaalsContact O-N 3.12Å; E157-Q159 VanDerWaalsContact C-N 3.27Å; E157-Q159 PolarHBondContact O-N 3.26Å; Q159-M161 VanDerWaalsContact C-N 3.32Å; Q159-M161 PolarHBondContact O-N 3.11Å; Q159-F162 PolarHBondContact O-N 3.32Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.35Å; Q159-E163 PolarHBondContact NE2-OE1 3.31Å; Q159-E163 WeakPolarHBondContact O-CG 3.24Å; Q159-E163 PolarHBondContact O-N 2.82Å
160	L	94.3	Very high	92.6	Very high	56 Å²	56	68.3 Å²	68.3	29%	0.293	33%	0.326	S	S	.	.	H	α-helix	trans	-58.5	-44.4	176	-69.4	-178.9	0	0	0	111.7	Y156 E157 F162 E163 H164	Y156-L160 HydrophobicContact CD1-CD1 3.94Å; Y156-L160 HydrophobicContact CD1-CG 4.39Å; Y156-L160 HydrophobicContact CE1-CD1 3.4Å; Y156-L160 HydrophobicContact CE1-CG 4.01Å; Y156-L160 PolarHBondContact O-N 3.02Å; E157-L160 PolarHBondContact O-N 2.9Å; L160-F162 VanDerWaalsContact C-N 3.32Å; L160-F162 PolarHBondContact O-N 3.19Å; L160-E163 CarbonylContact O-C 3.57Å; L160-E163 PolarHBondContact O-N 3.4Å; L160-E163 VanDerWaalsContact O-N 3.14Å; L160-H164 WeakPolarHBondContact O-CB 3.48Å; L160-H164 PolarHBondContact O-N 3.48Å
161	M	95.9	Very high	92.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.1	-44.6	176	-179.2	-161.3	70.6	0	0	112.1	P118 L122 M142 E157 L158 Q159 H164 F167 L196	P118-M161 HydrophobicContact CB-CB 4.1Å; P118-M161 HydrophobicContact CB-CG 3.97Å; P118-M161 HydrophobicContact CB-SD 4.02Å; L122-M161 HydrophobicContact CD1-CG 3.96Å; M142-M161 HydrophobicContact CE-CG 3.61Å; M142-M161 HydrophobicContact CE-SD 3.57Å; M142-M161 VanDerWaalsContact CE-SD 3.57Å; E157-M161 WeakPolarHBondContact O-CB 3.49Å; E157-M161 PolarHBondContact O-N 3.02Å; L158-M161 HydrophobicContact CD2-CE 3.85Å; L158-M161 HydrophobicContact CD2-SD 4.17Å; L158-M161 WeakPolarHBondContact O-CB 3.09Å; L158-M161 PolarHBondContact O-N 3.18Å; Q159-M161 VanDerWaalsContact C-N 3.32Å; Q159-M161 PolarHBondContact O-N 3.11Å; M161-H164 WeakPolarHBondContact O-CB 3.32Å; M161-H164 PolarHBondContact O-N 2.99Å; M161-F167 HydrophobicContact CE-CE1 4Å; M161-F167 HydrophobicContact CE-CE2 3.97Å; M161-F167 HydrophobicContact CE-CZ 3.58Å; M161-F167 HydrophobicContact CG-CD2 3.77Å; M161-F167 HydrophobicContact CG-CE2 3.84Å; M161-F167 HydrophobicContact CG-CG 4.18Å; M161-F167 HydrophobicContact CG-CZ 4.31Å; M161-F167 VanDerWaalsContact O-CB 3.23Å; M161-F167 WeakPolarHBondContact O-CB 3.22Å; M161-F167 WeakPolarHBondContact O-CG 3.38Å; M161-F167 HydrophobicContact SD-CD2 4.22Å; M161-F167 HydrophobicContact SD-CE2 3.66Å; M161-F167 HydrophobicContact SD-CZ 3.92Å; M161-L196 HydrophobicContact CE-CB 4.38Å; M161-L196 HydrophobicContact SD-CB 4.44Å; M161-L196 HydrophobicContact SD-CD1 4.49Å; M161-L196 HydrophobicContact SD-CD2 3.97Å
162	F	94.2	Very high	93	Very high	83 Å²	83	65.3 Å²	65.3	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-71.4	-28.2	178.5	-78.8	-68.8	0	0	0	113.4	L158 Q159 L160 H164 F167	L158-F162 WeakPolarHBondContact O-CD2 3.33Å; L158-F162 PolarHBondContact O-N 3.26Å; L158-F162 VanDerWaalsContact O-N 3.07Å; Q159-F162 PolarHBondContact O-N 3.32Å; L160-F162 VanDerWaalsContact C-N 3.32Å; L160-F162 PolarHBondContact O-N 3.19Å; F162-H164 VanDerWaalsContact C-N 3.35Å; F162-F167 HydrophobicContact CD1-CD1 4.08Å; F162-F167 AromaticContact CD1-CE1 3.6Å; F162-F167 HydrophobicContact CD1-CE1 3.6Å; F162-F167 HydrophobicContact CE1-CD1 4.5Å; F162-F167 AromaticContact CE1-CE1 3.59Å; F162-F167 HydrophobicContact CE1-CE1 3.59Å; F162-F167 HydrophobicContact CE1-CZ 4.27Å; F162-F167 HydrophobicContact CG-CE1 4.5Å; F162-F167 HydrophobicContact CZ-CE1 4.46Å
163	E	93.6	Very high	93.1	Very high	104 Å²	104	62.8 Å²	62.8	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-82.6	-15	176.3	-68.9	174	-178.9	0	0	112.2	K11 Q159 L160	K11-E163 WeakPolarHBondContact CE-OE1 3.41Å; K11-E163 IonicContact NZ-OE1 3.31Å; K11-E163 PolarHBondContact NZ-OE1 3.41Å; Q159-E163 WeakPolarHBondContact CG-OE1 3.35Å; Q159-E163 PolarHBondContact NE2-OE1 3.31Å; Q159-E163 WeakPolarHBondContact O-CG 3.24Å; Q159-E163 PolarHBondContact O-N 2.82Å; L160-E163 CarbonylContact O-C 3.57Å; L160-E163 PolarHBondContact O-N 3.4Å; L160-E163 VanDerWaalsContact O-N 3.14Å
164	H	94.4	Very high	93.2	Very high	35 Å²	35	57.2 Å²	57.2	16%	0.162	26%	0.262	C	S	.	.	S	Bend	trans	-73.4	129.3	-176.7	-169.3	-70.4	0	0	0	112.4	L122 D123 L160 M161 F162 E166 F167	L122-H164 HydrophobicContact CD1-CB 3.71Å; D123-H164 IonicContact OD1-NE2 2.79Å; D123-H164 PolarHBondContact OD1-NE2 3.09Å; L160-H164 WeakPolarHBondContact O-CB 3.48Å; L160-H164 PolarHBondContact O-N 3.48Å; M161-H164 WeakPolarHBondContact O-CB 3.32Å; M161-H164 PolarHBondContact O-N 2.99Å; F162-H164 VanDerWaalsContact C-N 3.35Å; H164-E166 VanDerWaalsContact C-N 3.34Å; H164-E166 PolarHBondContact ND1-N 3.42Å; H164-E166 VanDerWaalsContact ND1-N 3.12Å; H164-E166 PolarHBondContact O-N 3.49Å; H164-F167 WeakPolarHBondContact O-CB 3.36Å; H164-F167 PolarHBondContact O-N 3.43Å; H164-F167 VanDerWaalsContact O-N 3.12Å
165	P	90.8	Very high	93.3	Very high	101 Å²	101	55.1 Å²	55.1	66%	0.656	26%	0.257	S	S	*	.	H	α-helix	trans	-61.7	-35.4	-172.7	23	-34.1	0	0	0	114.2	F167	P165-F167 VanDerWaalsContact C-N 3.3Å; P165-F167 PolarHBondContact O-N 3.22Å
166	E	92.9	Very high	93.3	Very high	40 Å²	40	58.1 Å²	58.1	19%	0.187	27%	0.268	C	S	.	.	H	α-helix	trans	-76.3	-8.9	179.7	-68.5	-54.8	133.4	0	0	115.3	H164 N169 L170	H164-E166 VanDerWaalsContact C-N 3.34Å; H164-E166 PolarHBondContact ND1-N 3.42Å; H164-E166 VanDerWaalsContact ND1-N 3.12Å; H164-E166 PolarHBondContact O-N 3.49Å; E166-N169 PolarHBondContact O-N 3Å; E166-N169 PolarHBondContact OE1-ND2 2.94Å; E166-N169 WeakPolarHBondContact OE2-CB 3.25Å; E166-N169 PolarHBondContact OE2-ND2 3.39Å; E166-L170 WeakPolarHBondContact O-CB 3.1Å; E166-L170 PolarHBondContact O-N 2.92Å
167	F	94.8	Very high	93	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.039	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-47.6	-176.6	-176.7	-122.3	0	0	0	111.9	L122 M142 M161 F162 H164 P165 N169 L170 L171 V198	L122-F167 HydrophobicContact CD1-CB 3.85Å; L122-F167 HydrophobicContact CD1-CD2 4.13Å; L122-F167 HydrophobicContact CD1-CG 4.37Å; L122-F167 HydrophobicContact CD2-CB 4.29Å; L122-F167 HydrophobicContact CD2-CD2 4.18Å; M142-F167 HydrophobicContact CE-CD2 3.88Å; M142-F167 HydrophobicContact CE-CE2 3.85Å; M161-F167 HydrophobicContact CE-CE1 4Å; M161-F167 HydrophobicContact CE-CE2 3.97Å; M161-F167 HydrophobicContact CE-CZ 3.58Å; M161-F167 HydrophobicContact CG-CD2 3.77Å; M161-F167 HydrophobicContact CG-CE2 3.84Å; M161-F167 HydrophobicContact CG-CG 4.18Å; M161-F167 HydrophobicContact CG-CZ 4.31Å; M161-F167 VanDerWaalsContact O-CB 3.23Å; M161-F167 WeakPolarHBondContact O-CB 3.22Å; M161-F167 WeakPolarHBondContact O-CG 3.38Å; M161-F167 HydrophobicContact SD-CD2 4.22Å; M161-F167 HydrophobicContact SD-CE2 3.66Å; M161-F167 HydrophobicContact SD-CZ 3.92Å; F162-F167 HydrophobicContact CD1-CD1 4.08Å; F162-F167 AromaticContact CD1-CE1 3.6Å; F162-F167 HydrophobicContact CD1-CE1 3.6Å; F162-F167 HydrophobicContact CE1-CD1 4.5Å; F162-F167 AromaticContact CE1-CE1 3.59Å; F162-F167 HydrophobicContact CE1-CE1 3.59Å; F162-F167 HydrophobicContact CE1-CZ 4.27Å; F162-F167 HydrophobicContact CG-CE1 4.5Å; F162-F167 HydrophobicContact CZ-CE1 4.46Å; H164-F167 WeakPolarHBondContact O-CB 3.36Å; H164-F167 PolarHBondContact O-N 3.43Å; H164-F167 VanDerWaalsContact O-N 3.12Å; P165-F167 VanDerWaalsContact C-N 3.3Å; P165-F167 PolarHBondContact O-N 3.22Å; F167-N169 VanDerWaalsContact C-N 3.32Å; F167-N169 PolarHBondContact O-N 3.48Å; F167-L170 PolarHBondContact O-N 3.38Å; F167-L171 HydrophobicContact CD1-CD1 4.29Å; F167-L171 HydrophobicContact CE1-CD1 3.78Å; F167-L171 HydrophobicContact CE2-CD1 4.39Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.31Å; F167-L171 HydrophobicContact CZ-CD1 3.85Å; F167-L171 HydrophobicContact CZ-CD2 4.35Å; F167-L171 HydrophobicContact CZ-CG 4.26Å; F167-L171 WeakPolarHBondContact O-CG 3.48Å; F167-L171 PolarHBondContact O-N 2.71Å; F167-V198 HydrophobicContact CE1-CG2 4.46Å; F167-V198 HydrophobicContact CZ-CG2 3.94Å
168	E	92.3	Very high	92.9	Very high	102 Å²	102	50.7 Å²	50.7	48%	0.477	24%	0.239	S	C	.	.	H	α-helix	trans	-64.4	-38.9	177	-176.3	56.8	-149.4	0	0	111.2	L170 L171 Q172	E168-L170 VanDerWaalsContact C-N 3.34Å; E168-L170 PolarHBondContact O-N 2.98Å; E168-L171 PolarHBondContact O-N 3.02Å; E168-Q172 VanDerWaalsContact O-CG 3.31Å; E168-Q172 WeakPolarHBondContact O-CG 3.48Å; E168-Q172 PolarHBondContact O-N 2.86Å; E168-Q172 PolarHBondContact OE1-NE2 3.31Å; E168-Q172 VanDerWaalsContact OE1-NE2 3.15Å
169	N	91.9	Very high	92.6	Very high	62 Å²	62	55.6 Å²	55.6	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-43.8	174.6	-72.5	-23.2	0	0	0	111.8	E166 F167 Q172 R173	E166-N169 PolarHBondContact O-N 3Å; E166-N169 PolarHBondContact OE1-ND2 2.94Å; E166-N169 WeakPolarHBondContact OE2-CB 3.25Å; E166-N169 PolarHBondContact OE2-ND2 3.39Å; F167-N169 VanDerWaalsContact C-N 3.32Å; F167-N169 PolarHBondContact O-N 3.48Å; N169-Q172 PolarHBondContact O-N 3.16Å; N169-R173 WeakPolarHBondContact O-CB 3.3Å; N169-R173 VanDerWaalsContact O-CG 3.28Å; N169-R173 WeakPolarHBondContact O-CG 3.27Å; N169-R173 PolarHBondContact O-N 2.88Å
170	L	94	Very high	92.4	Very high	1 Å²	1	59 Å²	59	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-43.6	177.6	-177.7	63.8	0	0	0	111.5	L122 T125 P130 I135 C138 L139 M142 E166 F167 E168 R173 A174	L122-L170 HydrophobicContact CD2-CB 4.33Å; L122-L170 HydrophobicContact CD2-CD2 3.79Å; T125-L170 HydrophobicContact CG2-CD1 4.32Å; P130-L170 HydrophobicContact CG-CD1 4.47Å; I135-L170 HydrophobicContact CG2-CD1 4.24Å; C138-L170 HydrophobicContact CB-CD1 4.48Å; C138-L170 HydrophobicContact CB-CD2 4.44Å; L139-L170 HydrophobicContact CD2-CD2 4.1Å; L139-L170 HydrophobicContact CD2-CG 4.41Å; M142-L170 HydrophobicContact SD-CD2 3.67Å; E166-L170 WeakPolarHBondContact O-CB 3.1Å; E166-L170 PolarHBondContact O-N 2.92Å; F167-L170 PolarHBondContact O-N 3.38Å; E168-L170 VanDerWaalsContact C-N 3.34Å; E168-L170 PolarHBondContact O-N 2.98Å; L170-R173 PolarHBondContact O-N 3.31Å; L170-A174 WeakPolarHBondContact O-CB 3.33Å; L170-A174 PolarHBondContact O-N 3.4Å
171	L	94.4	Very high	92.2	Very high	6 Å²	6	56.6 Å²	56.6	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-37.9	177.1	-65.9	-177	0	0	0	112.7	L139 F167 E168 A174 T175 V193 V198 V204	L139-L171 HydrophobicContact CD2-CD2 4.24Å; F167-L171 HydrophobicContact CD1-CD1 4.29Å; F167-L171 HydrophobicContact CE1-CD1 3.78Å; F167-L171 HydrophobicContact CE2-CD1 4.39Å; F167-L171 HydrophobicContact CE2-CD2 4.33Å; F167-L171 HydrophobicContact CE2-CG 4.31Å; F167-L171 HydrophobicContact CZ-CD1 3.85Å; F167-L171 HydrophobicContact CZ-CD2 4.35Å; F167-L171 HydrophobicContact CZ-CG 4.26Å; F167-L171 WeakPolarHBondContact O-CG 3.48Å; F167-L171 PolarHBondContact O-N 2.71Å; E168-L171 PolarHBondContact O-N 3.02Å; L171-A174 WeakPolarHBondContact O-CB 3.18Å; L171-A174 PolarHBondContact O-N 3.08Å; L171-T175 PolarHBondContact O-N 2.93Å; L171-T175 PolarHBondContact O-OG1 3.22Å; L171-V193 HydrophobicContact CD2-CG1 3.93Å; L171-V198 HydrophobicContact CD1-CG1 4.41Å; L171-V198 HydrophobicContact CD1-CG2 4.14Å; L171-V198 HydrophobicContact CD2-CG2 4.44Å; L171-V204 HydrophobicContact CB-CG1 4.44Å; L171-V204 HydrophobicContact CB-CG2 3.89Å; L171-V204 HydrophobicContact CD2-CG1 4.38Å
172	Q	92.4	Very high	91.9	Very high	76 Å²	76	58.3 Å²	58.3	36%	0.355	28%	0.277	S	S	.	.	H	α-helix	trans	-66.2	-42.3	173.7	-72	-179.9	16.5	0	0	111.9	E168 N169 A174 T175 R176	E168-Q172 VanDerWaalsContact O-CG 3.31Å; E168-Q172 WeakPolarHBondContact O-CG 3.48Å; E168-Q172 PolarHBondContact O-N 2.86Å; E168-Q172 PolarHBondContact OE1-NE2 3.31Å; E168-Q172 VanDerWaalsContact OE1-NE2 3.15Å; N169-Q172 PolarHBondContact O-N 3.16Å; Q172-A174 VanDerWaalsContact C-N 3.34Å; Q172-T175 PolarHBondContact O-N 3Å; Q172-R176 WeakPolarHBondContact O-CG 3.26Å; Q172-R176 PolarHBondContact O-N 2.81Å
173	R	91.4	Very high	91.7	Very high	86 Å²	86	56.4 Å²	56.4	33%	0.325	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-42.1	173	-72.8	176.7	-171	173.7	6.5	111.1	I135 N169 L170 T175 R176 S177	I135-R173 HydrophobicContact CD1-CB 3.89Å; N169-R173 WeakPolarHBondContact O-CB 3.3Å; N169-R173 VanDerWaalsContact O-CG 3.28Å; N169-R173 WeakPolarHBondContact O-CG 3.27Å; N169-R173 PolarHBondContact O-N 2.88Å; L170-R173 PolarHBondContact O-N 3.31Å; R173-T175 VanDerWaalsContact C-N 3.31Å; R173-T175 PolarHBondContact O-N 3.07Å; R173-R176 PolarHBondContact O-N 2.79Å; R173-S177 VanDerWaalsContact O-CB 3.31Å; R173-S177 WeakPolarHBondContact O-CB 3.43Å; R173-S177 PolarHBondContact O-N 2.86Å; R173-S177 PolarHBondContact O-OG 3.19Å
174	A	93.1	Very high	91.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-43.9	174.9	0	0	0	0	0	111.7	I135 L139 L170 L171 Q172 R176 S177 I178 F208	I135-A174 HydrophobicContact CG2-CB 3.62Å; L139-A174 HydrophobicContact CD1-CB 4.09Å; L170-A174 WeakPolarHBondContact O-CB 3.33Å; L170-A174 PolarHBondContact O-N 3.4Å; L171-A174 WeakPolarHBondContact O-CB 3.18Å; L171-A174 PolarHBondContact O-N 3.08Å; Q172-A174 VanDerWaalsContact C-N 3.34Å; A174-R176 PolarHBondContact O-N 3.42Å; A174-S177 WeakPolarHBondContact CA-OG 3.39Å; A174-S177 PolarHBondContact O-N 2.92Å; A174-S177 PolarHBondContact O-OG 3.32Å; A174-I178 PolarHBondContact O-N 2.98Å; A174-I178 VanDerWaalsContact O-N 3.1Å; A174-F208 HydrophobicContact CB-CE2 4.29Å; A174-F208 HydrophobicContact CB-CZ 4.19Å
175	T	93.1	Very high	91.3	Very high	25 Å²	25	55.6 Å²	55.6	15%	0.153	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-40	177.7	-53	0	0	0	0	112.3	L171 Q172 R173 I178 T207	L171-T175 PolarHBondContact O-N 2.93Å; L171-T175 PolarHBondContact O-OG1 3.22Å; Q172-T175 PolarHBondContact O-N 3Å; R173-T175 VanDerWaalsContact C-N 3.31Å; R173-T175 PolarHBondContact O-N 3.07Å; T175-I178 VanDerWaalsContact O-CG2 3.31Å; T175-I178 WeakPolarHBondContact O-CG2 3.23Å; T175-T207 HydrophobicContact CG2-CG2 3.88Å
176	R	90.6	Very high	91.5	Very high	182 Å²	182	50.8 Å²	50.8	69%	0.687	24%	0.238	S	C	*	.	H	α-helix	trans	-74.4	-32.2	179.1	-68.1	175.9	-171	170.2	5.9	113.2	Q172 R173 A174	Q172-R176 WeakPolarHBondContact O-CG 3.26Å; Q172-R176 PolarHBondContact O-N 2.81Å; R173-R176 PolarHBondContact O-N 2.79Å; A174-R176 PolarHBondContact O-N 3.42Å
177	S	88.1	Confident	91.5	Very high	2 Å²	2	49 Å²	49	1%	0.014	23%	0.229	C	C	.	.	H	α-helix	trans	-89.2	-8.5	-175.6	56.2	0	0	0	0	113.9	N132 I135 R173 A174 Q179 Y180 M181	N132-S177 WeakPolarHBondContact OD1-CB 3.46Å; I135-S177 VanDerWaalsContact CD1-OG 3.23Å; I135-S177 WeakPolarHBondContact CD1-OG 3.36Å; R173-S177 VanDerWaalsContact O-CB 3.31Å; R173-S177 WeakPolarHBondContact O-CB 3.43Å; R173-S177 PolarHBondContact O-N 2.86Å; R173-S177 PolarHBondContact O-OG 3.19Å; A174-S177 WeakPolarHBondContact CA-OG 3.39Å; A174-S177 PolarHBondContact O-N 2.92Å; A174-S177 PolarHBondContact O-OG 3.32Å; S177-Q179 PolarHBondContact O-N 3.41Å; S177-Q179 VanDerWaalsContact O-N 3.12Å; S177-Y180 PolarHBondContact O-N 3.42Å; S177-M181 PolarHBondContact O-N 2.99Å; S177-M181 VanDerWaalsContact OG-CE 3.32Å; S177-M181 WeakPolarHBondContact OG-CE 3.4Å
178	I	90.9	Very high	91.3	Very high	11 Å²	11	52.5 Å²	52.5	6%	0.056	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-54.5	-35.9	-174	-159	172.8	0	0	0	113.6	A174 T175 Y180 M181 V186 T207 F208 T211	A174-I178 PolarHBondContact O-N 2.98Å; A174-I178 VanDerWaalsContact O-N 3.1Å; T175-I178 VanDerWaalsContact O-CG2 3.31Å; T175-I178 WeakPolarHBondContact O-CG2 3.23Å; I178-Y180 PolarHBondContact O-N 3.37Å; I178-M181 PolarHBondContact O-N 3.22Å; I178-V186 HydrophobicContact CD1-CG1 4.44Å; I178-V186 HydrophobicContact CG1-CG2 4.13Å; I178-T207 HydrophobicContact CD1-CG2 4.34Å; I178-T207 HydrophobicContact CG2-CG2 4.29Å; I178-F208 HydrophobicContact CD1-CB 4.29Å; I178-F208 HydrophobicContact CD1-CD1 3.37Å; I178-F208 HydrophobicContact CD1-CD2 4.27Å; I178-F208 HydrophobicContact CD1-CE1 3.56Å; I178-F208 HydrophobicContact CD1-CE2 4.44Å; I178-F208 HydrophobicContact CD1-CG 3.73Å; I178-F208 HydrophobicContact CD1-CZ 4.11Å; I178-F208 HydrophobicContact CG1-CD1 4.17Å; I178-F208 HydrophobicContact CG1-CE1 3.9Å; I178-F208 HydrophobicContact CG1-CZ 4.43Å; I178-T211 HydrophobicContact CD1-CG2 4.07Å; I178-T211 HydrophobicContact CG1-CG2 4.09Å
179	Q	88	Confident	91.4	Very high	118 Å²	118	47.7 Å²	47.7	55%	0.551	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-65.2	-23	178.9	66.8	-173.8	0.5	0	0	113.2	S177 R215	S177-Q179 PolarHBondContact O-N 3.41Å; S177-Q179 VanDerWaalsContact O-N 3.12Å; Q179-R215 PolarHBondContact O-NH2 3.38Å
180	Y	89	Confident	91.5	Very high	140 Å²	140	44.7 Å²	44.7	55%	0.549	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-99.3	-4.3	179.4	-50.5	-72	0	0	0	113.5	N132 S177 I178	N132-Y180 VanDerWaalsContact ND2-CD2 3.26Å; N132-Y180 WeakPolarHBondContact ND2-CD2 3.25Å; S177-Y180 PolarHBondContact O-N 3.42Å; I178-Y180 PolarHBondContact O-N 3.37Å
181	M	89.8	Confident	91.5	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.025	21%	0.208	C	C	.	.	S	Bend	trans	-76.6	146.5	176	-66.8	-175.7	-178.3	0	0	110.5	I135 S177 I178 D185 V186 F208 R215	I135-M181 HydrophobicContact CB-CE 4.02Å; I135-M181 HydrophobicContact CG2-CE 3.88Å; S177-M181 PolarHBondContact O-N 2.99Å; S177-M181 VanDerWaalsContact OG-CE 3.32Å; S177-M181 WeakPolarHBondContact OG-CE 3.4Å; I178-M181 PolarHBondContact O-N 3.22Å; M181-D185 HydrophobicContact CB-CB 3.99Å; M181-V186 HydrophobicContact CB-CG2 3.71Å; M181-F208 HydrophobicContact SD-CE1 4.4Å; M181-R215 PolarHBondContact O-NH1 3.19Å
182	G	89.7	Confident	91.5	Very high	36 Å²	36	45.2 Å²	45.2	37%	0.371	21%	0.207	S	C	.	.			trans	-68.2	164.9	169.2	0	0	0	0	0	111.9	E184 D185 V186	G182-E184 PolarHBondContact O-N 3.12Å; G182-D185 WeakPolarHBondContact O-CB 3.46Å; G182-D185 PolarHBondContact O-N 3.32Å; G182-V186 WeakPolarHBondContact O-CG2 3.22Å; G182-V186 PolarHBondContact O-N 2.98Å
183	N	91	Very high	91.6	Very high	44 Å²	44	41.6 Å²	41.6	24%	0.235	19%	0.191	C	C	.	.	H	α-helix	trans	-62.2	-42.9	-177.1	-71.5	-16	0	0	0	112.7	V186 A187 R215 D218 F219	N183-V186 PolarHBondContact O-N 2.68Å; N183-A187 PolarHBondContact O-N 2.77Å; N183-R215 WeakPolarHBondContact OD1-CD 3.48Å; N183-D218 VanDerWaalsContact ND2-CB 3.29Å; N183-D218 WeakPolarHBondContact ND2-CB 3.34Å; N183-D218 PolarHBondContact ND2-O 2.76Å; N183-F219 HydrophobicContact CB-CD1 3.65Å; N183-F219 HydrophobicContact CB-CE1 3.73Å
184	E	89.4	Confident	91.7	Very high	79 Å²	79	38.9 Å²	38.9	37%	0.369	18%	0.183	S	C	.	.	H	α-helix	trans	-59.3	-48	172.8	-67.3	-170.5	140.7	0	0	111.1	G182 V186 A187 Y188	G182-E184 PolarHBondContact O-N 3.12Å; E184-V186 VanDerWaalsContact C-N 3.29Å; E184-V186 PolarHBondContact O-N 2.87Å; E184-A187 PolarHBondContact O-N 3Å; E184-A187 VanDerWaalsContact O-N 3.1Å; E184-Y188 HydrophobicContact CB-CD2 4.38Å; E184-Y188 VanDerWaalsContact O-CD2 3.28Å; E184-Y188 WeakPolarHBondContact O-CD2 3.39Å; E184-Y188 PolarHBondContact O-N 3.23Å
185	D	90.7	Very high	91.6	Very high	43 Å²	43	40.3 Å²	40.3	23%	0.23	19%	0.191	C	C	.	.	H	α-helix	trans	-58.6	-39.2	-179.8	-75.4	-48.2	0	0	0	112.8	S136 M181 G182 S189	S136-D185 WeakPolarHBondContact CB-OD1 3.47Å; S136-D185 WeakPolarHBondContact OG-CA 3.38Å; S136-D185 WeakPolarHBondContact OG-CB 3.5Å; S136-D185 PolarHBondContact OG-O 3.42Å; S136-D185 PolarHBondContact OG-OD1 2.99Å; M181-D185 HydrophobicContact CB-CB 3.99Å; G182-D185 WeakPolarHBondContact O-CB 3.46Å; G182-D185 PolarHBondContact O-N 3.32Å; D185-S189 WeakPolarHBondContact O-CB 3.42Å; D185-S189 PolarHBondContact O-N 3.31Å; D185-S189 PolarHBondContact O-OG 2.88Å
186	V	93.8	Very high	91.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.6	-46.7	175.9	174.5	0	0	0	0	110.4	I178 M181 G182 N183 E184 S189 L190 F208 T211	I178-V186 HydrophobicContact CD1-CG1 4.44Å; I178-V186 HydrophobicContact CG1-CG2 4.13Å; M181-V186 HydrophobicContact CB-CG2 3.71Å; G182-V186 WeakPolarHBondContact O-CG2 3.22Å; G182-V186 PolarHBondContact O-N 2.98Å; N183-V186 PolarHBondContact O-N 2.68Å; E184-V186 VanDerWaalsContact C-N 3.29Å; E184-V186 PolarHBondContact O-N 2.87Å; V186-S189 PolarHBondContact O-N 3.11Å; V186-L190 WeakPolarHBondContact O-CB 3.44Å; V186-L190 PolarHBondContact O-N 2.95Å; V186-F208 HydrophobicContact CG1-CD1 4.12Å; V186-T211 HydrophobicContact CG1-CG2 4.26Å
187	A	92.8	Very high	91.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-65.3	-43.3	179	0	0	0	0	0	112.2	N183 E184 L190 L191 F219 A223 M226	N183-A187 PolarHBondContact O-N 2.77Å; E184-A187 PolarHBondContact O-N 3Å; E184-A187 VanDerWaalsContact O-N 3.1Å; A187-L190 PolarHBondContact O-N 2.93Å; A187-L191 PolarHBondContact O-N 3.33Å; A187-F219 HydrophobicContact CB-CE2 4.26Å; A187-A223 HydrophobicContact CB-CB 4.23Å; A187-M226 HydrophobicContact CB-CB 4.15Å
188	Y	91	Very high	91.9	Very high	84 Å²	84	33.2 Å²	33.2	33%	0.329	18%	0.177	S	C	.	.	H	α-helix	trans	-64.5	-41.4	175.5	-89.3	-79.6	0	0	0	112.4	E184 L191 S192 M226	E184-Y188 HydrophobicContact CB-CD2 4.38Å; E184-Y188 VanDerWaalsContact O-CD2 3.28Å; E184-Y188 WeakPolarHBondContact O-CD2 3.39Å; E184-Y188 PolarHBondContact O-N 3.23Å; Y188-L191 PolarHBondContact O-N 3.01Å; Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.29Å; Y188-S192 PolarHBondContact O-N 3.26Å; Y188-S192 PolarHBondContact O-OG 3.42Å; Y188-M226 HydrophobicContact CD1-CE 3.18Å; Y188-M226 HydrophobicContact CD2-CE 4.12Å; Y188-M226 HydrophobicContact CE1-CE 3.16Å; Y188-M226 HydrophobicContact CE1-SD 3.95Å; Y188-M226 HydrophobicContact CE2-CE 4.11Å; Y188-M226 HydrophobicContact CE2-CG 4.29Å; Y188-M226 HydrophobicContact CG-CE 3.67Å
189	S	93.9	Very high	91.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-45.7	176.9	-65.4	0	0	0	0	111	S136 D185 V186 S192 V193	S136-S189 WeakPolarHBondContact CA-OG 3.34Å; S136-S189 WeakPolarHBondContact CB-OG 3.38Å; S136-S189 PolarHBondContact OG-OG 3.31Å; D185-S189 WeakPolarHBondContact O-CB 3.42Å; D185-S189 PolarHBondContact O-N 3.31Å; D185-S189 PolarHBondContact O-OG 2.88Å; V186-S189 PolarHBondContact O-N 3.11Å; S189-S192 PolarHBondContact O-N 3.48Å; S189-V193 WeakPolarHBondContact O-CG2 3.27Å; S189-V193 PolarHBondContact O-N 2.92Å
190	L	95.2	Very high	92.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-46.1	174.9	175.8	59.4	0	0	0	111.6	V186 A187 S192 V193 V194 I205 F208 L209 L227 V230	V186-L190 WeakPolarHBondContact O-CB 3.44Å; V186-L190 PolarHBondContact O-N 2.95Å; A187-L190 PolarHBondContact O-N 2.93Å; L190-S192 VanDerWaalsContact C-N 3.31Å; L190-S192 PolarHBondContact O-N 2.81Å; L190-V193 WeakPolarHBondContact O-CG2 2.99Å; L190-V194 HydrophobicContact CD1-CG2 3.91Å; L190-V194 WeakPolarHBondContact O-CB 3.47Å; L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.44Å; L190-V194 PolarHBondContact O-N 2.91Å; L190-V194 VanDerWaalsContact O-N 3.14Å; L190-I205 HydrophobicContact CD1-CG2 4.45Å; L190-F208 HydrophobicContact CB-CB 4.13Å; L190-F208 HydrophobicContact CB-CD1 4.19Å; L190-F208 HydrophobicContact CB-CG 4.34Å; L190-F208 HydrophobicContact CD1-CB 3.8Å; L190-F208 HydrophobicContact CG-CB 4.37Å; L190-L209 HydrophobicContact CD1-CD2 4.48Å; L190-L209 HydrophobicContact CD2-CD2 4.02Å; L190-L227 HydrophobicContact CD2-CD1 3.82Å; L190-V230 HydrophobicContact CD2-CG1 4.45Å; L190-V230 HydrophobicContact CG-CG1 4.17Å
191	L	93.3	Very high	92.3	Very high	16 Å²	16	32.4 Å²	32.4	8%	0.084	19%	0.185	C	C	.	.	H	α-helix	trans	-54.8	-52.5	174.2	175.8	70.4	0	0	0	110.2	W143 A187 Y188 V194 N195 M226 V230	W143-L191 HydrophobicContact CH2-CD1 3.56Å; W143-L191 HydrophobicContact CH2-CD2 4.08Å; W143-L191 HydrophobicContact CH2-CG 3.6Å; W143-L191 HydrophobicContact CZ2-CD1 4.26Å; W143-L191 HydrophobicContact CZ2-CD2 4.07Å; W143-L191 HydrophobicContact CZ2-CG 4.1Å; W143-L191 HydrophobicContact CZ3-CD1 4.16Å; W143-L191 HydrophobicContact CZ3-CG 3.93Å; W143-L191 WeakPolarHBondContact CZ3-O 3.22Å; A187-L191 PolarHBondContact O-N 3.33Å; Y188-L191 PolarHBondContact O-N 3.01Å; L191-V194 PolarHBondContact O-N 3.35Å; L191-N195 PolarHBondContact O-N 3.06Å; L191-N195 PolarHBondContact O-ND2 3.1Å; L191-N195 VanDerWaalsContact O-ND2 3.12Å; L191-M226 HydrophobicContact CB-CE 4.02Å; L191-M226 HydrophobicContact CD2-CE 3.16Å; L191-M226 HydrophobicContact CD2-SD 4.04Å; L191-M226 HydrophobicContact CG-CE 4.16Å; L191-V230 VanDerWaalsContact CA-CG2 3.41Å; L191-V230 HydrophobicContact CB-CG2 3.54Å; L191-V230 HydrophobicContact CD1-CG2 3.39Å; L191-V230 HydrophobicContact CG-CG2 4.05Å
192	S	94.1	Very high	92.5	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-53.6	-174.7	-61.2	0	0	0	0	111.6	S140 Y188 S189 L190 V194 N195 L196	S140-S192 WeakPolarHBondContact CA-OG 3.41Å; Y188-S192 VanDerWaalsContact O-CB 3.29Å; Y188-S192 WeakPolarHBondContact O-CB 3.29Å; Y188-S192 PolarHBondContact O-N 3.26Å; Y188-S192 PolarHBondContact O-OG 3.42Å; S189-S192 PolarHBondContact O-N 3.48Å; L190-S192 VanDerWaalsContact C-N 3.31Å; L190-S192 PolarHBondContact O-N 2.81Å; S192-V194 VanDerWaalsContact C-N 3.28Å; S192-V194 PolarHBondContact O-N 3.34Å; S192-N195 PolarHBondContact O-N 3.49Å; S192-L196 WeakPolarHBondContact O-CB 3.35Å; S192-L196 WeakPolarHBondContact O-CG 3.45Å; S192-L196 PolarHBondContact O-N 3.45Å
193	V	94.6	Very high	92.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-35	-179.2	-61.1	0	0	0	0	112.2	L139 L171 S189 L190 G197 V198 I205	L139-V193 HydrophobicContact CD1-CG1 3.97Å; L139-V193 HydrophobicContact CD2-CG1 4.07Å; L171-V193 HydrophobicContact CD2-CG1 3.93Å; S189-V193 WeakPolarHBondContact O-CG2 3.27Å; S189-V193 PolarHBondContact O-N 2.92Å; L190-V193 WeakPolarHBondContact O-CG2 2.99Å; V193-G197 PolarHBondContact O-N 3.42Å; V193-V198 HydrophobicContact CB-CB 4.3Å; V193-V198 HydrophobicContact CB-CG2 4.07Å; V193-V198 VanDerWaalsContact O-CB 3.31Å; V193-V198 WeakPolarHBondContact O-CB 3.46Å; V193-V198 WeakPolarHBondContact O-CG2 3.4Å; V193-V198 PolarHBondContact O-N 3.14Å; V193-V198 VanDerWaalsContact O-N 3.1Å; V193-I205 HydrophobicContact CG2-CG1 4.03Å
194	V	93.6	Very high	92.9	Very high	28 Å²	28	39.9 Å²	39.9	17%	0.17	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-46.1	179.3	168.3	0	0	0	0	112	L190 L191 S192 G197 I205 V230 M234	L190-V194 HydrophobicContact CD1-CG2 3.91Å; L190-V194 WeakPolarHBondContact O-CB 3.47Å; L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.44Å; L190-V194 PolarHBondContact O-N 2.91Å; L190-V194 VanDerWaalsContact O-N 3.14Å; L191-V194 PolarHBondContact O-N 3.35Å; S192-V194 VanDerWaalsContact C-N 3.28Å; S192-V194 PolarHBondContact O-N 3.34Å; V194-G197 PolarHBondContact O-N 2.97Å; V194-I205 HydrophobicContact CG2-CD1 4.01Å; V194-V230 HydrophobicContact CB-CG1 4.23Å; V194-V230 HydrophobicContact CG1-CG1 4.25Å; V194-V230 HydrophobicContact CG2-CG1 3.91Å; V194-M234 HydrophobicContact CG1-CG 4.44Å; V194-M234 HydrophobicContact CG2-CE 4.28Å; V194-M234 HydrophobicContact CG2-SD 4.35Å
195	N	90.8	Very high	93.2	Very high	30 Å²	30	36.1 Å²	36.1	16%	0.16	19%	0.186	C	C	.	.	H	α-helix	trans	-96.1	0.8	-179.3	-27.8	-137.9	0	0	0	115.2	W143 R154 L191 S192 R233	W143-N195 HydrophobicContact CE3-CB 3.68Å; W143-N195 HydrophobicContact CH2-CB 3.28Å; W143-N195 WeakPolarHBondContact CH2-ND2 3.29Å; W143-N195 HydrophobicContact CZ2-CB 4.37Å; W143-N195 VanDerWaalsContact CZ3-CA 3.47Å; W143-N195 HydrophobicContact CZ3-CB 2.89Å; W143-N195 WeakPolarHBondContact CZ3-ND2 3.33Å; R154-N195 PolarHBondContact NH2-O 3.11Å; L191-N195 PolarHBondContact O-N 3.06Å; L191-N195 PolarHBondContact O-ND2 3.1Å; L191-N195 VanDerWaalsContact O-ND2 3.12Å; S192-N195 PolarHBondContact O-N 3.49Å; N195-R233 PolarHBondContact OD1-NH1 3.37Å
196	L	92.9	Very high	93.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-9.9	152.3	-71.7	171.7	0	0	0	111.9	M142 W143 T146 L158 M161 S192	M142-L196 HydrophobicContact CB-CD1 4.02Å; M142-L196 HydrophobicContact CB-CD2 4.27Å; W143-L196 HydrophobicContact CB-CG 4.43Å; T146-L196 HydrophobicContact CG2-CD2 4.14Å; L158-L196 HydrophobicContact CD2-CD2 4.11Å; M161-L196 HydrophobicContact CE-CB 4.38Å; M161-L196 HydrophobicContact SD-CB 4.44Å; M161-L196 HydrophobicContact SD-CD1 4.49Å; M161-L196 HydrophobicContact SD-CD2 3.97Å; S192-L196 WeakPolarHBondContact O-CB 3.35Å; S192-L196 WeakPolarHBondContact O-CG 3.45Å; S192-L196 PolarHBondContact O-N 3.45Å
197	G	91.3	Very high	93.4	Very high	45 Å²	45	38.1 Å²	38.1	46%	0.464	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	91	15.9	173	0	0	0	0	0	114.5	V193 V194 A199	V193-G197 PolarHBondContact O-N 3.42Å; V194-G197 PolarHBondContact O-N 2.97Å; G197-A199 PolarHBondContact O-N 3.41Å
198	V	93.9	Very high	93.6	Very high	15 Å²	15	38 Å²	38	9%	0.091	20%	0.196	C	C	.	.			trans	-60.6	136.1	174	179.6	0	0	0	0	109.5	F167 L171 V193 Q200 I205	F167-V198 HydrophobicContact CE1-CG2 4.46Å; F167-V198 HydrophobicContact CZ-CG2 3.94Å; L171-V198 HydrophobicContact CD1-CG1 4.41Å; L171-V198 HydrophobicContact CD1-CG2 4.14Å; L171-V198 HydrophobicContact CD2-CG2 4.44Å; V193-V198 HydrophobicContact CB-CB 4.3Å; V193-V198 HydrophobicContact CB-CG2 4.07Å; V193-V198 VanDerWaalsContact O-CB 3.31Å; V193-V198 WeakPolarHBondContact O-CB 3.46Å; V193-V198 WeakPolarHBondContact O-CG2 3.4Å; V193-V198 PolarHBondContact O-N 3.14Å; V193-V198 VanDerWaalsContact O-N 3.1Å; V198-Q200 PolarHBondContact O-N 3.38Å; V198-I205 HydrophobicContact CB-CD1 4Å; V198-I205 HydrophobicContact CG1-CD1 3.99Å; V198-I205 HydrophobicContact CG1-CG1 4.12Å; V198-I205 WeakPolarHBondContact O-CD1 3.01Å
199	A	92.1	Very high	93.8	Very high	45 Å²	45	34 Å²	34	37%	0.372	18%	0.181	S	C	.	.			trans	-63.7	129.9	-173.1	0	0	0	0	0	112.1	G197 H201 S202 I205	G197-A199 PolarHBondContact O-N 3.41Å; A199-H201 PolarHBondContact O-N 2.93Å; A199-H201 VanDerWaalsContact O-N 3.09Å; A199-S202 WeakPolarHBondContact O-CB 3.48Å; A199-S202 PolarHBondContact O-N 3.02Å; A199-S202 PolarHBondContact O-OG 2.9Å; A199-I205 WeakPolarHBondContact O-CD1 3.46Å
200	Q	92.9	Very high	93.8	Very high	44 Å²	44	41 Å²	41	21%	0.206	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.2	-176	-179.7	173.5	-17	0	0	113.8	V198 S202 I205 Q206 M234 K235	V198-Q200 PolarHBondContact O-N 3.38Å; Q200-S202 VanDerWaalsContact C-N 3.3Å; Q200-I205 WeakPolarHBondContact O-CG2 3.47Å; Q200-Q206 PolarHBondContact O-NE2 3.32Å; Q200-M234 HydrophobicContact CG-CE 3.73Å; Q200-K235 PolarHBondContact NE2-O 2.92Å
201	H	90.8	Very high	93.8	Very high	163 Å²	163	41.6 Å²	41.6	76%	0.755	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-1.9	178.5	60.7	-90	0	0	0	113.6	A199	A199-H201 PolarHBondContact O-N 2.93Å; A199-H201 VanDerWaalsContact O-N 3.09Å
202	S	94.3	Very high	93.9	Very high	27 Å²	27	40.8 Å²	40.8	19%	0.189	21%	0.206	C	C	.	.	S	Bend	trans	-62.5	149	176.2	66.4	0	0	0	0	111.1	A199 Q200 V204 I205 Q206	A199-S202 WeakPolarHBondContact O-CB 3.48Å; A199-S202 PolarHBondContact O-N 3.02Å; A199-S202 PolarHBondContact O-OG 2.9Å; Q200-S202 VanDerWaalsContact C-N 3.3Å; S202-V204 PolarHBondContact O-N 2.91Å; S202-I205 PolarHBondContact O-N 3.08Å; S202-I205 PolarHBondContact OG-N 3.14Å; S202-Q206 WeakPolarHBondContact O-CG 3.29Å; S202-Q206 PolarHBondContact O-N 3.48Å; S202-Q206 VanDerWaalsContact O-N 3.07Å
203	R	93.9	Very high	93.9	Very high	204 Å²	204	43.5 Å²	43.5	77%	0.77	22%	0.219	S	C	*	.	H	α-helix	trans	-54.9	-40.8	176	-177.4	178	176	-179.1	0.8	111.6	Q206 T207	R203-Q206 PolarHBondContact O-N 3.35Å; R203-T207 WeakPolarHBondContact O-CB 3.4Å; R203-T207 PolarHBondContact O-N 2.96Å; R203-T207 PolarHBondContact O-OG1 3.43Å
204	V	95.1	Very high	93.9	Very high	11 Å²	11	49.7 Å²	49.7	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-57.3	-56.6	-179.4	-176.9	0	0	0	0	110.3	L171 S202 Q206 T207 F208	L171-V204 HydrophobicContact CB-CG1 4.44Å; L171-V204 HydrophobicContact CB-CG2 3.89Å; L171-V204 HydrophobicContact CD2-CG1 4.38Å; S202-V204 PolarHBondContact O-N 2.91Å; V204-Q206 VanDerWaalsContact C-N 3.34Å; V204-Q206 PolarHBondContact O-N 3.43Å; V204-T207 PolarHBondContact O-N 3.34Å; V204-F208 HydrophobicContact CG1-CD2 3.87Å; V204-F208 HydrophobicContact CG1-CE2 3.76Å; V204-F208 VanDerWaalsContact O-CD2 3.25Å; V204-F208 WeakPolarHBondContact O-CD2 3.44Å; V204-F208 PolarHBondContact O-N 3.45Å
205	I	95.5	Very high	93.9	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-62.1	-41.4	179.8	-71.3	-176.2	0	0	0	111.4	L190 V193 V194 V198 A199 Q200 S202 T207 F208 L209 M234	L190-I205 HydrophobicContact CD1-CG2 4.45Å; V193-I205 HydrophobicContact CG2-CG1 4.03Å; V194-I205 HydrophobicContact CG2-CD1 4.01Å; V198-I205 HydrophobicContact CB-CD1 4Å; V198-I205 HydrophobicContact CG1-CD1 3.99Å; V198-I205 HydrophobicContact CG1-CG1 4.12Å; V198-I205 WeakPolarHBondContact O-CD1 3.01Å; A199-I205 WeakPolarHBondContact O-CD1 3.46Å; Q200-I205 WeakPolarHBondContact O-CG2 3.47Å; S202-I205 PolarHBondContact O-N 3.08Å; S202-I205 PolarHBondContact OG-N 3.14Å; I205-T207 VanDerWaalsContact C-N 3.34Å; I205-T207 PolarHBondContact O-N 2.98Å; I205-F208 PolarHBondContact O-N 2.86Å; I205-L209 HydrophobicContact CG2-CD1 4.02Å; I205-L209 HydrophobicContact CG2-CG 4.26Å; I205-L209 WeakPolarHBondContact O-CB 3.37Å; I205-L209 VanDerWaalsContact O-CG 3.32Å; I205-L209 WeakPolarHBondContact O-CG 3.18Å; I205-L209 PolarHBondContact O-N 2.99Å; I205-M234 HydrophobicContact CG2-CE 3.7Å
206	Q	95.1	Very high	94.1	Very high	46 Å²	46	49.7 Å²	49.7	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-36.6	178.5	-65.4	-55.9	-47.8	0	0	112.5	Q200 S202 R203 V204 R210 N239	Q200-Q206 PolarHBondContact O-NE2 3.32Å; S202-Q206 WeakPolarHBondContact O-CG 3.29Å; S202-Q206 PolarHBondContact O-N 3.48Å; S202-Q206 VanDerWaalsContact O-N 3.07Å; R203-Q206 PolarHBondContact O-N 3.35Å; V204-Q206 VanDerWaalsContact C-N 3.34Å; V204-Q206 PolarHBondContact O-N 3.43Å; Q206-R210 PolarHBondContact O-N 2.97Å; Q206-N239 PolarHBondContact OE1-ND2 3.01Å
207	T	95.3	Very high	94	Very high	38 Å²	38	55.4 Å²	55.4	23%	0.233	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-46.2	173.3	-62.3	0	0	0	0	111.2	T175 I178 R203 V204 I205 L209 R210 T211	T175-T207 HydrophobicContact CG2-CG2 3.88Å; I178-T207 HydrophobicContact CD1-CG2 4.34Å; I178-T207 HydrophobicContact CG2-CG2 4.29Å; R203-T207 WeakPolarHBondContact O-CB 3.4Å; R203-T207 PolarHBondContact O-N 2.96Å; R203-T207 PolarHBondContact O-OG1 3.43Å; V204-T207 PolarHBondContact O-N 3.34Å; I205-T207 VanDerWaalsContact C-N 3.34Å; I205-T207 PolarHBondContact O-N 2.98Å; T207-L209 PolarHBondContact O-N 2.98Å; T207-R210 PolarHBondContact O-N 3.29Å; T207-T211 PolarHBondContact O-N 3.27Å; T207-T211 PolarHBondContact O-OG1 2.9Å
208	F	95.3	Very high	94.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-45.6	175	-85.5	-79.1	0	0	0	112.4	A174 I178 M181 V186 L190 V204 I205 R210 T211 C212	A174-F208 HydrophobicContact CB-CE2 4.29Å; A174-F208 HydrophobicContact CB-CZ 4.19Å; I178-F208 HydrophobicContact CD1-CB 4.29Å; I178-F208 HydrophobicContact CD1-CD1 3.37Å; I178-F208 HydrophobicContact CD1-CD2 4.27Å; I178-F208 HydrophobicContact CD1-CE1 3.56Å; I178-F208 HydrophobicContact CD1-CE2 4.44Å; I178-F208 HydrophobicContact CD1-CG 3.73Å; I178-F208 HydrophobicContact CD1-CZ 4.11Å; I178-F208 HydrophobicContact CG1-CD1 4.17Å; I178-F208 HydrophobicContact CG1-CE1 3.9Å; I178-F208 HydrophobicContact CG1-CZ 4.43Å; M181-F208 HydrophobicContact SD-CE1 4.4Å; V186-F208 HydrophobicContact CG1-CD1 4.12Å; L190-F208 HydrophobicContact CB-CB 4.13Å; L190-F208 HydrophobicContact CB-CD1 4.19Å; L190-F208 HydrophobicContact CB-CG 4.34Å; L190-F208 HydrophobicContact CD1-CB 3.8Å; L190-F208 HydrophobicContact CG-CB 4.37Å; V204-F208 HydrophobicContact CG1-CD2 3.87Å; V204-F208 HydrophobicContact CG1-CE2 3.76Å; V204-F208 VanDerWaalsContact O-CD2 3.25Å; V204-F208 WeakPolarHBondContact O-CD2 3.44Å; V204-F208 PolarHBondContact O-N 3.45Å; I205-F208 PolarHBondContact O-N 2.86Å; F208-R210 VanDerWaalsContact C-N 3.35Å; F208-R210 PolarHBondContact O-N 3.32Å; F208-T211 PolarHBondContact O-N 2.79Å; F208-C212 WeakPolarHBondContact O-CB 3.24Å; F208-C212 PolarHBondContact O-N 2.92Å; F208-C212 PolarHBondContact O-SG 3.22Å
209	L	95.8	Very high	94.1	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-44.1	177.2	-73.6	173.9	0	0	0	112.2	L190 I205 T207 C212 Q213 L231 M234 N239 V240 L243	L190-L209 HydrophobicContact CD1-CD2 4.48Å; L190-L209 HydrophobicContact CD2-CD2 4.02Å; I205-L209 HydrophobicContact CG2-CD1 4.02Å; I205-L209 HydrophobicContact CG2-CG 4.26Å; I205-L209 WeakPolarHBondContact O-CB 3.37Å; I205-L209 VanDerWaalsContact O-CG 3.32Å; I205-L209 WeakPolarHBondContact O-CG 3.18Å; I205-L209 PolarHBondContact O-N 2.99Å; T207-L209 PolarHBondContact O-N 2.98Å; L209-C212 PolarHBondContact O-N 3.46Å; L209-Q213 WeakPolarHBondContact O-CG 3.49Å; L209-Q213 PolarHBondContact O-N 3.14Å; L209-L231 HydrophobicContact CD2-CD2 4.08Å; L209-M234 HydrophobicContact CD1-CE 3.88Å; L209-M234 HydrophobicContact CD2-CE 4.14Å; L209-M234 HydrophobicContact CD2-SD 4.03Å; L209-M234 HydrophobicContact CG-CE 4.34Å; L209-N239 HydrophobicContact CB-CB 4.24Å; L209-N239 HydrophobicContact CD1-CB 4.1Å; L209-V240 HydrophobicContact CD1-CG2 3.99Å; L209-V240 HydrophobicContact CD2-CG2 4.39Å; L209-L243 HydrophobicContact CD2-CD2 4.14Å
210	R	94.3	Very high	94	Very high	147 Å²	147	58.8 Å²	58.8	56%	0.555	27%	0.274	S	S	*	.	H	α-helix	trans	-65	-44.5	177.8	176.9	173.9	-82.6	166.7	-7.3	111.5	Q206 T207 F208 C212 Q213 E214	Q206-R210 PolarHBondContact O-N 2.97Å; T207-R210 PolarHBondContact O-N 3.29Å; F208-R210 VanDerWaalsContact C-N 3.35Å; F208-R210 PolarHBondContact O-N 3.32Å; R210-C212 VanDerWaalsContact C-N 3.31Å; R210-C212 PolarHBondContact O-N 3.22Å; R210-Q213 WeakPolarHBondContact O-CB 3.32Å; R210-Q213 PolarHBondContact O-N 3.37Å; R210-E214 WeakPolarHBondContact CG-OE1 3.29Å; R210-E214 WeakPolarHBondContact O-CG 3.32Å; R210-E214 PolarHBondContact O-N 2.9Å
211	T	94.9	Very high	93.9	Very high	11 Å²	11	59 Å²	59	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-36.4	176.9	-58.7	0	0	0	0	112.1	I178 V186 T207 F208 Q213 E214 R215	I178-T211 HydrophobicContact CD1-CG2 4.07Å; I178-T211 HydrophobicContact CG1-CG2 4.09Å; V186-T211 HydrophobicContact CG1-CG2 4.26Å; T207-T211 PolarHBondContact O-N 3.27Å; T207-T211 PolarHBondContact O-OG1 2.9Å; F208-T211 PolarHBondContact O-N 2.79Å; T211-Q213 VanDerWaalsContact C-N 3.31Å; T211-Q213 PolarHBondContact O-N 2.74Å; T211-E214 PolarHBondContact O-N 2.93Å; T211-R215 HydrophobicContact CG2-CG 4.37Å; T211-R215 WeakPolarHBondContact O-CB 3.27Å; T211-R215 WeakPolarHBondContact O-CG 3.44Å; T211-R215 PolarHBondContact O-N 2.93Å
212	C	95.5	Very high	93.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-36.3	171.1	-70.6	0	0	0	0	112.5	F208 L209 R210 L216 F219 L227 L243	F208-C212 WeakPolarHBondContact O-CB 3.24Å; F208-C212 PolarHBondContact O-N 2.92Å; F208-C212 PolarHBondContact O-SG 3.22Å; L209-C212 PolarHBondContact O-N 3.46Å; R210-C212 VanDerWaalsContact C-N 3.31Å; R210-C212 PolarHBondContact O-N 3.22Å; C212-L216 WeakPolarHBondContact O-CA 3.22Å; C212-L216 WeakPolarHBondContact O-CB 3.46Å; C212-L216 PolarHBondContact O-N 2.95Å; C212-L216 VanDerWaalsContact O-N 3.14Å; C212-F219 HydrophobicContact CB-CE2 4.37Å; C212-F219 HydrophobicContact CB-CZ 4.29Å; C212-L227 HydrophobicContact CB-CD1 4.26Å; C212-L227 HydrophobicContact CB-CD2 4.39Å; C212-L243 HydrophobicContact CB-CD1 4.42Å; C212-L243 HydrophobicContact CB-CD2 3.73Å
213	Q	94.3	Very high	93.8	Very high	58 Å²	58	56.1 Å²	56.1	27%	0.271	26%	0.257	S	S	.	.	H	α-helix	trans	-65.4	-46	174	-69.6	170.2	18.4	0	0	111.7	L209 R210 T211 R215 L216 N239 L243	L209-Q213 WeakPolarHBondContact O-CG 3.49Å; L209-Q213 PolarHBondContact O-N 3.14Å; R210-Q213 WeakPolarHBondContact O-CB 3.32Å; R210-Q213 PolarHBondContact O-N 3.37Å; T211-Q213 VanDerWaalsContact C-N 3.31Å; T211-Q213 PolarHBondContact O-N 2.74Å; Q213-R215 VanDerWaalsContact C-N 3.31Å; Q213-R215 PolarHBondContact O-N 3.39Å; Q213-L216 PolarHBondContact O-N 3.13Å; Q213-N239 VanDerWaalsContact NE2-CA 3.33Å; Q213-N239 PolarHBondContact NE2-O 2.99Å; Q213-L243 HydrophobicContact CB-CD1 4.26Å; Q213-L243 HydrophobicContact CG-CB 3.9Å; Q213-L243 HydrophobicContact CG-CD1 3.65Å; Q213-L243 HydrophobicContact CG-CD2 4.36Å; Q213-L243 HydrophobicContact CG-CG 4.18Å
214	E	93.7	Very high	93.7	Very high	130 Å²	130	46.8 Å²	46.8	61%	0.607	22%	0.223	S	C	*	.	H	α-helix	trans	-63	-37.3	-178.9	-70.6	165	-175.3	0	0	112.4	R210 T211	R210-E214 WeakPolarHBondContact CG-OE1 3.29Å; R210-E214 WeakPolarHBondContact O-CG 3.32Å; R210-E214 PolarHBondContact O-N 2.9Å; T211-E214 PolarHBondContact O-N 2.93Å
215	R	94	Very high	93.6	Very high	48 Å²	48	47.3 Å²	47.3	18%	0.181	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	6.7	-175.3	-61.3	-178.6	179.4	-165.2	-6.7	114.1	Q179 M181 N183 T211 Q213 N217 D218 F219	Q179-R215 PolarHBondContact O-NH2 3.38Å; M181-R215 PolarHBondContact O-NH1 3.19Å; N183-R215 WeakPolarHBondContact OD1-CD 3.48Å; T211-R215 HydrophobicContact CG2-CG 4.37Å; T211-R215 WeakPolarHBondContact O-CB 3.27Å; T211-R215 WeakPolarHBondContact O-CG 3.44Å; T211-R215 PolarHBondContact O-N 2.93Å; Q213-R215 VanDerWaalsContact C-N 3.31Å; Q213-R215 PolarHBondContact O-N 3.39Å; R215-N217 PolarHBondContact O-N 2.85Å; R215-N217 VanDerWaalsContact O-N 3.17Å; R215-D218 PolarHBondContact O-N 2.81Å; R215-F219 HydrophobicContact CB-CD1 4.21Å; R215-F219 HydrophobicContact CB-CE1 3.69Å; R215-F219 WeakPolarHBondContact O-CD1 3.43Å; R215-F219 PolarHBondContact O-N 3.5Å
216	L	94.4	Very high	93.4	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.052	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-57.9	-37.5	-167.7	-175.4	63.5	0	0	0	113.3	C212 Q213 D218 F219 L224 L227 L243 M247 V250	C212-L216 WeakPolarHBondContact O-CA 3.22Å; C212-L216 WeakPolarHBondContact O-CB 3.46Å; C212-L216 PolarHBondContact O-N 2.95Å; C212-L216 VanDerWaalsContact O-N 3.14Å; Q213-L216 PolarHBondContact O-N 3.13Å; L216-D218 PolarHBondContact O-N 3.19Å; L216-F219 PolarHBondContact O-N 2.84Å; L216-L224 HydrophobicContact CD1-CD2 3.81Å; L216-L227 HydrophobicContact CD1-CD2 3.81Å; L216-L243 HydrophobicContact CD1-CD1 4.08Å; L216-L243 HydrophobicContact CD2-CD1 4.11Å; L216-M247 HydrophobicContact CD1-CG 4Å; L216-M247 HydrophobicContact CD2-CG 4.49Å; L216-V250 HydrophobicContact CD2-CG2 3.91Å; L216-V250 HydrophobicContact CG-CG2 3.97Å
217	N	92.8	Very high	93.4	Very high	120 Å²	120	46.1 Å²	46.1	64%	0.642	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-66.5	-26.5	-179.9	-65.2	-32.9	0	0	0	112.6	R215 V250	R215-N217 PolarHBondContact O-N 2.85Å; R215-N217 VanDerWaalsContact O-N 3.17Å; N217-V250 WeakPolarHBondContact OD1-CG2 3.48Å
218	D	93	Very high	93.3	Very high	114 Å²	114	44.4 Å²	44.4	61%	0.61	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-92.8	-0.4	-176.8	-53.7	-38.9	0	0	0	112.7	N183 R215 L216	N183-D218 VanDerWaalsContact ND2-CB 3.29Å; N183-D218 WeakPolarHBondContact ND2-CB 3.34Å; N183-D218 PolarHBondContact ND2-O 2.76Å; R215-D218 PolarHBondContact O-N 2.81Å; L216-D218 PolarHBondContact O-N 3.19Å
219	F	92.8	Very high	93.1	Very high	1 Å²	1	45.6 Å²	45.6	0%	0.004	22%	0.219	C	C	.	.			trans	-74.9	132.7	179.4	-81.7	19.1	0	0	0	110.2	N183 A187 C212 R215 L216 A223 L224 L227 R254	N183-F219 HydrophobicContact CB-CD1 3.65Å; N183-F219 HydrophobicContact CB-CE1 3.73Å; A187-F219 HydrophobicContact CB-CE2 4.26Å; C212-F219 HydrophobicContact CB-CE2 4.37Å; C212-F219 HydrophobicContact CB-CZ 4.29Å; R215-F219 HydrophobicContact CB-CD1 4.21Å; R215-F219 HydrophobicContact CB-CE1 3.69Å; R215-F219 WeakPolarHBondContact O-CD1 3.43Å; R215-F219 PolarHBondContact O-N 3.5Å; L216-F219 PolarHBondContact O-N 2.84Å; F219-A223 HydrophobicContact CB-CB 3.93Å; F219-A223 HydrophobicContact CD2-CB 3.85Å; F219-A223 HydrophobicContact CE2-CB 4.45Å; F219-A223 HydrophobicContact CG-CB 3.88Å; F219-L224 HydrophobicContact CB-CD2 3.75Å; F219-L224 HydrophobicContact CB-CG 3.82Å; F219-L224 HydrophobicContact CD2-CD2 4.35Å; F219-L227 HydrophobicContact CD2-CD2 4.18Å; F219-L227 HydrophobicContact CE2-CD2 4Å; F219-R254 PolarHBondContact O-NH1 3.32Å
220	D	90.8	Very high	93	Very high	61 Å²	61	45.6 Å²	45.6	33%	0.326	22%	0.219	S	C	.	.			trans	-78.8	179.4	173.3	70.5	-14.5	0	0	0	111.9	K222 A223 L224	D220-K222 PolarHBondContact O-N 3.23Å; D220-A223 PolarHBondContact O-N 2.65Å; D220-A223 WeakPolarHBondContact OD1-CB 3.46Å; D220-A223 PolarHBondContact OD1-N 2.91Å; D220-L224 WeakPolarHBondContact O-CB 3.47Å; D220-L224 VanDerWaalsContact O-CG 3.28Å; D220-L224 WeakPolarHBondContact O-CG 3.39Å; D220-L224 PolarHBondContact O-N 3.44Å
221	E	90.5	Very high	93	Very high	49 Å²	49	38.6 Å²	38.6	23%	0.229	19%	0.192	C	C	.	.	H	α-helix	trans	-54.5	-42	-179.5	-176.7	-179.1	156.5	0	0	111.9	S225 Q259 N260 T263	E221-S225 WeakPolarHBondContact O-CB 3.5Å; E221-S225 PolarHBondContact O-N 3.38Å; E221-Q259 PolarHBondContact OE2-N 3.41Å; E221-N260 WeakPolarHBondContact OE1-CB 3.49Å; E221-N260 PolarHBondContact OE1-N 3.22Å; E221-N260 VanDerWaalsContact OE1-N 3.1Å; E221-T263 HydrophobicContact CG-CG2 3.56Å; E221-T263 WeakPolarHBondContact OE1-CB 3.49Å; E221-T263 PolarHBondContact OE1-OG1 2.9Å
222	K	90.4	Very high	92.7	Very high	129 Å²	129	42 Å²	42	56%	0.561	21%	0.208	S	C	*	.	H	α-helix	trans	-68	-49	-178.8	-68.9	177.5	-178.5	173.5	0	111.7	D220 L224 S225 M226	D220-K222 PolarHBondContact O-N 3.23Å; K222-L224 VanDerWaalsContact C-N 3.32Å; K222-L224 PolarHBondContact O-N 2.85Å; K222-S225 PolarHBondContact O-N 3.46Å; K222-M226 WeakPolarHBondContact O-CB 3.43Å; K222-M226 VanDerWaalsContact O-CG 3.25Å; K222-M226 WeakPolarHBondContact O-CG 3.39Å; K222-M226 PolarHBondContact O-N 2.95Å
223	A	91.8	Very high	92.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.4	0	0	0	0	0	111.7	A187 F219 D220 M226 L227	A187-A223 HydrophobicContact CB-CB 4.23Å; F219-A223 HydrophobicContact CB-CB 3.93Å; F219-A223 HydrophobicContact CD2-CB 3.85Å; F219-A223 HydrophobicContact CE2-CB 4.45Å; F219-A223 HydrophobicContact CG-CB 3.88Å; D220-A223 PolarHBondContact O-N 2.65Å; D220-A223 WeakPolarHBondContact OD1-CB 3.46Å; D220-A223 PolarHBondContact OD1-N 2.91Å; A223-M226 PolarHBondContact O-N 3.47Å; A223-L227 VanDerWaalsContact O-CB 3.32Å; A223-L227 WeakPolarHBondContact O-CB 3.24Å; A223-L227 PolarHBondContact O-N 3.46Å
224	L	92.8	Very high	92.1	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-46.3	174.1	-69.2	174	0	0	0	111.2	L216 F219 D220 K222 M226 L227 A228 M247 V250 M267	L216-L224 HydrophobicContact CD1-CD2 3.81Å; F219-L224 HydrophobicContact CB-CD2 3.75Å; F219-L224 HydrophobicContact CB-CG 3.82Å; F219-L224 HydrophobicContact CD2-CD2 4.35Å; D220-L224 WeakPolarHBondContact O-CB 3.47Å; D220-L224 VanDerWaalsContact O-CG 3.28Å; D220-L224 WeakPolarHBondContact O-CG 3.39Å; D220-L224 PolarHBondContact O-N 3.44Å; K222-L224 VanDerWaalsContact C-N 3.32Å; K222-L224 PolarHBondContact O-N 2.85Å; L224-M226 VanDerWaalsContact C-N 3.33Å; L224-M226 PolarHBondContact O-N 3.03Å; L224-L227 PolarHBondContact O-N 3.4Å; L224-A228 WeakPolarHBondContact O-CB 3.49Å; L224-A228 PolarHBondContact O-N 2.95Å; L224-M247 HydrophobicContact CB-CE 4.35Å; L224-M247 HydrophobicContact CD2-CE 4.21Å; L224-V250 HydrophobicContact CD1-CG1 4.26Å; L224-V250 HydrophobicContact CD2-CG1 4.4Å; L224-M267 HydrophobicContact CB-CE 3.51Å; L224-M267 WeakPolarHBondContact O-CE 3.24Å
225	S	92.9	Very high	92	Very high	21 Å²	21	48.7 Å²	48.7	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-45	179.1	-171.8	0	0	0	0	111.8	E221 K222 A228 S229	E221-S225 WeakPolarHBondContact O-CB 3.5Å; E221-S225 PolarHBondContact O-N 3.38Å; K222-S225 PolarHBondContact O-N 3.46Å; S225-A228 PolarHBondContact O-N 2.84Å; S225-S229 PolarHBondContact O-N 2.92Å
226	M	91.8	Very high	91.8	Very high	23 Å²	23	50.2 Å²	50.2	11%	0.113	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-49.7	175.2	-72.6	-69.4	-68.5	0	0	111.3	A187 Y188 L191 K222 A223 L224 A228 S229 V230	A187-M226 HydrophobicContact CB-CB 4.15Å; Y188-M226 HydrophobicContact CD1-CE 3.18Å; Y188-M226 HydrophobicContact CD2-CE 4.12Å; Y188-M226 HydrophobicContact CE1-CE 3.16Å; Y188-M226 HydrophobicContact CE1-SD 3.95Å; Y188-M226 HydrophobicContact CE2-CE 4.11Å; Y188-M226 HydrophobicContact CE2-CG 4.29Å; Y188-M226 HydrophobicContact CG-CE 3.67Å; L191-M226 HydrophobicContact CB-CE 4.02Å; L191-M226 HydrophobicContact CD2-CE 3.16Å; L191-M226 HydrophobicContact CD2-SD 4.04Å; L191-M226 HydrophobicContact CG-CE 4.16Å; K222-M226 WeakPolarHBondContact O-CB 3.43Å; K222-M226 VanDerWaalsContact O-CG 3.25Å; K222-M226 WeakPolarHBondContact O-CG 3.39Å; K222-M226 PolarHBondContact O-N 2.95Å; A223-M226 PolarHBondContact O-N 3.47Å; L224-M226 VanDerWaalsContact C-N 3.33Å; L224-M226 PolarHBondContact O-N 3.03Å; M226-A228 VanDerWaalsContact C-N 3.32Å; M226-A228 PolarHBondContact O-N 3.02Å; M226-S229 PolarHBondContact O-N 3.25Å; M226-S229 PolarHBondContact O-OG 2.84Å; M226-V230 WeakPolarHBondContact O-CG2 3.35Å; M226-V230 PolarHBondContact O-N 2.6Å
227	L	94.4	Very high	91.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-43.3	177.8	-179.1	60.9	0	0	0	111.9	L190 C212 L216 F219 A223 L224 S229 V230 L231 L243 M247	L190-L227 HydrophobicContact CD2-CD1 3.82Å; C212-L227 HydrophobicContact CB-CD1 4.26Å; C212-L227 HydrophobicContact CB-CD2 4.39Å; L216-L227 HydrophobicContact CD1-CD2 3.81Å; F219-L227 HydrophobicContact CD2-CD2 4.18Å; F219-L227 HydrophobicContact CE2-CD2 4Å; A223-L227 VanDerWaalsContact O-CB 3.32Å; A223-L227 WeakPolarHBondContact O-CB 3.24Å; A223-L227 PolarHBondContact O-N 3.46Å; L224-L227 PolarHBondContact O-N 3.4Å; L227-S229 VanDerWaalsContact C-N 3.35Å; L227-S229 PolarHBondContact O-N 2.77Å; L227-V230 WeakPolarHBondContact O-CB 3.47Å; L227-V230 PolarHBondContact O-N 3.12Å; L227-V230 VanDerWaalsContact O-N 3.16Å; L227-L231 HydrophobicContact CD1-CD1 4.03Å; L227-L231 HydrophobicContact CD1-CG 4.08Å; L227-L231 HydrophobicContact CD2-CD1 4.41Å; L227-L231 HydrophobicContact CG-CD1 3.83Å; L227-L231 HydrophobicContact CG-CG 4.31Å; L227-L231 WeakPolarHBondContact O-CG 3.43Å; L227-L231 PolarHBondContact O-N 2.68Å; L227-L243 HydrophobicContact CD1-CD2 3.78Å; L227-L243 HydrophobicContact CD2-CD1 4.07Å; L227-L243 HydrophobicContact CD2-CD2 4.02Å; L227-L243 HydrophobicContact CD2-CG 4.11Å; L227-L243 HydrophobicContact CG-CD2 4.35Å; L227-M247 HydrophobicContact CB-SD 4.34Å; L227-M247 HydrophobicContact CD2-CG 4.15Å; L227-M247 HydrophobicContact CD2-SD 3.81Å; L227-M247 HydrophobicContact CG-SD 3.83Å
228	A	93.3	Very high	91.5	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-44	177.5	0	0	0	0	0	112.4	L224 S225 M226 V230 L231 E232 M247 T266 M267 L270	L224-A228 WeakPolarHBondContact O-CB 3.49Å; L224-A228 PolarHBondContact O-N 2.95Å; S225-A228 PolarHBondContact O-N 2.84Å; M226-A228 VanDerWaalsContact C-N 3.32Å; M226-A228 PolarHBondContact O-N 3.02Å; A228-V230 PolarHBondContact O-N 3.12Å; A228-L231 PolarHBondContact O-N 3.39Å; A228-E232 PolarHBondContact O-N 3.48Å; A228-E232 VanDerWaalsContact O-N 3.09Å; A228-M247 HydrophobicContact CB-CE 3.89Å; A228-M247 HydrophobicContact CB-SD 4.32Å; A228-T266 HydrophobicContact CB-CG2 3.83Å; A228-M267 HydrophobicContact CB-CE 4.3Å; A228-M267 HydrophobicContact CB-SD 3.79Å; A228-L270 HydrophobicContact CB-CB 4.21Å; A228-L270 HydrophobicContact CB-CD2 3.75Å
229	S	91.5	Very high	91.5	Very high	25 Å²	25	49.8 Å²	49.8	18%	0.175	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-30.6	177.5	80.9	0	0	0	0	113.1	S225 M226 L227	S225-S229 PolarHBondContact O-N 2.92Å; M226-S229 PolarHBondContact O-N 3.25Å; M226-S229 PolarHBondContact O-OG 2.84Å; L227-S229 VanDerWaalsContact C-N 3.35Å; L227-S229 PolarHBondContact O-N 2.77Å
230	V	93.4	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-74.9	-53.3	175.6	179	0	0	0	0	110.7	L190 L191 V194 M226 L227 A228 E232 R233 M234	L190-V230 HydrophobicContact CD2-CG1 4.45Å; L190-V230 HydrophobicContact CG-CG1 4.17Å; L191-V230 VanDerWaalsContact CA-CG2 3.41Å; L191-V230 HydrophobicContact CB-CG2 3.54Å; L191-V230 HydrophobicContact CD1-CG2 3.39Å; L191-V230 HydrophobicContact CG-CG2 4.05Å; V194-V230 HydrophobicContact CB-CG1 4.23Å; V194-V230 HydrophobicContact CG1-CG1 4.25Å; V194-V230 HydrophobicContact CG2-CG1 3.91Å; M226-V230 WeakPolarHBondContact O-CG2 3.35Å; M226-V230 PolarHBondContact O-N 2.6Å; L227-V230 WeakPolarHBondContact O-CB 3.47Å; L227-V230 PolarHBondContact O-N 3.12Å; L227-V230 VanDerWaalsContact O-N 3.16Å; A228-V230 PolarHBondContact O-N 3.12Å; V230-E232 PolarHBondContact O-N 3.36Å; V230-R233 PolarHBondContact O-N 3.31Å; V230-M234 HydrophobicContact CG1-CG 4.08Å; V230-M234 HydrophobicContact CG1-SD 3.66Å; V230-M234 WeakPolarHBondContact O-CG 3.28Å; V230-M234 PolarHBondContact O-N 3.31Å
231	L	93.6	Very high	91.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-27	-173.5	-68.2	173.9	0	0	0	113.2	L209 L227 A228 R233 M234 V240 L243 K244 M247 L270	L209-L231 HydrophobicContact CD2-CD2 4.08Å; L227-L231 HydrophobicContact CD1-CD1 4.03Å; L227-L231 HydrophobicContact CD1-CG 4.08Å; L227-L231 HydrophobicContact CD2-CD1 4.41Å; L227-L231 HydrophobicContact CG-CD1 3.83Å; L227-L231 HydrophobicContact CG-CG 4.31Å; L227-L231 WeakPolarHBondContact O-CG 3.43Å; L227-L231 PolarHBondContact O-N 2.68Å; A228-L231 PolarHBondContact O-N 3.39Å; L231-R233 PolarHBondContact O-N 3.42Å; L231-M234 HydrophobicContact CD2-SD 4.17Å; L231-V240 HydrophobicContact CD2-CG1 4.08Å; L231-V240 HydrophobicContact CD2-CG2 4.39Å; L231-L243 HydrophobicContact CD1-CB 4.27Å; L231-L243 HydrophobicContact CD1-CD2 4.06Å; L231-L243 HydrophobicContact CD1-CG 3.81Å; L231-L243 HydrophobicContact CD2-CD2 4.1Å; L231-L243 HydrophobicContact CD2-CG 4.48Å; L231-K244 HydrophobicContact CB-CG 4.32Å; L231-K244 HydrophobicContact CD1-CG 4.33Å; L231-K244 WeakPolarHBondContact O-CE 3.24Å; L231-K244 PolarHBondContact O-NZ 2.82Å; L231-M247 HydrophobicContact CD1-CG 4.32Å; L231-M247 HydrophobicContact CD1-SD 3.64Å; L231-L270 HydrophobicContact CB-CD1 3.68Å; L231-L270 HydrophobicContact CB-CD2 4.5Å; L231-L270 HydrophobicContact CD1-CD2 4.48Å
232	E	88.9	Confident	91.6	Very high	84 Å²	84	50.4 Å²	50.4	39%	0.393	26%	0.259	S	S	.	.	H	α-helix	trans	-58	-38.6	172.2	-168.3	-135.8	159.8	0	0	111.7	A228 V230 R269 L270	A228-E232 PolarHBondContact O-N 3.48Å; A228-E232 VanDerWaalsContact O-N 3.09Å; V230-E232 PolarHBondContact O-N 3.36Å; E232-R269 VanDerWaalsContact CD-CD 3.44Å; E232-R269 HydrophobicContact CG-CG 4.1Å; E232-R269 WeakPolarHBondContact OE1-CD 3.32Å; E232-L270 HydrophobicContact CB-CD1 4.26Å
233	R	86.6	Confident	91.8	Very high	142 Å²	142	44.3 Å²	44.3	54%	0.536	23%	0.233	S	C	.	.	H	α-helix	trans	-91.2	-17.1	-173	-58.3	176.4	-174.5	-158.9	-3.2	113.6	N195 V230 L231	N195-R233 PolarHBondContact OD1-NH1 3.37Å; V230-R233 PolarHBondContact O-N 3.31Å; L231-R233 PolarHBondContact O-N 3.42Å
234	M	91.7	Very high	91.9	Very high	15 Å²	15	46.8 Å²	46.8	7%	0.074	24%	0.244	C	C	.	.	S	Bend	trans	-77.2	145.9	-178.4	-65.7	-176.4	83.5	0	0	111.6	V194 Q200 I205 L209 V230 L231 V240	V194-M234 HydrophobicContact CG1-CG 4.44Å; V194-M234 HydrophobicContact CG2-CE 4.28Å; V194-M234 HydrophobicContact CG2-SD 4.35Å; Q200-M234 HydrophobicContact CG-CE 3.73Å; I205-M234 HydrophobicContact CG2-CE 3.7Å; L209-M234 HydrophobicContact CD1-CE 3.88Å; L209-M234 HydrophobicContact CD2-CE 4.14Å; L209-M234 HydrophobicContact CD2-SD 4.03Å; L209-M234 HydrophobicContact CG-CE 4.34Å; V230-M234 HydrophobicContact CG1-CG 4.08Å; V230-M234 HydrophobicContact CG1-SD 3.66Å; V230-M234 WeakPolarHBondContact O-CG 3.28Å; V230-M234 PolarHBondContact O-N 3.31Å; L231-M234 HydrophobicContact CD2-SD 4.17Å; M234-V240 HydrophobicContact CB-CG1 4.29Å; M234-V240 HydrophobicContact CB-CG2 4.02Å; M234-V240 HydrophobicContact CE-CG2 3.98Å; M234-V240 HydrophobicContact SD-CG2 4.04Å
235	K	90.9	Very high	91.9	Very high	170 Å²	170	50.8 Å²	50.8	74%	0.739	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-67.6	152	172.4	-63.5	178.3	-179.6	176.1	0	109.6	Q200 S237	Q200-K235 PolarHBondContact NE2-O 2.92Å; K235-S237 PolarHBondContact O-N 3.06Å
236	A	89.1	Confident	91.9	Very high	81 Å²	81	50.7 Å²	50.7	67%	0.669	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-58	129.9	175.2	0	0	0	0	0	110.7
237	S	91.3	Very high	91.9	Very high	31 Å²	31	49.6 Å²	49.6	22%	0.217	26%	0.26	C	S	.	.			trans	-150.7	164.4	171.4	75.9	0	0	0	0	108.7	K235 N239 V240 N241	K235-S237 PolarHBondContact O-N 3.06Å; S237-N239 VanDerWaalsContact C-N 3.3Å; S237-N239 PolarHBondContact O-N 3.38Å; S237-V240 PolarHBondContact O-N 3.23Å; S237-V240 WeakPolarHBondContact OG-CG2 3.29Å; S237-V240 PolarHBondContact OG-N 3.21Å; S237-N241 WeakPolarHBondContact O-CB 3.35Å; S237-N241 VanDerWaalsContact O-CG 3.23Å; S237-N241 PolarHBondContact O-N 3.21Å
238	Q	90.8	Very high	91.8	Very high	172 Å²	172	52.6 Å²	52.6	80%	0.804	27%	0.271	S	S	*	.	H	α-helix	trans	-52.5	-48.1	179.9	-174.5	178.5	1.3	0	0	112	N241 A242	Q238-N241 PolarHBondContact O-N 3.26Å; Q238-A242 VanDerWaalsContact O-CB 3.29Å; Q238-A242 WeakPolarHBondContact O-CB 2.87Å; Q238-A242 PolarHBondContact O-N 3.21Å
239	N	92	Very high	91.7	Very high	31 Å²	31	57.5 Å²	57.5	17%	0.166	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-35.6	-179.7	-72	-24.7	0	0	0	113.6	Q206 L209 Q213 S237 L243	Q206-N239 PolarHBondContact OE1-ND2 3.01Å; L209-N239 HydrophobicContact CB-CB 4.24Å; L209-N239 HydrophobicContact CD1-CB 4.1Å; Q213-N239 VanDerWaalsContact NE2-CA 3.33Å; Q213-N239 PolarHBondContact NE2-O 2.99Å; S237-N239 VanDerWaalsContact C-N 3.3Å; S237-N239 PolarHBondContact O-N 3.38Å; N239-L243 VanDerWaalsContact O-CB 3.29Å; N239-L243 WeakPolarHBondContact O-CB 3.34Å; N239-L243 PolarHBondContact O-N 3.14Å
240	V	92.8	Very high	91.8	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-43.2	176	170	0	0	0	0	110.4	L209 L231 M234 S237 L243 K244	L209-V240 HydrophobicContact CD1-CG2 3.99Å; L209-V240 HydrophobicContact CD2-CG2 4.39Å; L231-V240 HydrophobicContact CD2-CG1 4.08Å; L231-V240 HydrophobicContact CD2-CG2 4.39Å; M234-V240 HydrophobicContact CB-CG1 4.29Å; M234-V240 HydrophobicContact CB-CG2 4.02Å; M234-V240 HydrophobicContact CE-CG2 3.98Å; M234-V240 HydrophobicContact SD-CG2 4.04Å; S237-V240 PolarHBondContact O-N 3.23Å; S237-V240 WeakPolarHBondContact OG-CG2 3.29Å; S237-V240 PolarHBondContact OG-N 3.21Å; V240-L243 PolarHBondContact O-N 3.39Å; V240-K244 HydrophobicContact CG1-CD 4.28Å; V240-K244 WeakPolarHBondContact O-CG 3.46Å; V240-K244 PolarHBondContact O-N 2.8Å
241	N	91.8	Very high	91.6	Very high	77 Å²	77	57 Å²	57	41%	0.412	29%	0.292	S	S	.	.	H	α-helix	trans	-67.8	-45.7	179.6	-66.9	-9.9	0	0	0	111	S237 Q238 L243 K244 E245	S237-N241 WeakPolarHBondContact O-CB 3.35Å; S237-N241 VanDerWaalsContact O-CG 3.23Å; S237-N241 PolarHBondContact O-N 3.21Å; Q238-N241 PolarHBondContact O-N 3.26Å; N241-L243 VanDerWaalsContact C-N 3.27Å; N241-L243 PolarHBondContact O-N 3.24Å; N241-K244 PolarHBondContact O-N 3.07Å; N241-E245 WeakPolarHBondContact O-CG 3.18Å; N241-E245 PolarHBondContact O-N 3.12Å
242	A	92.3	Very high	91.4	Very high	47 Å²	47	58.9 Å²	58.9	39%	0.388	30%	0.301	S	S	.	.	H	α-helix	trans	-57.6	-41.2	175.3	0	0	0	0	0	111.9	Q238 E245 G246	Q238-A242 VanDerWaalsContact O-CB 3.29Å; Q238-A242 WeakPolarHBondContact O-CB 2.87Å; Q238-A242 PolarHBondContact O-N 3.21Å; A242-E245 PolarHBondContact O-N 2.98Å; A242-G246 PolarHBondContact O-N 3.03Å
243	L	94.3	Very high	91.5	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-71.8	-35.9	178.1	-167.8	53.4	0	0	0	112.5	L209 C212 Q213 L216 L227 L231 N239 V240 N241 E245 G246 M247	L209-L243 HydrophobicContact CD2-CD2 4.14Å; C212-L243 HydrophobicContact CB-CD1 4.42Å; C212-L243 HydrophobicContact CB-CD2 3.73Å; Q213-L243 HydrophobicContact CB-CD1 4.26Å; Q213-L243 HydrophobicContact CG-CB 3.9Å; Q213-L243 HydrophobicContact CG-CD1 3.65Å; Q213-L243 HydrophobicContact CG-CD2 4.36Å; Q213-L243 HydrophobicContact CG-CG 4.18Å; L216-L243 HydrophobicContact CD1-CD1 4.08Å; L216-L243 HydrophobicContact CD2-CD1 4.11Å; L227-L243 HydrophobicContact CD1-CD2 3.78Å; L227-L243 HydrophobicContact CD2-CD1 4.07Å; L227-L243 HydrophobicContact CD2-CD2 4.02Å; L227-L243 HydrophobicContact CD2-CG 4.11Å; L227-L243 HydrophobicContact CG-CD2 4.35Å; L231-L243 HydrophobicContact CD1-CB 4.27Å; L231-L243 HydrophobicContact CD1-CD2 4.06Å; L231-L243 HydrophobicContact CD1-CG 3.81Å; L231-L243 HydrophobicContact CD2-CD2 4.1Å; L231-L243 HydrophobicContact CD2-CG 4.48Å; N239-L243 VanDerWaalsContact O-CB 3.29Å; N239-L243 WeakPolarHBondContact O-CB 3.34Å; N239-L243 PolarHBondContact O-N 3.14Å; V240-L243 PolarHBondContact O-N 3.39Å; N241-L243 VanDerWaalsContact C-N 3.27Å; N241-L243 PolarHBondContact O-N 3.24Å; L243-E245 VanDerWaalsContact C-N 3.35Å; L243-G246 PolarHBondContact O-N 3.12Å; L243-M247 WeakPolarHBondContact O-CB 3.1Å; L243-M247 VanDerWaalsContact O-CG 3.29Å; L243-M247 WeakPolarHBondContact O-CG 3.41Å; L243-M247 PolarHBondContact O-N 2.91Å
244	K	93.6	Very high	91.7	Very high	53 Å²	53	56.4 Å²	56.4	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-41.9	171.3	-75.6	-179.9	-177.4	-174.1	0	112	L231 V240 N241 M247 R248 L270	L231-K244 HydrophobicContact CB-CG 4.32Å; L231-K244 HydrophobicContact CD1-CG 4.33Å; L231-K244 WeakPolarHBondContact O-CE 3.24Å; L231-K244 PolarHBondContact O-NZ 2.82Å; V240-K244 HydrophobicContact CG1-CD 4.28Å; V240-K244 WeakPolarHBondContact O-CG 3.46Å; V240-K244 PolarHBondContact O-N 2.8Å; N241-K244 PolarHBondContact O-N 3.07Å; K244-M247 PolarHBondContact O-N 3.4Å; K244-R248 PolarHBondContact O-N 2.94Å; K244-L270 HydrophobicContact CD-CD1 4.33Å; K244-L270 HydrophobicContact CG-CD1 4.23Å
245	E	92	Very high	91.6	Very high	92 Å²	92	56.1 Å²	56.1	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-66.6	-43.8	176	-68.7	-63.6	108.1	0	0	111.7	N241 A242 L243 M247 R248 L249	N241-E245 WeakPolarHBondContact O-CG 3.18Å; N241-E245 PolarHBondContact O-N 3.12Å; A242-E245 PolarHBondContact O-N 2.98Å; L243-E245 VanDerWaalsContact C-N 3.35Å; E245-M247 VanDerWaalsContact C-N 3.34Å; E245-M247 PolarHBondContact O-N 3.05Å; E245-R248 VanDerWaalsContact O-CB 3.3Å; E245-R248 WeakPolarHBondContact O-CB 3.5Å; E245-R248 PolarHBondContact O-N 2.84Å; E245-R248 IonicContact OE1-CZ 2.93Å; E245-R248 IonicContact OE1-NH1 3.42Å; E245-R248 PolarHBondContact OE1-NH1 3.17Å; E245-R248 IonicContact OE2-CZ 2.7Å; E245-R248 IonicContact OE2-NH1 2.86Å; E245-R248 PolarHBondContact OE2-NH1 3.03Å; E245-R248 IonicContact OE2-NH2 3Å; E245-R248 PolarHBondContact OE2-NH2 3.32Å; E245-L249 PolarHBondContact O-N 3.17Å
246	G	93.1	Very high	91.6	Very high	20 Å²	20	52.8 Å²	52.8	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-59.2	-45.5	172.2	0	0	0	0	0	111.8	A242 L243 R248 L249 V250	A242-G246 PolarHBondContact O-N 3.03Å; L243-G246 PolarHBondContact O-N 3.12Å; G246-R248 VanDerWaalsContact C-N 3.27Å; G246-R248 PolarHBondContact O-N 3.43Å; G246-L249 PolarHBondContact O-N 2.96Å; G246-V250 WeakPolarHBondContact O-CG2 3.49Å; G246-V250 PolarHBondContact O-N 3.41Å
247	M	93.1	Very high	91.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-39.1	176.4	-81.1	-153.9	71.1	0	0	111.5	L216 L224 L227 A228 L231 L243 K244 E245 L249 V250 V251 M267 L270 L271	L216-M247 HydrophobicContact CD1-CG 4Å; L216-M247 HydrophobicContact CD2-CG 4.49Å; L224-M247 HydrophobicContact CB-CE 4.35Å; L224-M247 HydrophobicContact CD2-CE 4.21Å; L227-M247 HydrophobicContact CB-SD 4.34Å; L227-M247 HydrophobicContact CD2-CG 4.15Å; L227-M247 HydrophobicContact CD2-SD 3.81Å; L227-M247 HydrophobicContact CG-SD 3.83Å; A228-M247 HydrophobicContact CB-CE 3.89Å; A228-M247 HydrophobicContact CB-SD 4.32Å; L231-M247 HydrophobicContact CD1-CG 4.32Å; L231-M247 HydrophobicContact CD1-SD 3.64Å; L243-M247 WeakPolarHBondContact O-CB 3.1Å; L243-M247 VanDerWaalsContact O-CG 3.29Å; L243-M247 WeakPolarHBondContact O-CG 3.41Å; L243-M247 PolarHBondContact O-N 2.91Å; K244-M247 PolarHBondContact O-N 3.4Å; E245-M247 VanDerWaalsContact C-N 3.34Å; E245-M247 PolarHBondContact O-N 3.05Å; M247-L249 VanDerWaalsContact C-N 3.34Å; M247-L249 PolarHBondContact O-N 3.02Å; M247-V250 PolarHBondContact O-N 3.43Å; M247-V251 HydrophobicContact CE-CG2 4.26Å; M247-V251 VanDerWaalsContact O-CB 3.22Å; M247-V251 WeakPolarHBondContact O-CB 3.33Å; M247-V251 WeakPolarHBondContact O-CG2 3.43Å; M247-V251 PolarHBondContact O-N 3.34Å; M247-M267 HydrophobicContact CE-CE 4.07Å; M247-M267 HydrophobicContact CE-SD 3.72Å; M247-L270 HydrophobicContact CB-CD2 4.48Å; M247-L270 HydrophobicContact CE-CD2 4.16Å; M247-L270 HydrophobicContact SD-CD2 3.61Å; M247-L271 HydrophobicContact CB-CD2 4.31Å
248	R	91.9	Very high	91.7	Very high	63 Å²	63	53 Å²	53	24%	0.238	28%	0.279	C	S	.	.	H	α-helix	trans	-56.2	-49.5	175.6	-168.4	-176.9	67.3	-141.9	-10	111.2	K244 E245 G246 E252 L271 L279	K244-R248 PolarHBondContact O-N 2.94Å; E245-R248 VanDerWaalsContact O-CB 3.3Å; E245-R248 WeakPolarHBondContact O-CB 3.5Å; E245-R248 PolarHBondContact O-N 2.84Å; E245-R248 IonicContact OE1-CZ 2.93Å; E245-R248 IonicContact OE1-NH1 3.42Å; E245-R248 PolarHBondContact OE1-NH1 3.17Å; E245-R248 IonicContact OE2-CZ 2.7Å; E245-R248 IonicContact OE2-NH1 2.86Å; E245-R248 PolarHBondContact OE2-NH1 3.03Å; E245-R248 IonicContact OE2-NH2 3Å; E245-R248 PolarHBondContact OE2-NH2 3.32Å; G246-R248 VanDerWaalsContact C-N 3.27Å; G246-R248 PolarHBondContact O-N 3.43Å; R248-E252 WeakPolarHBondContact O-CB 3.46Å; R248-E252 PolarHBondContact O-N 2.95Å; R248-L271 HydrophobicContact CB-CD2 4.17Å; R248-L279 HydrophobicContact CG-CD2 3.41Å; R248-L279 VanDerWaalsContact CG-CD2 3.41Å
249	L	91.6	Very high	91.7	Very high	104 Å²	104	52.2 Å²	52.2	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-65.2	-46.7	-179.1	-63.1	174.9	0	0	0	111.9	E245 G246 M247 E252 V253	E245-L249 PolarHBondContact O-N 3.17Å; G246-L249 PolarHBondContact O-N 2.96Å; M247-L249 VanDerWaalsContact C-N 3.34Å; M247-L249 PolarHBondContact O-N 3.02Å; L249-E252 PolarHBondContact O-N 3.07Å; L249-V253 WeakPolarHBondContact O-CG2 3.45Å; L249-V253 PolarHBondContact O-N 3.19Å
250	V	92.3	Very high	91.8	Very high	13 Å²	13	54.1 Å²	54.1	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-46.1	-179	173.1	0	0	0	0	111.3	L216 N217 L224 G246 M247 E252 V253 R254	L216-V250 HydrophobicContact CD2-CG2 3.91Å; L216-V250 HydrophobicContact CG-CG2 3.97Å; N217-V250 WeakPolarHBondContact OD1-CG2 3.48Å; L224-V250 HydrophobicContact CD1-CG1 4.26Å; L224-V250 HydrophobicContact CD2-CG1 4.4Å; G246-V250 WeakPolarHBondContact O-CG2 3.49Å; G246-V250 PolarHBondContact O-N 3.41Å; M247-V250 PolarHBondContact O-N 3.43Å; V250-E252 VanDerWaalsContact C-N 3.31Å; V250-E252 PolarHBondContact O-N 3.11Å; V250-V253 PolarHBondContact O-N 3Å; V250-R254 WeakPolarHBondContact O-CB 3.27Å; V250-R254 WeakPolarHBondContact O-CG 3.43Å; V250-R254 PolarHBondContact O-N 2.92Å
251	V	89.8	Confident	91.9	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-36.5	178.1	172.1	0	0	0	0	110.9	M247 V253 R254 L255 I258 M267 L271	M247-V251 HydrophobicContact CE-CG2 4.26Å; M247-V251 VanDerWaalsContact O-CB 3.22Å; M247-V251 WeakPolarHBondContact O-CB 3.33Å; M247-V251 WeakPolarHBondContact O-CG2 3.43Å; M247-V251 PolarHBondContact O-N 3.34Å; V251-V253 VanDerWaalsContact C-N 3.32Å; V251-V253 PolarHBondContact O-N 3.49Å; V251-R254 PolarHBondContact O-N 2.92Å; V251-L255 HydrophobicContact CG1-CD1 4.45Å; V251-L255 WeakPolarHBondContact O-CA 3.41Å; V251-L255 VanDerWaalsContact O-CB 3.27Å; V251-L255 WeakPolarHBondContact O-CB 3.46Å; V251-L255 PolarHBondContact O-N 3.02Å; V251-I258 HydrophobicContact CG1-CD1 4.47Å; V251-M267 HydrophobicContact CG1-CB 4.28Å; V251-M267 HydrophobicContact CG1-CG 4.27Å; V251-M267 HydrophobicContact CG2-CE 4.42Å; V251-M267 HydrophobicContact CG2-CG 4.29Å; V251-M267 HydrophobicContact CG2-SD 3.78Å; V251-L271 HydrophobicContact CB-CD1 3.79Å; V251-L271 HydrophobicContact CG1-CD1 3.9Å; V251-L271 HydrophobicContact CG2-CD1 3.92Å
252	E	90.4	Very high	91.9	Very high	39 Å²	39	54.4 Å²	54.4	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-38.8	178.2	-175.1	166.4	-177.5	0	0	112.9	R248 L249 V250 L279 K282	R248-E252 WeakPolarHBondContact O-CB 3.46Å; R248-E252 PolarHBondContact O-N 2.95Å; L249-E252 PolarHBondContact O-N 3.07Å; V250-E252 VanDerWaalsContact C-N 3.31Å; V250-E252 PolarHBondContact O-N 3.11Å; E252-L279 HydrophobicContact CB-CD1 3.97Å; E252-L279 HydrophobicContact CG-CD1 4.08Å; E252-K282 HydrophobicContact CG-CD 3.92Å; E252-K282 IonicContact OE1-NZ 3.73Å; E252-K282 PolarHBondContact OE1-NZ 2.99Å
253	V	90.8	Very high	91.9	Very high	118 Å²	118	52.6 Å²	52.6	72%	0.715	27%	0.272	S	S	*	.	H	α-helix	trans	-74.6	-43.2	176.9	175	0	0	0	0	111.1	L249 V250 V251 P256	L249-V253 WeakPolarHBondContact O-CG2 3.45Å; L249-V253 PolarHBondContact O-N 3.19Å; V250-V253 PolarHBondContact O-N 3Å; V251-V253 VanDerWaalsContact C-N 3.32Å; V251-V253 PolarHBondContact O-N 3.49Å; V253-P256 WeakPolarHBondContact O-CD 3.37Å
254	R	89.8	Confident	91.9	Very high	56 Å²	56	52.6 Å²	52.6	21%	0.211	27%	0.271	C	S	.	.	H	α-helix	trans	-94.9	6.9	-171.6	-61.5	-178.2	62.2	-162.2	-9.6	114.1	F219 V250 V251 P256 E257	F219-R254 PolarHBondContact O-NH1 3.32Å; V250-R254 WeakPolarHBondContact O-CB 3.27Å; V250-R254 WeakPolarHBondContact O-CG 3.43Å; V250-R254 PolarHBondContact O-N 2.92Å; V251-R254 PolarHBondContact O-N 2.92Å; R254-P256 VanDerWaalsContact C-N 3.27Å; R254-E257 IonicContact CZ-OE2 2.78Å; R254-E257 VanDerWaalsContact CZ-OE2 3.29Å; R254-E257 IonicContact NE-OE1 3.27Å; R254-E257 IonicContact NE-OE2 2.68Å; R254-E257 PolarHBondContact NE-OE2 2.81Å; R254-E257 IonicContact NH2-OE2 3.29Å; R254-E257 PolarHBondContact NH2-OE2 2.77Å; R254-E257 WeakPolarHBondContact O-CB 3.3Å; R254-E257 PolarHBondContact O-N 2.88Å
255	L	90.9	Very high	92	Very high	8 Å²	8	50 Å²	50	4%	0.042	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-51.8	-39.2	177.7	-169.7	63.6	0	0	0	113.7	V251 E257 I258 L264 K282 L283 K286	V251-L255 HydrophobicContact CG1-CD1 4.45Å; V251-L255 WeakPolarHBondContact O-CA 3.41Å; V251-L255 VanDerWaalsContact O-CB 3.27Å; V251-L255 WeakPolarHBondContact O-CB 3.46Å; V251-L255 PolarHBondContact O-N 3.02Å; L255-E257 PolarHBondContact O-N 2.89Å; L255-I258 HydrophobicContact CD1-CD1 4.02Å; L255-I258 PolarHBondContact O-N 2.96Å; L255-L264 HydrophobicContact CD1-CD1 3.94Å; L255-K282 HydrophobicContact CD2-CB 3.69Å; L255-K282 VanDerWaalsContact CD2-O 3.27Å; L255-K282 WeakPolarHBondContact CD2-O 3.46Å; L255-L283 HydrophobicContact CD1-CD2 3.8Å; L255-L283 HydrophobicContact CD2-CD2 4.33Å; L255-K286 HydrophobicContact CD1-CB 4.08Å; L255-K286 HydrophobicContact CD1-CG 3.87Å; L255-K286 HydrophobicContact CD2-CB 3.79Å; L255-K286 HydrophobicContact CD2-CG 4.4Å; L255-K286 HydrophobicContact CG-CB 3.8Å; L255-K286 HydrophobicContact CG-CD 4.49Å; L255-K286 HydrophobicContact CG-CG 3.84Å; L255-K286 WeakPolarHBondContact O-CE 3.05Å
256	P	90.4	Very high	92.1	Very high	100 Å²	100	47.2 Å²	47.2	65%	0.649	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-59.8	-33.6	176.6	-24.9	36.5	0	0	0	113.4	V253 R254 I258 K286	V253-P256 WeakPolarHBondContact O-CD 3.37Å; R254-P256 VanDerWaalsContact C-N 3.27Å; P256-I258 VanDerWaalsContact C-N 3.32Å; P256-I258 PolarHBondContact O-N 3.37Å; P256-K286 PolarHBondContact O-NZ 3.41Å
257	E	91.1	Very high	92.1	Very high	105 Å²	105	46.3 Å²	46.3	49%	0.491	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-72.1	-21.1	-176.7	-59.6	171.5	-162.5	0	0	113.5	R254 L255 Q259	R254-E257 IonicContact CZ-OE2 2.78Å; R254-E257 VanDerWaalsContact CZ-OE2 3.29Å; R254-E257 IonicContact NE-OE1 3.27Å; R254-E257 IonicContact NE-OE2 2.68Å; R254-E257 PolarHBondContact NE-OE2 2.81Å; R254-E257 IonicContact NH2-OE2 3.29Å; R254-E257 PolarHBondContact NH2-OE2 2.77Å; R254-E257 WeakPolarHBondContact O-CB 3.3Å; R254-E257 PolarHBondContact O-N 2.88Å; L255-E257 PolarHBondContact O-N 2.89Å; E257-Q259 PolarHBondContact O-N 2.78Å
258	I	91.6	Very high	92.1	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.056	24%	0.24	C	C	.	.			trans	-66.7	116.4	-177.6	-59.6	-174.9	0	0	0	109.5	V251 L255 P256 T263 L264 M267 K286	V251-I258 HydrophobicContact CG1-CD1 4.47Å; L255-I258 HydrophobicContact CD1-CD1 4.02Å; L255-I258 PolarHBondContact O-N 2.96Å; P256-I258 VanDerWaalsContact C-N 3.32Å; P256-I258 PolarHBondContact O-N 3.37Å; I258-T263 HydrophobicContact CG2-CG2 4.06Å; I258-L264 HydrophobicContact CG2-CB 4.13Å; I258-M267 HydrophobicContact CD1-CG 4.17Å; I258-K286 WeakPolarHBondContact O-CE 3.47Å; I258-K286 PolarHBondContact O-NZ 2.84Å
259	Q	91	Very high	92.3	Very high	156 Å²	156	46.6 Å²	46.6	73%	0.729	24%	0.241	S	C	*	.			trans	-105.5	-16.1	-179.5	-66.5	-178.3	13.3	0	0	113.2	E221 E257 M290	E221-Q259 PolarHBondContact OE2-N 3.41Å; E257-Q259 PolarHBondContact O-N 2.78Å; Q259-M290 VanDerWaalsContact C-CE 3.45Å; Q259-M290 WeakPolarHBondContact O-CE 3.18Å
260	N	92.8	Very high	92.3	Very high	72 Å²	72	42.4 Å²	42.4	39%	0.385	22%	0.219	S	C	.	.			trans	-100.2	129	-177.9	-168.7	-66	0	0	0	112.6	E221 L262 T263 L264	E221-N260 WeakPolarHBondContact OE1-CB 3.49Å; E221-N260 PolarHBondContact OE1-N 3.22Å; E221-N260 VanDerWaalsContact OE1-N 3.1Å; N260-L262 VanDerWaalsContact C-N 3.32Å; N260-L262 PolarHBondContact O-N 2.9Å; N260-L262 WeakPolarHBondContact OD1-CA 3.43Å; N260-L262 VanDerWaalsContact OD1-CB 3.23Å; N260-L262 WeakPolarHBondContact OD1-CB 3.28Å; N260-L262 PolarHBondContact OD1-N 2.99Å; N260-T263 WeakPolarHBondContact O-CB 3.48Å; N260-T263 PolarHBondContact O-N 3.13Å; N260-T263 PolarHBondContact OD1-N 3.14Å; N260-L264 PolarHBondContact O-N 3.31Å
261	V	94.5	Very high	92.3	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-39.2	178.7	177.7	0	0	0	0	112.3	L264 Q265 M290 Q293 F294 N298	V261-L264 PolarHBondContact O-N 3.45Å; V261-Q265 HydrophobicContact CG1-CG 4.34Å; V261-Q265 WeakPolarHBondContact O-CB 3.37Å; V261-Q265 VanDerWaalsContact O-CG 3.27Å; V261-Q265 WeakPolarHBondContact O-CG 3.36Å; V261-Q265 PolarHBondContact O-N 2.94Å; V261-M290 HydrophobicContact CG2-CE 3.85Å; V261-Q293 HydrophobicContact CG2-CB 3.88Å; V261-F294 HydrophobicContact CG1-CD1 3.86Å; V261-F294 HydrophobicContact CG1-CE1 3.65Å; V261-F294 HydrophobicContact CG1-CZ 4.37Å; V261-F294 HydrophobicContact CG2-CD1 4.03Å; V261-F294 HydrophobicContact CG2-CE1 4.07Å; V261-N298 HydrophobicContact CG1-CB 4.01Å
262	L	92.6	Very high	92.2	Very high	75 Å²	75	42.3 Å²	42.3	39%	0.393	22%	0.218	S	C	.	.	H	α-helix	trans	-67.2	-37.8	179	-61.2	173.7	0	0	0	111.4	N260 Q265 T266	N260-L262 VanDerWaalsContact C-N 3.32Å; N260-L262 PolarHBondContact O-N 2.9Å; N260-L262 WeakPolarHBondContact OD1-CA 3.43Å; N260-L262 VanDerWaalsContact OD1-CB 3.23Å; N260-L262 WeakPolarHBondContact OD1-CB 3.28Å; N260-L262 PolarHBondContact OD1-N 2.99Å; L262-Q265 PolarHBondContact O-N 3.25Å; L262-T266 WeakPolarHBondContact O-CB 3.44Å; L262-T266 PolarHBondContact O-N 2.76Å; L262-T266 PolarHBondContact O-OG1 3.44Å
263	T	92.6	Very high	92	Very high	10 Å²	10	48 Å²	48	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-50.4	173.5	-56.9	0	0	0	0	110.1	E221 I258 N260 Q265 T266 M267	E221-T263 HydrophobicContact CG-CG2 3.56Å; E221-T263 WeakPolarHBondContact OE1-CB 3.49Å; E221-T263 PolarHBondContact OE1-OG1 2.9Å; I258-T263 HydrophobicContact CG2-CG2 4.06Å; N260-T263 WeakPolarHBondContact O-CB 3.48Å; N260-T263 PolarHBondContact O-N 3.13Å; N260-T263 PolarHBondContact OD1-N 3.14Å; T263-Q265 VanDerWaalsContact C-N 3.31Å; T263-Q265 PolarHBondContact O-N 2.89Å; T263-T266 PolarHBondContact O-N 2.68Å; T263-T266 VanDerWaalsContact O-N 3.11Å; T263-M267 HydrophobicContact CG2-CE 3.9Å; T263-M267 HydrophobicContact CG2-CG 4.43Å; T263-M267 WeakPolarHBondContact O-CG 3.43Å; T263-M267 PolarHBondContact O-N 3Å
264	L	95.1	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56	-46.6	178	177.8	62.8	0	0	0	111.7	L255 I258 N260 V261 T266 M267 M268 L283 K286 A287 M290	L255-L264 HydrophobicContact CD1-CD1 3.94Å; I258-L264 HydrophobicContact CG2-CB 4.13Å; N260-L264 PolarHBondContact O-N 3.31Å; V261-L264 PolarHBondContact O-N 3.45Å; L264-T266 VanDerWaalsContact C-N 3.32Å; L264-T266 PolarHBondContact O-N 3.42Å; L264-M267 WeakPolarHBondContact O-CB 3.32Å; L264-M267 PolarHBondContact O-N 2.86Å; L264-M268 HydrophobicContact CD1-CG 4.28Å; L264-M268 HydrophobicContact CD1-SD 4.36Å; L264-M268 HydrophobicContact CG-CG 4.47Å; L264-M268 HydrophobicContact CG-SD 4.15Å; L264-M268 WeakPolarHBondContact O-CG 3.29Å; L264-M268 PolarHBondContact O-N 3.05Å; L264-L283 HydrophobicContact CD1-CD2 4.22Å; L264-K286 HydrophobicContact CD1-CG 4.03Å; L264-K286 HydrophobicContact CD2-CG 4.14Å; L264-A287 HydrophobicContact CD2-CB 3.91Å; L264-M290 HydrophobicContact CD2-SD 3.99Å
265	Q	94.7	Very high	91.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-41.9	177	-80	-179.9	-1.4	0	0	112.7	V261 L262 T263 M268 R269 N298 H301 M302 I305	V261-Q265 HydrophobicContact CG1-CG 4.34Å; V261-Q265 WeakPolarHBondContact O-CB 3.37Å; V261-Q265 VanDerWaalsContact O-CG 3.27Å; V261-Q265 WeakPolarHBondContact O-CG 3.36Å; V261-Q265 PolarHBondContact O-N 2.94Å; L262-Q265 PolarHBondContact O-N 3.25Å; T263-Q265 VanDerWaalsContact C-N 3.31Å; T263-Q265 PolarHBondContact O-N 2.89Å; Q265-M268 PolarHBondContact O-N 2.88Å; Q265-R269 WeakPolarHBondContact O-CB 3.3Å; Q265-R269 PolarHBondContact O-N 3.33Å; Q265-N298 PolarHBondContact NE2-O 2.97Å; Q265-H301 PolarHBondContact OE1-ND1 3.09Å; Q265-M302 HydrophobicContact CG-CE 3.48Å; Q265-M302 VanDerWaalsContact CG-CE 3.48Å; Q265-M302 HydrophobicContact CG-SD 4.26Å; Q265-I305 HydrophobicContact CB-CD1 3.47Å; Q265-I305 VanDerWaalsContact CB-CD1 3.47Å; Q265-I305 HydrophobicContact CG-CD1 3.84Å; Q265-I305 WeakPolarHBondContact O-CD1 3.3Å
266	T	93.4	Very high	91.6	Very high	32 Å²	32	49.6 Å²	49.6	20%	0.196	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-40.9	177.3	-55.3	0	0	0	0	111	A228 L262 T263 L264 R269 L270	A228-T266 HydrophobicContact CB-CG2 3.83Å; L262-T266 WeakPolarHBondContact O-CB 3.44Å; L262-T266 PolarHBondContact O-N 2.76Å; L262-T266 PolarHBondContact O-OG1 3.44Å; T263-T266 PolarHBondContact O-N 2.68Å; T263-T266 VanDerWaalsContact O-N 3.11Å; L264-T266 VanDerWaalsContact C-N 3.32Å; L264-T266 PolarHBondContact O-N 3.42Å; T266-R269 PolarHBondContact O-N 3.39Å; T266-L270 PolarHBondContact O-N 3.14Å; T266-L270 VanDerWaalsContact O-N 3.1Å
267	M	93.3	Very high	91.5	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-46.5	173.9	-63	-50	169	0	0	112.2	L224 A228 M247 V251 I258 T263 L264 R269 L270 L271	L224-M267 HydrophobicContact CB-CE 3.51Å; L224-M267 WeakPolarHBondContact O-CE 3.24Å; A228-M267 HydrophobicContact CB-CE 4.3Å; A228-M267 HydrophobicContact CB-SD 3.79Å; M247-M267 HydrophobicContact CE-CE 4.07Å; M247-M267 HydrophobicContact CE-SD 3.72Å; V251-M267 HydrophobicContact CG1-CB 4.28Å; V251-M267 HydrophobicContact CG1-CG 4.27Å; V251-M267 HydrophobicContact CG2-CE 4.42Å; V251-M267 HydrophobicContact CG2-CG 4.29Å; V251-M267 HydrophobicContact CG2-SD 3.78Å; I258-M267 HydrophobicContact CD1-CG 4.17Å; T263-M267 HydrophobicContact CG2-CE 3.9Å; T263-M267 HydrophobicContact CG2-CG 4.43Å; T263-M267 WeakPolarHBondContact O-CG 3.43Å; T263-M267 PolarHBondContact O-N 3Å; L264-M267 WeakPolarHBondContact O-CB 3.32Å; L264-M267 PolarHBondContact O-N 2.86Å; M267-R269 VanDerWaalsContact C-N 3.27Å; M267-R269 PolarHBondContact O-N 3.36Å; M267-L270 PolarHBondContact O-N 3.34Å; M267-L271 WeakPolarHBondContact O-CB 3.35Å; M267-L271 PolarHBondContact O-N 3.09Å
268	M	94.5	Very high	91.5	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-37.1	177.8	-73.2	-177.8	73.5	0	0	111.7	L264 Q265 G272 L283 A287 M302 I305 F311 L316	L264-M268 HydrophobicContact CD1-CG 4.28Å; L264-M268 HydrophobicContact CD1-SD 4.36Å; L264-M268 HydrophobicContact CG-CG 4.47Å; L264-M268 HydrophobicContact CG-SD 4.15Å; L264-M268 WeakPolarHBondContact O-CG 3.29Å; L264-M268 PolarHBondContact O-N 3.05Å; Q265-M268 PolarHBondContact O-N 2.88Å; M268-G272 WeakPolarHBondContact O-CA 3.46Å; M268-G272 PolarHBondContact O-N 3.22Å; M268-L283 HydrophobicContact CG-CB 4.34Å; M268-L283 HydrophobicContact CG-CD1 4.34Å; M268-L283 HydrophobicContact CG-CD2 4Å; M268-L283 HydrophobicContact CG-CG 4.46Å; M268-A287 HydrophobicContact SD-CB 4.34Å; M268-M302 HydrophobicContact CE-SD 4Å; M268-M302 HydrophobicContact SD-CE 3.69Å; M268-M302 HydrophobicContact SD-SD 3.82Å; M268-I305 HydrophobicContact CB-CG2 4.03Å; M268-F311 HydrophobicContact CE-CD1 4.41Å; M268-F311 HydrophobicContact CE-CD2 4.34Å; M268-F311 HydrophobicContact CE-CE1 4.19Å; M268-F311 HydrophobicContact CE-CE2 4.12Å; M268-F311 HydrophobicContact CE-CG 4.49Å; M268-F311 HydrophobicContact CE-CZ 4.04Å; M268-L316 HydrophobicContact CE-CD2 4.26Å
269	R	94.3	Very high	91.4	Very high	68 Å²	68	55 Å²	55	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-65.5	-44.2	175.6	-178	171.8	-73.2	170.8	1.6	112.4	E232 Q265 T266 M267 H301 I305 V309	E232-R269 VanDerWaalsContact CD-CD 3.44Å; E232-R269 HydrophobicContact CG-CG 4.1Å; E232-R269 WeakPolarHBondContact OE1-CD 3.32Å; Q265-R269 WeakPolarHBondContact O-CB 3.3Å; Q265-R269 PolarHBondContact O-N 3.33Å; T266-R269 PolarHBondContact O-N 3.39Å; M267-R269 VanDerWaalsContact C-N 3.27Å; M267-R269 PolarHBondContact O-N 3.36Å; R269-H301 PolarHBondContact NH1-NE2 3.07Å; R269-H301 PolarHBondContact NH2-CD2 2.87Å; R269-H301 PolarHBondContact NH2-CE1 3.22Å; R269-H301 PolarHBondContact NH2-NE2 3.16Å; R269-I305 HydrophobicContact CB-CG1 4.24Å; R269-I305 HydrophobicContact CB-CG2 4.17Å; R269-V309 WeakPolarHBondContact O-CG1 3.48Å
270	L	92.8	Very high	91.4	Very high	17 Å²	17	51 Å²	51	9%	0.089	24%	0.237	C	C	.	.	H	α-helix	trans	-69.3	-49	179.9	179.9	74.4	0	0	0	111.9	A228 L231 E232 K244 M247 T266 M267	A228-L270 HydrophobicContact CB-CB 4.21Å; A228-L270 HydrophobicContact CB-CD2 3.75Å; L231-L270 HydrophobicContact CB-CD1 3.68Å; L231-L270 HydrophobicContact CB-CD2 4.5Å; L231-L270 HydrophobicContact CD1-CD2 4.48Å; E232-L270 HydrophobicContact CB-CD1 4.26Å; K244-L270 HydrophobicContact CD-CD1 4.33Å; K244-L270 HydrophobicContact CG-CD1 4.23Å; M247-L270 HydrophobicContact CB-CD2 4.48Å; M247-L270 HydrophobicContact CE-CD2 4.16Å; M247-L270 HydrophobicContact SD-CD2 3.61Å; T266-L270 PolarHBondContact O-N 3.14Å; T266-L270 VanDerWaalsContact O-N 3.1Å; M267-L270 PolarHBondContact O-N 3.34Å
271	L	91.4	Very high	91.4	Very high	13 Å²	13	51 Å²	51	7%	0.068	24%	0.235	C	C	.	.	H	α-helix	trans	-100.4	-16.6	-164.6	-58.9	175.2	0	0	0	113.2	M247 R248 V251 M267 R273 A275	M247-L271 HydrophobicContact CB-CD2 4.31Å; R248-L271 HydrophobicContact CB-CD2 4.17Å; V251-L271 HydrophobicContact CB-CD1 3.79Å; V251-L271 HydrophobicContact CG1-CD1 3.9Å; V251-L271 HydrophobicContact CG2-CD1 3.92Å; M267-L271 WeakPolarHBondContact O-CB 3.35Å; M267-L271 PolarHBondContact O-N 3.09Å; L271-R273 VanDerWaalsContact C-N 3.33Å; L271-R273 PolarHBondContact O-N 3.44Å; L271-A275 VanDerWaalsContact O-CB 3.29Å; L271-A275 WeakPolarHBondContact O-CB 3.41Å
272	G	87.4	Confident	91.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-70.5	-27.3	-172.1	0	0	0	0	0	114.3	M268 D274 A275 R280	M268-G272 WeakPolarHBondContact O-CA 3.46Å; M268-G272 PolarHBondContact O-N 3.22Å; G272-D274 PolarHBondContact O-N 3.13Å; G272-A275 PolarHBondContact O-N 3.03Å; G272-R280 PolarHBondContact O-NE 3.14Å; G272-R280 PolarHBondContact O-NH2 3.09Å
273	R	87.8	Confident	91.5	Very high	158 Å²	158	50.2 Å²	50.2	60%	0.596	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	125.7	175.9	-175.4	176.1	-66.8	175.3	1.3	108.7	L271 A275 A308 V309	L271-R273 VanDerWaalsContact C-N 3.33Å; L271-R273 PolarHBondContact O-N 3.44Å; R273-A275 PolarHBondContact O-N 2.97Å; R273-A308 PolarHBondContact NH2-O 2.97Å; R273-V309 HydrophobicContact CB-CB 4.37Å; R273-V309 HydrophobicContact CB-CG1 4.41Å
274	D	83.7	Confident	91.7	Very high	144 Å²	144	52 Å²	52	77%	0.77	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	16.4	-179	-48.7	-41.1	0	0	0	115.1	G272	G272-D274 PolarHBondContact O-N 3.13Å
275	A	87.7	Confident	91.7	Very high	11 Å²	11	58.9 Å²	58.9	9%	0.091	26%	0.261	C	S	.	.			trans	-58	139.2	175.1	0	0	0	0	0	111.7	L271 G272 R273 L279 R280	L271-A275 VanDerWaalsContact O-CB 3.29Å; L271-A275 WeakPolarHBondContact O-CB 3.41Å; G272-A275 PolarHBondContact O-N 3.03Å; R273-A275 PolarHBondContact O-N 2.97Å; A275-L279 HydrophobicContact CB-CD2 4.18Å; A275-L279 HydrophobicContact CB-CG 4.46Å; A275-R280 HydrophobicContact CB-CG 3.58Å; A275-R280 PolarHBondContact O-NE 2.69Å
276	P	89.9	Confident	91.8	Very high	60 Å²	60	60.4 Å²	60.4	39%	0.39	27%	0.268	S	S	.	.			trans	-53.3	150	168.2	-24.6	33.8	0	0	0	111.7	E278 L279 R280	P276-E278 PolarHBondContact O-N 2.82Å; P276-L279 PolarHBondContact O-N 3.27Å; P276-R280 PolarHBondContact O-N 2.81Å
277	R	90	Very high	91.9	Very high	198 Å²	198	58.9 Å²	58.9	75%	0.747	26%	0.258	S	S	*	.	H	α-helix	trans	-53.7	-40.9	-177.6	-174.6	-178.2	178.8	-158.6	0.4	112.4	R280 Q281	R277-R280 PolarHBondContact O-N 3.46Å; R277-Q281 WeakPolarHBondContact O-CG 3.48Å; R277-Q281 PolarHBondContact O-N 3.34Å
278	E	89.4	Confident	92.1	Very high	131 Å²	131	61.2 Å²	61.2	61%	0.612	27%	0.271	S	S	*	.	H	α-helix	trans	-63.3	-48	-179.4	-64.6	-179	-170.4	0	0	112.2	P276 R280 Q281 K282	P276-E278 PolarHBondContact O-N 2.82Å; E278-R280 VanDerWaalsContact C-N 3.33Å; E278-R280 PolarHBondContact O-N 2.87Å; E278-Q281 PolarHBondContact O-N 3.26Å; E278-K282 WeakPolarHBondContact O-CG 3.44Å; E278-K282 PolarHBondContact O-N 3.31Å
279	L	90.6	Very high	92.2	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-41.7	176.2	178.4	59.8	0	0	0	111.3	R248 E252 A275 P276 Q281 K282 L283	R248-L279 HydrophobicContact CG-CD2 3.41Å; R248-L279 VanDerWaalsContact CG-CD2 3.41Å; E252-L279 HydrophobicContact CB-CD1 3.97Å; E252-L279 HydrophobicContact CG-CD1 4.08Å; A275-L279 HydrophobicContact CB-CD2 4.18Å; A275-L279 HydrophobicContact CB-CG 4.46Å; P276-L279 PolarHBondContact O-N 3.27Å; L279-Q281 VanDerWaalsContact C-N 3.33Å; L279-Q281 PolarHBondContact O-N 2.92Å; L279-K282 PolarHBondContact O-N 3.15Å; L279-L283 HydrophobicContact CD1-CD1 4.24Å; L279-L283 HydrophobicContact CD1-CG 4.09Å; L279-L283 HydrophobicContact CG-CD1 3.99Å; L279-L283 HydrophobicContact CG-CG 4.31Å; L279-L283 WeakPolarHBondContact O-CB 3.37Å; L279-L283 VanDerWaalsContact O-CG 3.32Å; L279-L283 WeakPolarHBondContact O-CG 3.39Å; L279-L283 PolarHBondContact O-N 2.73Å
280	R	91.8	Very high	92.3	Very high	74 Å²	74	61.8 Å²	61.8	28%	0.279	29%	0.285	S	S	.	.	H	α-helix	trans	-58.2	-45.4	175.5	-72.7	-174.7	165.5	-174	-6.2	111.9	G272 A275 P276 R277 E278 K282 L283 E284 F311	G272-R280 PolarHBondContact O-NE 3.14Å; G272-R280 PolarHBondContact O-NH2 3.09Å; A275-R280 HydrophobicContact CB-CG 3.58Å; A275-R280 PolarHBondContact O-NE 2.69Å; P276-R280 PolarHBondContact O-N 2.81Å; R277-R280 PolarHBondContact O-N 3.46Å; E278-R280 VanDerWaalsContact C-N 3.33Å; E278-R280 PolarHBondContact O-N 2.87Å; R280-K282 PolarHBondContact O-N 2.78Å; R280-L283 PolarHBondContact O-N 3.48Å; R280-E284 WeakPolarHBondContact O-CB 3.37Å; R280-E284 PolarHBondContact O-N 2.9Å; R280-F311 HydrophobicContact CB-CE2 3.89Å; R280-F311 HydrophobicContact CB-CZ 4.4Å; R280-F311 HydrophobicContact CG-CD2 4.26Å; R280-F311 HydrophobicContact CG-CE2 3.95Å; R280-F311 WeakPolarHBondContact O-CZ 3.43Å
281	Q	92.9	Very high	92.4	Very high	71 Å²	71	62.7 Å²	62.7	33%	0.332	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-37	177.2	-72	174.9	-14	0	0	112.7	R277 E278 L279 R285	R277-Q281 WeakPolarHBondContact O-CG 3.48Å; R277-Q281 PolarHBondContact O-N 3.34Å; E278-Q281 PolarHBondContact O-N 3.26Å; L279-Q281 VanDerWaalsContact C-N 3.33Å; L279-Q281 PolarHBondContact O-N 2.92Å; Q281-R285 WeakPolarHBondContact O-CB 3.28Å; Q281-R285 WeakPolarHBondContact O-CG 3.28Å; Q281-R285 PolarHBondContact O-N 3.28Å; Q281-R285 PolarHBondContact O-NE 2.91Å
282	K	94.3	Very high	92.5	Very high	66 Å²	66	67.8 Å²	67.8	29%	0.287	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-47	175.1	-73.8	176.1	-179.3	172.8	0	110.9	E252 L255 E278 L279 R280 E284 R285 K286	E252-K282 HydrophobicContact CG-CD 3.92Å; E252-K282 IonicContact OE1-NZ 3.73Å; E252-K282 PolarHBondContact OE1-NZ 2.99Å; L255-K282 HydrophobicContact CD2-CB 3.69Å; L255-K282 VanDerWaalsContact CD2-O 3.27Å; L255-K282 WeakPolarHBondContact CD2-O 3.46Å; E278-K282 WeakPolarHBondContact O-CG 3.44Å; E278-K282 PolarHBondContact O-N 3.31Å; L279-K282 PolarHBondContact O-N 3.15Å; R280-K282 PolarHBondContact O-N 2.78Å; K282-E284 PolarHBondContact O-N 3.12Å; K282-R285 PolarHBondContact O-N 3.47Å; K282-K286 WeakPolarHBondContact O-CB 3.39Å; K282-K286 PolarHBondContact O-N 3Å
283	L	94.8	Very high	92.8	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-43.7	176	-71.1	170.8	0	0	0	111.8	L255 L264 M268 L279 R280 K286 A287 F311	L255-L283 HydrophobicContact CD1-CD2 3.8Å; L255-L283 HydrophobicContact CD2-CD2 4.33Å; L264-L283 HydrophobicContact CD1-CD2 4.22Å; M268-L283 HydrophobicContact CG-CB 4.34Å; M268-L283 HydrophobicContact CG-CD1 4.34Å; M268-L283 HydrophobicContact CG-CD2 4Å; M268-L283 HydrophobicContact CG-CG 4.46Å; L279-L283 HydrophobicContact CD1-CD1 4.24Å; L279-L283 HydrophobicContact CD1-CG 4.09Å; L279-L283 HydrophobicContact CG-CD1 3.99Å; L279-L283 HydrophobicContact CG-CG 4.31Å; L279-L283 WeakPolarHBondContact O-CB 3.37Å; L279-L283 VanDerWaalsContact O-CG 3.32Å; L279-L283 WeakPolarHBondContact O-CG 3.39Å; L279-L283 PolarHBondContact O-N 2.73Å; R280-L283 PolarHBondContact O-N 3.48Å; L283-K286 PolarHBondContact O-N 3.31Å; L283-A287 WeakPolarHBondContact O-CB 3.37Å; L283-A287 PolarHBondContact O-N 3.28Å; L283-F311 HydrophobicContact CB-CE2 4.33Å; L283-F311 HydrophobicContact CB-CZ 4.48Å
284	E	95.6	Very high	93.2	Very high	46 Å²	46	65.2 Å²	65.2	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-51.9	174.6	177.4	173.2	-160.3	0	0	111.5	R280 K282 K286 A287 L288 F311 S313	R280-E284 WeakPolarHBondContact O-CB 3.37Å; R280-E284 PolarHBondContact O-N 2.9Å; K282-E284 PolarHBondContact O-N 3.12Å; E284-K286 VanDerWaalsContact C-N 3.28Å; E284-K286 PolarHBondContact O-N 3.04Å; E284-A287 PolarHBondContact O-N 2.89Å; E284-L288 HydrophobicContact CG-CD1 3.85Å; E284-L288 HydrophobicContact CG-CG 4.45Å; E284-L288 WeakPolarHBondContact O-CB 3.25Å; E284-L288 WeakPolarHBondContact O-CG 3.3Å; E284-L288 PolarHBondContact O-N 3.16Å; E284-F311 HydrophobicContact CB-CE1 4.23Å; E284-F311 HydrophobicContact CB-CZ 3.94Å; E284-S313 VanDerWaalsContact CD-OG 3.23Å; E284-S313 WeakPolarHBondContact OE1-CB 3.3Å; E284-S313 PolarHBondContact OE1-OG 3.07Å
285	R	95.7	Very high	93.8	Very high	146 Å²	146	60.9 Å²	60.9	55%	0.551	30%	0.296	S	S	*	.	H	α-helix	trans	-57.6	-42.1	178.4	-79.7	179.5	-92.5	135.4	-11.3	111.9	Q281 K282 L288 S289	Q281-R285 WeakPolarHBondContact O-CB 3.28Å; Q281-R285 WeakPolarHBondContact O-CG 3.28Å; Q281-R285 PolarHBondContact O-N 3.28Å; Q281-R285 PolarHBondContact O-NE 2.91Å; K282-R285 PolarHBondContact O-N 3.47Å; R285-L288 PolarHBondContact O-N 3.26Å; R285-S289 PolarHBondContact O-N 3Å
286	K	96.3	Very high	94.2	Very high	31 Å²	31	61.8 Å²	61.8	14%	0.135	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-41.3	177.1	-177.3	62.4	177.2	-179.8	0	112.4	L255 P256 I258 L264 K282 L283 E284 L288 S289 M290	L255-K286 HydrophobicContact CD1-CB 4.08Å; L255-K286 HydrophobicContact CD1-CG 3.87Å; L255-K286 HydrophobicContact CD2-CB 3.79Å; L255-K286 HydrophobicContact CD2-CG 4.4Å; L255-K286 HydrophobicContact CG-CB 3.8Å; L255-K286 HydrophobicContact CG-CD 4.49Å; L255-K286 HydrophobicContact CG-CG 3.84Å; L255-K286 WeakPolarHBondContact O-CE 3.05Å; P256-K286 PolarHBondContact O-NZ 3.41Å; I258-K286 WeakPolarHBondContact O-CE 3.47Å; I258-K286 PolarHBondContact O-NZ 2.84Å; L264-K286 HydrophobicContact CD1-CG 4.03Å; L264-K286 HydrophobicContact CD2-CG 4.14Å; K282-K286 WeakPolarHBondContact O-CB 3.39Å; K282-K286 PolarHBondContact O-N 3Å; L283-K286 PolarHBondContact O-N 3.31Å; E284-K286 VanDerWaalsContact C-N 3.28Å; E284-K286 PolarHBondContact O-N 3.04Å; K286-L288 VanDerWaalsContact C-N 3.34Å; K286-S289 PolarHBondContact O-N 3.42Å; K286-S289 PolarHBondContact O-OG 3.22Å; K286-M290 HydrophobicContact CD-SD 4.24Å; K286-M290 VanDerWaalsContact CE-SD 3.57Å; K286-M290 HydrophobicContact CG-SD 4.37Å; K286-M290 WeakPolarHBondContact O-CG 3.45Å; K286-M290 PolarHBondContact O-N 3.01Å
287	A	96.7	Very high	94.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-40.9	176.2	0	0	0	0	0	111.7	L264 M268 L283 E284 M290 S291 M302 L316	L264-A287 HydrophobicContact CD2-CB 3.91Å; M268-A287 HydrophobicContact SD-CB 4.34Å; L283-A287 WeakPolarHBondContact O-CB 3.37Å; L283-A287 PolarHBondContact O-N 3.28Å; E284-A287 PolarHBondContact O-N 2.89Å; A287-M290 CarbonylContact O-C 3.57Å; A287-M290 PolarHBondContact O-N 3.26Å; A287-S291 PolarHBondContact O-N 3.46Å; A287-M302 HydrophobicContact CB-CE 4.38Å; A287-L316 HydrophobicContact CB-CD1 3.84Å; A287-L316 HydrophobicContact CB-CD2 3.68Å; A287-L316 HydrophobicContact CB-CG 4.43Å
288	L	96.9	Very high	94.8	Very high	50 Å²	50	54.5 Å²	54.5	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-37.5	176.4	-69.7	170.5	0	0	0	112.4	E284 R285 K286 M290 S291 P315 L316 V319	E284-L288 HydrophobicContact CG-CD1 3.85Å; E284-L288 HydrophobicContact CG-CG 4.45Å; E284-L288 WeakPolarHBondContact O-CB 3.25Å; E284-L288 WeakPolarHBondContact O-CG 3.3Å; E284-L288 PolarHBondContact O-N 3.16Å; R285-L288 PolarHBondContact O-N 3.26Å; K286-L288 VanDerWaalsContact C-N 3.34Å; L288-M290 PolarHBondContact O-N 3.48Å; L288-S291 VanDerWaalsContact O-CB 3.26Å; L288-S291 WeakPolarHBondContact O-CB 3.48Å; L288-S291 PolarHBondContact O-N 3.44Å; L288-S291 PolarHBondContact O-OG 3.08Å; L288-P315 HydrophobicContact CD1-CB 4.09Å; L288-P315 HydrophobicContact CD2-CB 4.03Å; L288-L316 HydrophobicContact CD2-CB 4.26Å; L288-L316 HydrophobicContact CD2-CD1 4.3Å; L288-V319 HydrophobicContact CD2-CG2 4.22Å
289	S	95.9	Very high	95.2	Very high	77 Å²	77	48.3 Å²	48.3	54%	0.538	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-12	176.1	70.5	0	0	0	0	114	R285 K286	R285-S289 PolarHBondContact O-N 3Å; K286-S289 PolarHBondContact O-N 3.42Å; K286-S289 PolarHBondContact O-OG 3.22Å
290	M	95.9	Very high	95.5	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.02	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	14.6	177.9	-58.9	176.7	70.8	0	0	112	Q259 V261 L264 K286 A287 L288 D292 Q293 F294	Q259-M290 VanDerWaalsContact C-CE 3.45Å; Q259-M290 WeakPolarHBondContact O-CE 3.18Å; V261-M290 HydrophobicContact CG2-CE 3.85Å; L264-M290 HydrophobicContact CD2-SD 3.99Å; K286-M290 HydrophobicContact CD-SD 4.24Å; K286-M290 VanDerWaalsContact CE-SD 3.57Å; K286-M290 HydrophobicContact CG-SD 4.37Å; K286-M290 WeakPolarHBondContact O-CG 3.45Å; K286-M290 PolarHBondContact O-N 3.01Å; A287-M290 CarbonylContact O-C 3.57Å; A287-M290 PolarHBondContact O-N 3.26Å; L288-M290 PolarHBondContact O-N 3.48Å; M290-D292 VanDerWaalsContact C-N 3.25Å; M290-D292 VanDerWaalsContact C-OD1 3.28Å; M290-D292 PolarHBondContact O-N 3.02Å; M290-Q293 WeakPolarHBondContact O-CB 3.5Å; M290-Q293 PolarHBondContact O-N 2.87Å; M290-Q293 VanDerWaalsContact O-N 3.09Å; M290-F294 HydrophobicContact CB-CE1 4.45Å; M290-F294 WeakPolarHBondContact O-CD1 3.27Å; M290-F294 WeakPolarHBondContact O-CE1 3.44Å
291	S	94.6	Very high	95.7	Very high	37 Å²	37	48 Å²	48	26%	0.259	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-62.8	-30.8	-174.3	51.3	0	0	0	0	113.4	A287 L288 Q293 F294	A287-S291 PolarHBondContact O-N 3.46Å; L288-S291 VanDerWaalsContact O-CB 3.26Å; L288-S291 WeakPolarHBondContact O-CB 3.48Å; L288-S291 PolarHBondContact O-N 3.44Å; L288-S291 PolarHBondContact O-OG 3.08Å; S291-Q293 VanDerWaalsContact C-N 3.26Å; S291-Q293 PolarHBondContact O-N 3.35Å; S291-F294 WeakPolarHBondContact O-CB 3.43Å; S291-F294 PolarHBondContact O-N 2.96Å
292	D	93.9	Very high	96	Very high	120 Å²	120	44.6 Å²	44.6	64%	0.642	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-63	-30.6	174.1	61.4	-39.9	0	0	0	112.8	M290 F294	M290-D292 VanDerWaalsContact C-N 3.25Å; M290-D292 VanDerWaalsContact C-OD1 3.28Å; M290-D292 PolarHBondContact O-N 3.02Å; D292-F294 VanDerWaalsContact C-N 3.29Å; D292-F294 PolarHBondContact O-N 3.5Å
293	Q	95.4	Very high	96.1	Very high	98 Å²	98	41.4 Å²	41.4	46%	0.458	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-84	-1	179.5	-57.1	174	28.2	0	0	113.3	V261 M290 S291 S295	V261-Q293 HydrophobicContact CG2-CB 3.88Å; M290-Q293 WeakPolarHBondContact O-CB 3.5Å; M290-Q293 PolarHBondContact O-N 2.87Å; M290-Q293 VanDerWaalsContact O-N 3.09Å; S291-Q293 VanDerWaalsContact C-N 3.26Å; S291-Q293 PolarHBondContact O-N 3.35Å; Q293-S295 PolarHBondContact O-N 2.86Å
294	F	95.7	Very high	96.2	Very high	6 Å²	6	43.7 Å²	43.7	3%	0.026	23%	0.229	C	C	.	.			trans	-76.1	112.4	-178.3	-78.6	26.6	0	0	0	110.6	V261 M290 S291 D292 N298 M302 L316 V319	V261-F294 HydrophobicContact CG1-CD1 3.86Å; V261-F294 HydrophobicContact CG1-CE1 3.65Å; V261-F294 HydrophobicContact CG1-CZ 4.37Å; V261-F294 HydrophobicContact CG2-CD1 4.03Å; V261-F294 HydrophobicContact CG2-CE1 4.07Å; M290-F294 HydrophobicContact CB-CE1 4.45Å; M290-F294 WeakPolarHBondContact O-CD1 3.27Å; M290-F294 WeakPolarHBondContact O-CE1 3.44Å; S291-F294 WeakPolarHBondContact O-CB 3.43Å; S291-F294 PolarHBondContact O-N 2.96Å; D292-F294 VanDerWaalsContact C-N 3.29Å; D292-F294 PolarHBondContact O-N 3.5Å; F294-N298 HydrophobicContact CB-CB 4.46Å; F294-N298 HydrophobicContact CG-CB 4.49Å; F294-M302 HydrophobicContact CE2-CB 4.21Å; F294-M302 HydrophobicContact CE2-CE 4.24Å; F294-M302 HydrophobicContact CE2-CG 4.07Å; F294-M302 HydrophobicContact CZ-CE 3.78Å; F294-L316 HydrophobicContact CE2-CD1 3.93Å; F294-L316 HydrophobicContact CZ-CD1 4.18Å; F294-V319 HydrophobicContact CD2-CG1 4.37Å
295	S	95.8	Very high	96.2	Very high	52 Å²	52	41.5 Å²	41.5	36%	0.364	22%	0.218	S	C	.	.			trans	-74.8	168.1	161.8	68.2	0	0	0	0	111.1	Q293 N298 A299	Q293-S295 PolarHBondContact O-N 2.86Å; S295-N298 WeakPolarHBondContact O-CB 3.35Å; S295-N298 PolarHBondContact O-N 2.91Å; S295-N298 VanDerWaalsContact O-N 3.11Å; S295-N298 PolarHBondContact OG-N 2.9Å; S295-N298 PolarHBondContact OG-ND2 3.16Å; S295-A299 PolarHBondContact O-N 3Å
296	L	96	Very high	96.3	Very high	30 Å²	30	34.5 Å²	34.5	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-55	-50.5	174.3	172	66.9	0	0	0	112.5	N298 A299 Q300 I324 N327 H330 I331	L296-N298 PolarHBondContact O-N 2.77Å; L296-A299 PolarHBondContact O-N 2.85Å; L296-Q300 HydrophobicContact CD1-CG 4.07Å; L296-Q300 HydrophobicContact CG-CG 4.45Å; L296-Q300 VanDerWaalsContact O-CG 3.27Å; L296-Q300 WeakPolarHBondContact O-CG 3.23Å; L296-Q300 PolarHBondContact O-N 2.73Å; L296-I324 HydrophobicContact CD1-CG1 4.23Å; L296-N327 HydrophobicContact CD1-CB 4.01Å; L296-N327 HydrophobicContact CD2-CB 3.68Å; L296-N327 HydrophobicContact CG-CB 4.28Å; L296-H330 HydrophobicContact CD2-CB 4.33Å; L296-I331 HydrophobicContact CD1-CD1 4.04Å; L296-I331 HydrophobicContact CD1-CG1 4.4Å; L296-I331 HydrophobicContact CD2-CG1 4.26Å
297	P	96.4	Very high	96.3	Very high	81 Å²	81	33.7 Å²	33.7	53%	0.526	19%	0.191	S	C	.	.	H	α-helix	trans	-56.7	-38.2	174.6	-26.8	34.7	0	0	0	113.2	Q300 H301	P297-Q300 PolarHBondContact O-N 2.92Å; P297-H301 VanDerWaalsContact O-CB 3.24Å; P297-H301 WeakPolarHBondContact O-CB 3.37Å; P297-H301 PolarHBondContact O-N 3.4Å
298	N	96.1	Very high	96.2	Very high	25 Å²	25	36.2 Å²	36.2	13%	0.134	21%	0.212	C	C	.	.	H	α-helix	trans	-64.7	-45.4	177.4	-69.3	-13.7	0	0	0	111.2	V261 Q265 F294 S295 L296 H301 M302	V261-N298 HydrophobicContact CG1-CB 4.01Å; Q265-N298 PolarHBondContact NE2-O 2.97Å; F294-N298 HydrophobicContact CB-CB 4.46Å; F294-N298 HydrophobicContact CG-CB 4.49Å; S295-N298 WeakPolarHBondContact O-CB 3.35Å; S295-N298 PolarHBondContact O-N 2.91Å; S295-N298 VanDerWaalsContact O-N 3.11Å; S295-N298 PolarHBondContact OG-N 2.9Å; S295-N298 PolarHBondContact OG-ND2 3.16Å; L296-N298 PolarHBondContact O-N 2.77Å; N298-H301 PolarHBondContact O-N 3Å; N298-M302 VanDerWaalsContact O-CB 3.28Å; N298-M302 WeakPolarHBondContact O-CB 3.3Å; N298-M302 PolarHBondContact O-N 3.28Å
299	A	97.3	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-42.7	178	0	0	0	0	0	112.5	S295 L296 T303 C320 K323 I324	S295-A299 PolarHBondContact O-N 3Å; L296-A299 PolarHBondContact O-N 2.85Å; A299-T303 PolarHBondContact O-N 3.16Å; A299-T303 PolarHBondContact O-OG1 3.47Å; A299-C320 HydrophobicContact CB-CB 4.18Å; A299-K323 HydrophobicContact CB-CB 3.88Å; A299-I324 HydrophobicContact CB-CG1 4.42Å
300	Q	97.4	Very high	95.8	Very high	25 Å²	25	32 Å²	32	12%	0.117	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-50.5	175.2	-65.7	172	-11.1	0	0	110.8	L296 P297 M302 T303 F304 I324 I335 I339	L296-Q300 HydrophobicContact CD1-CG 4.07Å; L296-Q300 HydrophobicContact CG-CG 4.45Å; L296-Q300 VanDerWaalsContact O-CG 3.27Å; L296-Q300 WeakPolarHBondContact O-CG 3.23Å; L296-Q300 PolarHBondContact O-N 2.73Å; P297-Q300 PolarHBondContact O-N 2.92Å; Q300-M302 PolarHBondContact O-N 2.81Å; Q300-T303 WeakPolarHBondContact O-CB 3.48Å; Q300-T303 PolarHBondContact O-N 3.49Å; Q300-F304 HydrophobicContact CB-CE2 4.2Å; Q300-F304 HydrophobicContact CB-CZ 4.37Å; Q300-F304 VanDerWaalsContact O-CD2 3.29Å; Q300-F304 WeakPolarHBondContact O-CD2 3.37Å; Q300-F304 VanDerWaalsContact O-CG 3.23Å; Q300-F304 WeakPolarHBondContact O-CG 3.4Å; Q300-F304 PolarHBondContact O-N 3.41Å; Q300-I324 HydrophobicContact CG-CG1 4.31Å; Q300-I335 HydrophobicContact CG-CG2 4.21Å; Q300-I339 HydrophobicContact CG-CD1 3.96Å
301	H	96.8	Very high	95.6	Very high	42 Å²	42	32.1 Å²	32.1	19%	0.194	19%	0.191	C	C	.	.	H	α-helix	trans	-64.9	-39	-178.9	-170.3	-112.3	0	0	0	112.4	Q265 R269 P297 N298 T303 F304 I305	Q265-H301 PolarHBondContact OE1-ND1 3.09Å; R269-H301 PolarHBondContact NH1-NE2 3.07Å; R269-H301 PolarHBondContact NH2-CD2 2.87Å; R269-H301 PolarHBondContact NH2-CE1 3.22Å; R269-H301 PolarHBondContact NH2-NE2 3.16Å; P297-H301 VanDerWaalsContact O-CB 3.24Å; P297-H301 WeakPolarHBondContact O-CB 3.37Å; P297-H301 PolarHBondContact O-N 3.4Å; N298-H301 PolarHBondContact O-N 3Å; H301-T303 VanDerWaalsContact C-N 3.35Å; H301-F304 PolarHBondContact O-N 2.86Å; H301-I305 VanDerWaalsContact CE1-CD1 3.42Å; H301-I305 WeakPolarHBondContact CE1-CD1 3.28Å; H301-I305 VanDerWaalsContact ND1-CD1 3.34Å; H301-I305 WeakPolarHBondContact ND1-CD1 3.31Å; H301-I305 VanDerWaalsContact O-CG1 3.3Å; H301-I305 WeakPolarHBondContact O-CG1 3.44Å; H301-I305 PolarHBondContact O-N 3.07Å
302	M	97.5	Very high	95.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-43.6	174.3	-173.8	57.6	83.2	0	0	111.3	Q265 M268 A287 F294 N298 Q300 F304 I305 M306 L316	Q265-M302 HydrophobicContact CG-CE 3.48Å; Q265-M302 VanDerWaalsContact CG-CE 3.48Å; Q265-M302 HydrophobicContact CG-SD 4.26Å; M268-M302 HydrophobicContact CE-SD 4Å; M268-M302 HydrophobicContact SD-CE 3.69Å; M268-M302 HydrophobicContact SD-SD 3.82Å; A287-M302 HydrophobicContact CB-CE 4.38Å; F294-M302 HydrophobicContact CE2-CB 4.21Å; F294-M302 HydrophobicContact CE2-CE 4.24Å; F294-M302 HydrophobicContact CE2-CG 4.07Å; F294-M302 HydrophobicContact CZ-CE 3.78Å; N298-M302 VanDerWaalsContact O-CB 3.28Å; N298-M302 WeakPolarHBondContact O-CB 3.3Å; N298-M302 PolarHBondContact O-N 3.28Å; Q300-M302 PolarHBondContact O-N 2.81Å; M302-F304 VanDerWaalsContact C-N 3.33Å; M302-F304 PolarHBondContact O-N 3.47Å; M302-I305 PolarHBondContact O-N 3.26Å; M302-M306 HydrophobicContact CG-CE 4.07Å; M302-M306 WeakPolarHBondContact O-CG 3.36Å; M302-M306 PolarHBondContact O-N 2.94Å; M302-M306 HydrophobicContact SD-CG 4.47Å; M302-L316 HydrophobicContact CG-CD2 4.11Å; M302-L316 HydrophobicContact CG-CG 4.32Å; M302-L316 HydrophobicContact SD-CD2 4.15Å
303	T	97.7	Very high	95.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.9	-46	175.1	-57.5	0	0	0	0	111.2	A299 Q300 H301 I305 M306 A307 L317 Y343	A299-T303 PolarHBondContact O-N 3.16Å; A299-T303 PolarHBondContact O-OG1 3.47Å; Q300-T303 WeakPolarHBondContact O-CB 3.48Å; Q300-T303 PolarHBondContact O-N 3.49Å; H301-T303 VanDerWaalsContact C-N 3.35Å; T303-I305 PolarHBondContact O-N 3.24Å; T303-M306 PolarHBondContact O-N 3.01Å; T303-A307 PolarHBondContact O-N 3.41Å; T303-A307 VanDerWaalsContact O-N 3.1Å; T303-L317 HydrophobicContact CG2-CD2 4.46Å; T303-Y343 HydrophobicContact CG2-CD1 3.96Å; T303-Y343 HydrophobicContact CG2-CE1 3.54Å
304	F	97.3	Very high	95.5	Very high	47 Å²	47	33.4 Å²	33.4	21%	0.206	19%	0.186	C	C	.	.	H	α-helix	trans	-64.8	-39.2	177.4	-55.7	-28.4	0	0	0	112.8	Q300 H301 M302 A308 I335 N338 I339 S342	Q300-F304 HydrophobicContact CB-CE2 4.2Å; Q300-F304 HydrophobicContact CB-CZ 4.37Å; Q300-F304 VanDerWaalsContact O-CD2 3.29Å; Q300-F304 WeakPolarHBondContact O-CD2 3.37Å; Q300-F304 VanDerWaalsContact O-CG 3.23Å; Q300-F304 WeakPolarHBondContact O-CG 3.4Å; Q300-F304 PolarHBondContact O-N 3.41Å; H301-F304 PolarHBondContact O-N 2.86Å; M302-F304 VanDerWaalsContact C-N 3.33Å; M302-F304 PolarHBondContact O-N 3.47Å; F304-A308 VanDerWaalsContact O-CB 3.31Å; F304-A308 WeakPolarHBondContact O-CB 3.48Å; F304-A308 PolarHBondContact O-N 3.44Å; F304-I335 HydrophobicContact CZ-CG2 4.14Å; F304-N338 HydrophobicContact CE1-CB 3.88Å; F304-N338 HydrophobicContact CZ-CB 4.11Å; F304-I339 HydrophobicContact CE1-CG1 3.76Å; F304-I339 HydrophobicContact CZ-CG1 3.94Å; F304-S342 WeakPolarHBondContact CD1-OG 3.39Å
305	I	95.9	Very high	95.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-50.8	175.8	-72.6	163.3	0	0	0	110.1	Q265 M268 R269 H301 M302 T303 A307 A308 V309	Q265-I305 HydrophobicContact CB-CD1 3.47Å; Q265-I305 VanDerWaalsContact CB-CD1 3.47Å; Q265-I305 HydrophobicContact CG-CD1 3.84Å; Q265-I305 WeakPolarHBondContact O-CD1 3.3Å; M268-I305 HydrophobicContact CB-CG2 4.03Å; R269-I305 HydrophobicContact CB-CG1 4.24Å; R269-I305 HydrophobicContact CB-CG2 4.17Å; H301-I305 VanDerWaalsContact CE1-CD1 3.42Å; H301-I305 WeakPolarHBondContact CE1-CD1 3.28Å; H301-I305 VanDerWaalsContact ND1-CD1 3.34Å; H301-I305 WeakPolarHBondContact ND1-CD1 3.31Å; H301-I305 VanDerWaalsContact O-CG1 3.3Å; H301-I305 WeakPolarHBondContact O-CG1 3.44Å; H301-I305 PolarHBondContact O-N 3.07Å; M302-I305 PolarHBondContact O-N 3.26Å; T303-I305 PolarHBondContact O-N 3.24Å; I305-A307 VanDerWaalsContact C-N 3.27Å; I305-A307 PolarHBondContact O-N 3.18Å; I305-A308 PolarHBondContact O-N 3.3Å; I305-A308 VanDerWaalsContact O-N 3.14Å; I305-V309 HydrophobicContact CG2-CG2 4.35Å; I305-V309 WeakPolarHBondContact O-CG2 3.13Å; I305-V309 PolarHBondContact O-N 2.85Å
306	M	96.3	Very high	95.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-55.5	-45.5	-179.2	-74.6	-172.9	-65.6	0	0	111.1	M302 T303 V309 G310 F311 L316 L317 L346	M302-M306 HydrophobicContact CG-CE 4.07Å; M302-M306 WeakPolarHBondContact O-CG 3.36Å; M302-M306 PolarHBondContact O-N 2.94Å; M302-M306 HydrophobicContact SD-CG 4.47Å; T303-M306 PolarHBondContact O-N 3.01Å; M306-V309 PolarHBondContact O-N 3.19Å; M306-G310 WeakPolarHBondContact O-CA 3.22Å; M306-G310 PolarHBondContact O-N 3.29Å; M306-F311 HydrophobicContact CB-CB 4.34Å; M306-F311 WeakPolarHBondContact CB-O 3.42Å; M306-F311 HydrophobicContact CG-CB 4.28Å; M306-F311 HydrophobicContact CG-CD1 4.22Å; M306-F311 PolarHBondContact O-N 3.28Å; M306-F311 HydrophobicContact SD-CD1 4.41Å; M306-L316 HydrophobicContact CE-CG 4.38Å; M306-L316 HydrophobicContact SD-CB 4.27Å; M306-L316 HydrophobicContact SD-CD2 3.72Å; M306-L316 HydrophobicContact SD-CG 3.97Å; M306-L317 HydrophobicContact CE-CD2 3.39Å; M306-L317 HydrophobicContact CE-CG 3.64Å; M306-L317 HydrophobicContact SD-CD2 4.39Å; M306-L317 HydrophobicContact SD-CG 4.1Å; M306-L346 HydrophobicContact CB-CD1 3.84Å; M306-L346 HydrophobicContact CB-CD2 4.26Å
307	A	96.5	Very high	95.7	Very high	13 Å²	13	32.4 Å²	32.4	11%	0.107	18%	0.181	C	C	.	.	H	α-helix	trans	-61.8	-49.9	176.2	0	0	0	0	0	111.9	T303 I305 V309 G310 E345 L346	T303-A307 PolarHBondContact O-N 3.41Å; T303-A307 VanDerWaalsContact O-N 3.1Å; I305-A307 VanDerWaalsContact C-N 3.27Å; I305-A307 PolarHBondContact O-N 3.18Å; A307-V309 VanDerWaalsContact C-N 3.26Å; A307-V309 PolarHBondContact O-N 2.98Å; A307-G310 PolarHBondContact O-N 2.83Å; A307-G310 VanDerWaalsContact O-N 3.13Å; A307-E345 HydrophobicContact CB-CB 4.42Å; A307-L346 HydrophobicContact CB-CD1 4.08Å; A307-L346 HydrophobicContact CB-CG 4.08Å
308	A	93.9	Very high	95.8	Very high	53 Å²	53	31.7 Å²	31.7	44%	0.438	17%	0.17	S	C	.	.	H	α-helix	trans	-62.1	-28.4	-177.9	0	0	0	0	0	114.7	R273 F304 I305	R273-A308 PolarHBondContact NH2-O 2.97Å; F304-A308 VanDerWaalsContact O-CB 3.31Å; F304-A308 WeakPolarHBondContact O-CB 3.48Å; F304-A308 PolarHBondContact O-N 3.44Å; I305-A308 PolarHBondContact O-N 3.3Å; I305-A308 VanDerWaalsContact O-N 3.14Å
309	V	93.1	Very high	95.8	Very high	11 Å²	11	32.1 Å²	32.1	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-102.7	-1.5	178.3	-59.6	0	0	0	0	113.9	R269 R273 I305 M306 A307 F311	R269-V309 WeakPolarHBondContact O-CG1 3.48Å; R273-V309 HydrophobicContact CB-CB 4.37Å; R273-V309 HydrophobicContact CB-CG1 4.41Å; I305-V309 HydrophobicContact CG2-CG2 4.35Å; I305-V309 WeakPolarHBondContact O-CG2 3.13Å; I305-V309 PolarHBondContact O-N 2.85Å; M306-V309 PolarHBondContact O-N 3.19Å; A307-V309 VanDerWaalsContact C-N 3.26Å; A307-V309 PolarHBondContact O-N 2.98Å; V309-F311 VanDerWaalsContact C-N 3.32Å; V309-F311 HydrophobicContact CG2-CB 3.59Å
310	G	92.4	Very high	95.9	Very high	28 Å²	28	32.1 Å²	32.1	29%	0.289	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	34.6	-176.1	0	0	0	0	0	113.4	M306 A307 H312	M306-G310 WeakPolarHBondContact O-CA 3.22Å; M306-G310 PolarHBondContact O-N 3.29Å; A307-G310 PolarHBondContact O-N 2.83Å; A307-G310 VanDerWaalsContact O-N 3.13Å; G310-H312 PolarHBondContact O-CE1 2.94Å; G310-H312 PolarHBondContact O-N 3.33Å; G310-H312 PolarHBondContact O-ND1 2.94Å
311	F	92.8	Very high	95.9	Very high	6 Å²	6	31 Å²	31	3%	0.026	17%	0.168	C	C	.	.			trans	-88.7	104.4	-179.5	-167.7	-73.7	0	0	0	110.2	M268 R280 L283 E284 M306 V309 S313 L346	M268-F311 HydrophobicContact CE-CD1 4.41Å; M268-F311 HydrophobicContact CE-CD2 4.34Å; M268-F311 HydrophobicContact CE-CE1 4.19Å; M268-F311 HydrophobicContact CE-CE2 4.12Å; M268-F311 HydrophobicContact CE-CG 4.49Å; M268-F311 HydrophobicContact CE-CZ 4.04Å; R280-F311 HydrophobicContact CB-CE2 3.89Å; R280-F311 HydrophobicContact CB-CZ 4.4Å; R280-F311 HydrophobicContact CG-CD2 4.26Å; R280-F311 HydrophobicContact CG-CE2 3.95Å; R280-F311 WeakPolarHBondContact O-CZ 3.43Å; L283-F311 HydrophobicContact CB-CE2 4.33Å; L283-F311 HydrophobicContact CB-CZ 4.48Å; E284-F311 HydrophobicContact CB-CE1 4.23Å; E284-F311 HydrophobicContact CB-CZ 3.94Å; M306-F311 HydrophobicContact CB-CB 4.34Å; M306-F311 WeakPolarHBondContact CB-O 3.42Å; M306-F311 HydrophobicContact CG-CB 4.28Å; M306-F311 HydrophobicContact CG-CD1 4.22Å; M306-F311 PolarHBondContact O-N 3.28Å; M306-F311 HydrophobicContact SD-CD1 4.41Å; V309-F311 VanDerWaalsContact C-N 3.32Å; V309-F311 HydrophobicContact CG2-CB 3.59Å; F311-S313 PolarHBondContact O-N 3.15Å; F311-L346 WeakPolarHBondContact O-CD2 3.29Å
312	H	91.8	Very high	95.9	Very high	116 Å²	116	31 Å²	31	54%	0.537	17%	0.17	S	C	.	.			trans	-97.6	88.8	-174.8	-63.6	76.5	0	0	0	110.9	G310 L346	G310-H312 PolarHBondContact O-CE1 2.94Å; G310-H312 PolarHBondContact O-N 3.33Å; G310-H312 PolarHBondContact O-ND1 2.94Å; H312-L346 PolarHBondContact CD2-O 3.04Å; H312-L346 VanDerWaalsContact CD2-O 3.29Å
313	S	94.6	Very high	95.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.014	18%	0.183	C	C	.	.			trans	-117.3	107.7	172.4	167.1	0	0	0	0	110.6	E284 F311 L316 L317	E284-S313 VanDerWaalsContact CD-OG 3.23Å; E284-S313 WeakPolarHBondContact OE1-CB 3.3Å; E284-S313 PolarHBondContact OE1-OG 3.07Å; F311-S313 PolarHBondContact O-N 3.15Å; S313-L316 VanDerWaalsContact OG-CB 3.3Å; S313-L316 WeakPolarHBondContact OG-CB 3.33Å; S313-L316 PolarHBondContact OG-N 2.96Å; S313-L317 VanDerWaalsContact O-CB 3.29Å; S313-L317 WeakPolarHBondContact O-CB 3.47Å; S313-L317 WeakPolarHBondContact O-CD1 3.31Å; S313-L317 VanDerWaalsContact O-CG 3.27Å; S313-L317 WeakPolarHBondContact O-CG 3.28Å; S313-L317 PolarHBondContact O-N 3.26Å
314	K	95.3	Very high	95.8	Very high	164 Å²	164	34.1 Å²	34.1	71%	0.713	18%	0.183	S	C	*	.	H	α-helix	trans	-62.2	-43.8	177	-65.6	-175.7	179	-177.7	0	112.8	L316 L317 K318	K314-L316 PolarHBondContact O-N 3.38Å; K314-L317 PolarHBondContact O-N 2.81Å; K314-K318 WeakPolarHBondContact O-CB 3.33Å; K314-K318 PolarHBondContact O-N 3.17Å
315	P	96.9	Very high	95.8	Very high	65 Å²	65	34.9 Å²	34.9	42%	0.422	19%	0.186	S	C	.	.	H	α-helix	trans	-61.8	-44.2	178.8	-23.9	34.9	0	0	0	112.8	L288 K318 V319	L288-P315 HydrophobicContact CD1-CB 4.09Å; L288-P315 HydrophobicContact CD2-CB 4.03Å; P315-K318 WeakPolarHBondContact O-CB 3.42Å; P315-K318 PolarHBondContact O-N 3.31Å; P315-V319 PolarHBondContact O-N 2.84Å; P315-V319 VanDerWaalsContact O-N 3.11Å
316	L	96.8	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.4	-37.8	180	-174.3	58.6	0	0	0	111.7	M268 A287 L288 F294 M302 M306 S313 K314 K318 V319 C320	M268-L316 HydrophobicContact CE-CD2 4.26Å; A287-L316 HydrophobicContact CB-CD1 3.84Å; A287-L316 HydrophobicContact CB-CD2 3.68Å; A287-L316 HydrophobicContact CB-CG 4.43Å; L288-L316 HydrophobicContact CD2-CB 4.26Å; L288-L316 HydrophobicContact CD2-CD1 4.3Å; F294-L316 HydrophobicContact CE2-CD1 3.93Å; F294-L316 HydrophobicContact CZ-CD1 4.18Å; M302-L316 HydrophobicContact CG-CD2 4.11Å; M302-L316 HydrophobicContact CG-CG 4.32Å; M302-L316 HydrophobicContact SD-CD2 4.15Å; M306-L316 HydrophobicContact CE-CG 4.38Å; M306-L316 HydrophobicContact SD-CB 4.27Å; M306-L316 HydrophobicContact SD-CD2 3.72Å; M306-L316 HydrophobicContact SD-CG 3.97Å; S313-L316 VanDerWaalsContact OG-CB 3.3Å; S313-L316 WeakPolarHBondContact OG-CB 3.33Å; S313-L316 PolarHBondContact OG-N 2.96Å; K314-L316 PolarHBondContact O-N 3.38Å; L316-K318 VanDerWaalsContact C-N 3.29Å; L316-K318 PolarHBondContact O-N 3.07Å; L316-V319 PolarHBondContact O-N 3.41Å; L316-C320 PolarHBondContact O-N 3.19Å; L316-C320 PolarHBondContact O-SG 3.05Å
317	L	97.5	Very high	95.7	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-37.4	172.1	-80	163.2	0	0	0	112.1	T303 M306 S313 K314 C320 S321 Y343 L346 Y348	T303-L317 HydrophobicContact CG2-CD2 4.46Å; M306-L317 HydrophobicContact CE-CD2 3.39Å; M306-L317 HydrophobicContact CE-CG 3.64Å; M306-L317 HydrophobicContact SD-CD2 4.39Å; M306-L317 HydrophobicContact SD-CG 4.1Å; S313-L317 VanDerWaalsContact O-CB 3.29Å; S313-L317 WeakPolarHBondContact O-CB 3.47Å; S313-L317 WeakPolarHBondContact O-CD1 3.31Å; S313-L317 VanDerWaalsContact O-CG 3.27Å; S313-L317 WeakPolarHBondContact O-CG 3.28Å; S313-L317 PolarHBondContact O-N 3.26Å; K314-L317 PolarHBondContact O-N 2.81Å; L317-C320 PolarHBondContact O-N 3.21Å; L317-S321 VanDerWaalsContact O-CB 3.25Å; L317-S321 WeakPolarHBondContact O-CB 3.26Å; L317-S321 PolarHBondContact O-N 3.47Å; L317-S321 PolarHBondContact O-OG 3.44Å; L317-Y343 HydrophobicContact CD2-CD1 4.12Å; L317-Y343 HydrophobicContact CD2-CE1 3.9Å; L317-L346 HydrophobicContact CD1-CB 4.26Å; L317-L346 HydrophobicContact CD1-CD1 4.13Å; L317-L346 HydrophobicContact CD2-CD1 3.72Å; L317-L346 HydrophobicContact CG-CD1 4.45Å; L317-Y348 HydrophobicContact CB-CD1 4.25Å; L317-Y348 HydrophobicContact CB-CD2 3.72Å; L317-Y348 HydrophobicContact CB-CE1 4.19Å; L317-Y348 HydrophobicContact CB-CE2 3.67Å; L317-Y348 HydrophobicContact CB-CG 4.02Å; L317-Y348 HydrophobicContact CD1-CD2 3.79Å; L317-Y348 HydrophobicContact CD1-CG 3.84Å; L317-Y348 HydrophobicContact CD2-CD1 4.43Å; L317-Y348 HydrophobicContact CD2-CG 4.38Å; L317-Y348 HydrophobicContact CG-CD2 4.32Å; L317-Y348 HydrophobicContact CG-CG 4.32Å
318	K	97.5	Very high	95.7	Very high	65 Å²	65	42.5 Å²	42.5	28%	0.283	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-51	175.2	-174.6	54.2	174.2	168.4	0	111.2	K314 P315 L316 C320 S321 D322 Y348 D350	K314-K318 WeakPolarHBondContact O-CB 3.33Å; K314-K318 PolarHBondContact O-N 3.17Å; P315-K318 WeakPolarHBondContact O-CB 3.42Å; P315-K318 PolarHBondContact O-N 3.31Å; L316-K318 VanDerWaalsContact C-N 3.29Å; L316-K318 PolarHBondContact O-N 3.07Å; K318-C320 VanDerWaalsContact C-N 3.31Å; K318-C320 PolarHBondContact O-N 2.86Å; K318-S321 WeakPolarHBondContact CA-OG 3.46Å; K318-S321 PolarHBondContact O-N 3.08Å; K318-S321 VanDerWaalsContact O-N 3.1Å; K318-S321 PolarHBondContact O-OG 3.42Å; K318-D322 WeakPolarHBondContact CD-OD2 3.33Å; K318-D322 WeakPolarHBondContact CE-OD1 3.46Å; K318-D322 VanDerWaalsContact CE-OD2 3.28Å; K318-D322 WeakPolarHBondContact CE-OD2 3.42Å; K318-D322 IonicContact NZ-OD1 3.66Å; K318-D322 PolarHBondContact NZ-OD1 2.85Å; K318-D322 IonicContact NZ-OD2 2.75Å; K318-D322 PolarHBondContact O-N 2.88Å; K318-Y348 WeakPolarHBondContact CA-OH 3.37Å; K318-D350 IonicContact NZ-OD1 3.91Å; K318-D350 IonicContact NZ-OD2 2.73Å; K318-D350 PolarHBondContact NZ-OD2 2.94Å
319	V	97.5	Very high	95.7	Very high	35 Å²	35	45.7 Å²	45.7	21%	0.212	23%	0.227	C	C	.	.	H	α-helix	trans	-52.8	-48.8	173.8	170.8	0	0	0	0	111.6	L288 F294 P315 L316 S321 K323	L288-V319 HydrophobicContact CD2-CG2 4.22Å; F294-V319 HydrophobicContact CD2-CG1 4.37Å; P315-V319 PolarHBondContact O-N 2.84Å; P315-V319 VanDerWaalsContact O-N 3.11Å; L316-V319 PolarHBondContact O-N 3.41Å; V319-S321 PolarHBondContact O-N 2.91Å; V319-K323 PolarHBondContact O-N 2.93Å
320	C	97.8	Very high	95.7	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-41.9	179.7	-63.8	0	0	0	0	111.6	A299 L316 L317 K318 K323 I324	A299-C320 HydrophobicContact CB-CB 4.18Å; L316-C320 PolarHBondContact O-N 3.19Å; L316-C320 PolarHBondContact O-SG 3.05Å; L317-C320 PolarHBondContact O-N 3.21Å; K318-C320 VanDerWaalsContact C-N 3.31Å; K318-C320 PolarHBondContact O-N 2.86Å; C320-K323 PolarHBondContact O-N 3.36Å; C320-I324 WeakPolarHBondContact O-CB 3.26Å; C320-I324 WeakPolarHBondContact O-CD1 3.31Å; C320-I324 VanDerWaalsContact O-CG1 3.24Å; C320-I324 WeakPolarHBondContact O-CG1 3.46Å; C320-I324 PolarHBondContact O-N 3.45Å
321	S	97.3	Very high	95.8	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-39.3	-179.3	71.5	0	0	0	0	112.6	L317 K318 V319 I324 K325 Y348	L317-S321 VanDerWaalsContact O-CB 3.25Å; L317-S321 WeakPolarHBondContact O-CB 3.26Å; L317-S321 PolarHBondContact O-N 3.47Å; L317-S321 PolarHBondContact O-OG 3.44Å; K318-S321 WeakPolarHBondContact CA-OG 3.46Å; K318-S321 PolarHBondContact O-N 3.08Å; K318-S321 VanDerWaalsContact O-N 3.1Å; K318-S321 PolarHBondContact O-OG 3.42Å; V319-S321 PolarHBondContact O-N 2.91Å; S321-I324 PolarHBondContact O-N 3.34Å; S321-K325 VanDerWaalsContact O-CB 3.24Å; S321-K325 WeakPolarHBondContact O-CB 3.41Å; S321-K325 PolarHBondContact O-N 3.36Å; S321-Y348 PolarHBondContact OG-OH 2.75Å
322	D	97	Very high	95.9	Very high	44 Å²	44	53 Å²	53	24%	0.235	26%	0.259	C	S	.	.	H	α-helix	trans	-67.3	-42.3	179.2	-68.4	-35.4	0	0	0	110.1	K318 I324 K325 E326	K318-D322 WeakPolarHBondContact CD-OD2 3.33Å; K318-D322 WeakPolarHBondContact CE-OD1 3.46Å; K318-D322 VanDerWaalsContact CE-OD2 3.28Å; K318-D322 WeakPolarHBondContact CE-OD2 3.42Å; K318-D322 IonicContact NZ-OD1 3.66Å; K318-D322 PolarHBondContact NZ-OD1 2.85Å; K318-D322 IonicContact NZ-OD2 2.75Å; K318-D322 PolarHBondContact O-N 2.88Å; D322-I324 PolarHBondContact O-N 2.72Å; D322-K325 PolarHBondContact O-N 3.44Å; D322-K325 IonicContact OD1-NZ 3.15Å; D322-K325 PolarHBondContact OD1-NZ 3.4Å; D322-E326 VanDerWaalsContact O-CG 3.31Å; D322-E326 WeakPolarHBondContact O-CG 3.42Å; D322-E326 PolarHBondContact O-N 3.13Å
323	K	96.4	Very high	96.1	Very high	65 Å²	65	49 Å²	49	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-61	-40	172.1	-71.2	-63.8	-178.2	-166.2	0	113.4	A299 V319 C320 E326 N327	A299-K323 HydrophobicContact CB-CB 3.88Å; V319-K323 PolarHBondContact O-N 2.93Å; C320-K323 PolarHBondContact O-N 3.36Å; K323-E326 IonicContact NZ-OE2 3.36Å; K323-N327 PolarHBondContact O-ND2 3.03Å
324	I	97.1	Very high	96.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.8	-45.1	177	-74.3	162.1	0	0	0	110.3	L296 A299 Q300 C320 S321 D322 E326 N327 L328 I331 I339 Y343 L353	L296-I324 HydrophobicContact CD1-CG1 4.23Å; A299-I324 HydrophobicContact CB-CG1 4.42Å; Q300-I324 HydrophobicContact CG-CG1 4.31Å; C320-I324 WeakPolarHBondContact O-CB 3.26Å; C320-I324 WeakPolarHBondContact O-CD1 3.31Å; C320-I324 VanDerWaalsContact O-CG1 3.24Å; C320-I324 WeakPolarHBondContact O-CG1 3.46Å; C320-I324 PolarHBondContact O-N 3.45Å; S321-I324 PolarHBondContact O-N 3.34Å; D322-I324 PolarHBondContact O-N 2.72Å; I324-E326 PolarHBondContact O-N 3.1Å; I324-N327 CarbonylContact O-C 3.49Å; I324-N327 PolarHBondContact O-N 2.9Å; I324-N327 VanDerWaalsContact O-N 3.16Å; I324-L328 HydrophobicContact CG2-CD2 4.09Å; I324-L328 PolarHBondContact O-N 3.34Å; I324-L328 VanDerWaalsContact O-N 3.16Å; I324-I331 HydrophobicContact CG2-CD1 3.79Å; I324-I339 HydrophobicContact CD1-CD1 4.03Å; I324-I339 HydrophobicContact CD1-CG1 4.4Å; I324-I339 HydrophobicContact CD1-CG2 4.12Å; I324-I339 HydrophobicContact CG1-CD1 4.3Å; I324-I339 HydrophobicContact CG2-CD1 4.13Å; I324-I339 HydrophobicContact CG2-CG2 4.47Å; I324-Y343 WeakPolarHBondContact CD1-OH 3.27Å; I324-L353 HydrophobicContact CG2-CD1 4.45Å
325	K	96.9	Very high	96.3	Very high	62 Å²	62	44.5 Å²	44.5	27%	0.27	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-45.1	179.3	-172.6	-179.7	71.6	-164.8	0	112	S321 D322 N327 L328 L353	S321-K325 VanDerWaalsContact O-CB 3.24Å; S321-K325 WeakPolarHBondContact O-CB 3.41Å; S321-K325 PolarHBondContact O-N 3.36Å; D322-K325 PolarHBondContact O-N 3.44Å; D322-K325 IonicContact OD1-NZ 3.15Å; D322-K325 PolarHBondContact OD1-NZ 3.4Å; K325-N327 PolarHBondContact O-N 3.24Å; K325-L328 WeakPolarHBondContact O-CG 3.25Å; K325-L353 HydrophobicContact CB-CD1 3.9Å; K325-L353 HydrophobicContact CG-CD1 4.45Å
326	E	95.3	Very high	96.3	Very high	117 Å²	117	41.4 Å²	41.4	55%	0.547	20%	0.203	S	C	.	.	H	α-helix	trans	-60.5	-24.8	177.8	-74.3	168	-173.5	0	0	113.3	D322 K323 I324	D322-E326 VanDerWaalsContact O-CG 3.31Å; D322-E326 WeakPolarHBondContact O-CG 3.42Å; D322-E326 PolarHBondContact O-N 3.13Å; K323-E326 IonicContact NZ-OE2 3.36Å; I324-E326 PolarHBondContact O-N 3.1Å
327	N	95.8	Very high	96.3	Very high	46 Å²	46	43.7 Å²	43.7	25%	0.246	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	21.8	-170.5	-62	-89.6	0	0	0	113.7	L296 K323 I324 K325 H329 H330 I331	L296-N327 HydrophobicContact CD1-CB 4.01Å; L296-N327 HydrophobicContact CD2-CB 3.68Å; L296-N327 HydrophobicContact CG-CB 4.28Å; K323-N327 PolarHBondContact O-ND2 3.03Å; I324-N327 CarbonylContact O-C 3.49Å; I324-N327 PolarHBondContact O-N 2.9Å; I324-N327 VanDerWaalsContact O-N 3.16Å; K325-N327 PolarHBondContact O-N 3.24Å; N327-H329 PolarHBondContact O-N 3Å; N327-H329 VanDerWaalsContact O-N 3.14Å; N327-H330 PolarHBondContact O-N 2.87Å; N327-I331 WeakPolarHBondContact O-CG1 3.31Å
328	L	95.6	Very high	96.3	Very high	10 Å²	10	47.1 Å²	47.1	5%	0.052	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-52.3	-40	-174	-74.5	172.9	0	0	0	113.7	I324 K325 H330 I331 L336 I357 H360	I324-L328 HydrophobicContact CG2-CD2 4.09Å; I324-L328 PolarHBondContact O-N 3.34Å; I324-L328 VanDerWaalsContact O-N 3.16Å; K325-L328 WeakPolarHBondContact O-CG 3.25Å; L328-H330 PolarHBondContact O-N 2.96Å; L328-H330 VanDerWaalsContact O-N 3.13Å; L328-I331 HydrophobicContact CD2-CD1 4.27Å; L328-I331 WeakPolarHBondContact O-CB 3.43Å; L328-I331 PolarHBondContact O-N 2.99Å; L328-L336 HydrophobicContact CD2-CD1 3.99Å; L328-I357 HydrophobicContact CD1-CG1 4.23Å; L328-I357 HydrophobicContact CD2-CG1 3.81Å; L328-H360 HydrophobicContact CB-CB 4.39Å; L328-H360 HydrophobicContact CD1-CB 4.23Å
329	H	93.5	Very high	96.3	Very high	120 Å²	120	44 Å²	44	56%	0.556	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-63.2	-16.6	-179.5	61.1	-80.6	0	0	0	114.6	N327	N327-H329 PolarHBondContact O-N 3Å; N327-H329 VanDerWaalsContact O-N 3.14Å
330	H	93.1	Very high	96.3	Very high	123 Å²	123	42.3 Å²	42.3	57%	0.569	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-97.1	1.7	175.9	-63.3	-44.9	0	0	0	113.3	L296 N327 L328	L296-H330 HydrophobicContact CD2-CB 4.33Å; N327-H330 PolarHBondContact O-N 2.87Å; L328-H330 PolarHBondContact O-N 2.96Å; L328-H330 VanDerWaalsContact O-N 3.13Å
331	I	95.8	Very high	96.3	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	22%	0.217	C	C	.	.			trans	-99.5	116.8	-173.7	-51.6	-177.1	0	0	0	109.9	L296 I324 N327 L328 I335 L336 I339	L296-I331 HydrophobicContact CD1-CD1 4.04Å; L296-I331 HydrophobicContact CD1-CG1 4.4Å; L296-I331 HydrophobicContact CD2-CG1 4.26Å; I324-I331 HydrophobicContact CG2-CD1 3.79Å; N327-I331 WeakPolarHBondContact O-CG1 3.31Å; L328-I331 HydrophobicContact CD2-CD1 4.27Å; L328-I331 WeakPolarHBondContact O-CB 3.43Å; L328-I331 PolarHBondContact O-N 2.99Å; I331-I335 HydrophobicContact CG2-CB 3.79Å; I331-I335 HydrophobicContact CG2-CG2 3.66Å; I331-L336 HydrophobicContact CG2-CB 3.8Å; I331-I339 HydrophobicContact CD1-CD1 4.29Å; I331-I339 HydrophobicContact CG2-CD1 4.32Å
332	P	95	Very high	96.3	Very high	69 Å²	69	44.9 Å²	44.9	45%	0.448	22%	0.22	S	C	.	.			trans	-71.2	155.9	176.5	31.1	-35.8	0	0	0	111.1	N334 I335 L336	P332-N334 VanDerWaalsContact C-N 3.31Å; P332-N334 WeakPolarHBondContact CB-OD1 3.38Å; P332-N334 PolarHBondContact O-N 2.77Å; P332-N334 VanDerWaalsContact O-N 3.12Å; P332-I335 HydrophobicContact CG-CB 4.2Å; P332-I335 HydrophobicContact CG-CG1 3.82Å; P332-I335 PolarHBondContact O-N 3.21Å; P332-L336 PolarHBondContact O-N 2.82Å
333	F	96.1	Very high	96.4	Very high	32 Å²	32	42.9 Å²	42.9	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-42.8	-52.3	-176.1	172.6	-102	0	0	0	114.3	I335 L336 Y337 W368 Q372 F375 F376	F333-I335 VanDerWaalsContact C-N 3.26Å; F333-I335 PolarHBondContact O-N 3.46Å; F333-L336 PolarHBondContact O-N 3.01Å; F333-Y337 HydrophobicContact CZ-CD2 4.36Å; F333-Y337 HydrophobicContact CZ-CG 4.15Å; F333-Y337 VanDerWaalsContact O-CB 3.28Å; F333-Y337 WeakPolarHBondContact O-CB 3.49Å; F333-Y337 PolarHBondContact O-N 3.4Å; F333-W368 HydrophobicContact CB-CE3 4.28Å; F333-W368 HydrophobicContact CB-CH2 4.48Å; F333-W368 HydrophobicContact CB-CZ3 3.67Å; F333-W368 HydrophobicContact CD2-CE3 4.4Å; F333-W368 HydrophobicContact CD2-CZ3 4.41Å; F333-Q372 HydrophobicContact CD1-CG 3.81Å; F333-Q372 HydrophobicContact CD2-CB 3.66Å; F333-Q372 HydrophobicContact CD2-CG 3.59Å; F333-Q372 HydrophobicContact CE1-CG 3.87Å; F333-Q372 HydrophobicContact CE2-CB 3.53Å; F333-Q372 HydrophobicContact CE2-CG 3.67Å; F333-Q372 HydrophobicContact CG-CB 4.29Å; F333-Q372 HydrophobicContact CG-CG 3.7Å; F333-Q372 HydrophobicContact CZ-CB 4.05Å; F333-Q372 HydrophobicContact CZ-CG 3.83Å; F333-F375 HydrophobicContact CE1-CD2 4.21Å; F333-F375 HydrophobicContact CE2-CB 4.38Å; F333-F375 HydrophobicContact CZ-CB 3.87Å; F333-F375 AromaticContact CZ-CD2 3.77Å; F333-F375 HydrophobicContact CZ-CD2 3.77Å; F333-F375 HydrophobicContact CZ-CG 4.34Å; F333-F376 HydrophobicContact CD2-CD2 4.38Å; F333-F376 HydrophobicContact CD2-CE1 4.19Å; F333-F376 AromaticContact CD2-CE2 3.54Å; F333-F376 HydrophobicContact CD2-CE2 3.54Å; F333-F376 AromaticContact CD2-CZ 3.42Å; F333-F376 HydrophobicContact CD2-CZ 3.42Å; F333-F376 VanDerWaalsContact CD2-CZ 3.42Å; F333-F376 HydrophobicContact CE2-CD1 4.5Å; F333-F376 HydrophobicContact CE2-CD2 4.1Å; F333-F376 HydrophobicContact CE2-CE1 4.1Å; F333-F376 AromaticContact CE2-CE2 3.7Å; F333-F376 HydrophobicContact CE2-CE2 3.7Å; F333-F376 HydrophobicContact CE2-CG 4.49Å; F333-F376 AromaticContact CE2-CZ 3.7Å; F333-F376 HydrophobicContact CE2-CZ 3.7Å
334	N	95.8	Very high	96.3	Very high	49 Å²	49	43.5 Å²	43.5	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-62	-35	-174.3	59.1	-61.3	0	0	0	112.3	L83 P332 N338	L83-N334 HydrophobicContact CD1-CB 4.37Å; L83-N334 WeakPolarHBondContact CD1-ND2 3.29Å; L83-N334 WeakPolarHBondContact CD2-ND2 3.39Å; P332-N334 VanDerWaalsContact C-N 3.31Å; P332-N334 WeakPolarHBondContact CB-OD1 3.38Å; P332-N334 PolarHBondContact O-N 2.77Å; P332-N334 VanDerWaalsContact O-N 3.12Å; N334-N338 WeakPolarHBondContact O-CB 3.49Å; N334-N338 PolarHBondContact O-N 3.39Å; N334-N338 PolarHBondContact O-ND2 3.25Å; N334-N338 VanDerWaalsContact O-ND2 3.08Å
335	I	97	Very high	96.3	Very high	24 Å²	24	49.5 Å²	49.5	12%	0.123	24%	0.24	C	C	.	.	H	α-helix	trans	-76.7	-47.3	177.6	-61.1	-57.8	0	0	0	109.3	L83 Q300 F304 I331 P332 F333 Y337 N338 I339	L83-I335 HydrophobicContact CD2-CD1 3.97Å; Q300-I335 HydrophobicContact CG-CG2 4.21Å; F304-I335 HydrophobicContact CZ-CG2 4.14Å; I331-I335 HydrophobicContact CG2-CB 3.79Å; I331-I335 HydrophobicContact CG2-CG2 3.66Å; P332-I335 HydrophobicContact CG-CB 4.2Å; P332-I335 HydrophobicContact CG-CG1 3.82Å; P332-I335 PolarHBondContact O-N 3.21Å; F333-I335 VanDerWaalsContact C-N 3.26Å; F333-I335 PolarHBondContact O-N 3.46Å; I335-Y337 PolarHBondContact O-N 3.05Å; I335-N338 PolarHBondContact O-N 3.3Å; I335-N338 VanDerWaalsContact O-N 3.16Å; I335-I339 HydrophobicContact CG2-CD1 3.98Å; I335-I339 HydrophobicContact CG2-CG1 4.46Å; I335-I339 VanDerWaalsContact O-CG1 3.3Å; I335-I339 WeakPolarHBondContact O-CG1 3.44Å; I335-I339 PolarHBondContact O-N 3.09Å
336	L	97.5	Very high	96.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-44.7	179.9	-173.9	56.5	0	0	0	112.2	L328 I331 P332 F333 N338 I339 M340 I357 V361 F376	L328-L336 HydrophobicContact CD2-CD1 3.99Å; I331-L336 HydrophobicContact CG2-CB 3.8Å; P332-L336 PolarHBondContact O-N 2.82Å; F333-L336 PolarHBondContact O-N 3.01Å; L336-N338 PolarHBondContact O-N 3Å; L336-I339 WeakPolarHBondContact O-CB 3.28Å; L336-I339 PolarHBondContact O-N 3.26Å; L336-M340 WeakPolarHBondContact O-CG 3.33Å; L336-M340 PolarHBondContact O-N 3.04Å; L336-M340 VanDerWaalsContact O-N 3.08Å; L336-I357 HydrophobicContact CD1-CD1 4.25Å; L336-I357 HydrophobicContact CD1-CG1 4.24Å; L336-I357 HydrophobicContact CD1-CG2 4.36Å; L336-I357 HydrophobicContact CD2-CG2 4.31Å; L336-V361 HydrophobicContact CD2-CG2 4.46Å; L336-F376 HydrophobicContact CB-CE1 4.39Å; L336-F376 HydrophobicContact CD2-CE1 3.85Å; L336-F376 HydrophobicContact CD2-CZ 3.9Å; L336-F376 HydrophobicContact CG-CE1 3.94Å; L336-F376 HydrophobicContact CG-CZ 4.38Å
337	Y	97.3	Very high	96.2	Very high	48 Å²	48	47.9 Å²	47.9	19%	0.188	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-43.5	175.1	-179.2	-104.6	0	0	0	112.1	F333 I335 I339 M340 Q341 F375 A379	F333-Y337 HydrophobicContact CZ-CD2 4.36Å; F333-Y337 HydrophobicContact CZ-CG 4.15Å; F333-Y337 VanDerWaalsContact O-CB 3.28Å; F333-Y337 WeakPolarHBondContact O-CB 3.49Å; F333-Y337 PolarHBondContact O-N 3.4Å; I335-Y337 PolarHBondContact O-N 3.05Å; Y337-I339 VanDerWaalsContact C-N 3.3Å; Y337-I339 PolarHBondContact O-N 3.46Å; Y337-M340 PolarHBondContact O-N 3.2Å; Y337-Q341 HydrophobicContact CD1-CG 4.28Å; Y337-Q341 HydrophobicContact CE1-CG 3.91Å; Y337-Q341 HydrophobicContact CE2-CG 4.43Å; Y337-Q341 WeakPolarHBondContact O-CG 3.37Å; Y337-Q341 PolarHBondContact O-N 3.26Å; Y337-Q341 PolarHBondContact OH-NE2 3.42Å; Y337-F375 HydrophobicContact CD2-CB 4.06Å; Y337-F375 HydrophobicContact CE2-CB 3.77Å; Y337-F375 HydrophobicContact CE2-CG 4.44Å; Y337-F375 WeakPolarHBondContact CE2-O 3.28Å; Y337-A379 HydrophobicContact CD2-CB 4.33Å; Y337-A379 HydrophobicContact CE2-CB 4.08Å
338	N	97.2	Very high	96.2	Very high	74 Å²	74	46.7 Å²	46.7	40%	0.396	23%	0.23	S	C	.	.	H	α-helix	trans	-65.2	-33	176.6	-74	-15.4	0	0	0	112.5	F304 N334 I335 L336 Q341 S342	F304-N338 HydrophobicContact CE1-CB 3.88Å; F304-N338 HydrophobicContact CZ-CB 4.11Å; N334-N338 WeakPolarHBondContact O-CB 3.49Å; N334-N338 PolarHBondContact O-N 3.39Å; N334-N338 PolarHBondContact O-ND2 3.25Å; N334-N338 VanDerWaalsContact O-ND2 3.08Å; I335-N338 PolarHBondContact O-N 3.3Å; I335-N338 VanDerWaalsContact O-N 3.16Å; L336-N338 PolarHBondContact O-N 3Å; N338-Q341 PolarHBondContact O-N 3.17Å; N338-S342 WeakPolarHBondContact O-CB 3.4Å; N338-S342 PolarHBondContact O-N 3.28Å; N338-S342 PolarHBondContact O-OG 3.27Å
339	I	97.9	Very high	96.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.2	-49.5	173.4	-70.6	165.1	0	0	0	109.7	Q300 F304 I324 I331 I335 L336 Y337 Q341 S342 Y343	Q300-I339 HydrophobicContact CG-CD1 3.96Å; F304-I339 HydrophobicContact CE1-CG1 3.76Å; F304-I339 HydrophobicContact CZ-CG1 3.94Å; I324-I339 HydrophobicContact CD1-CD1 4.03Å; I324-I339 HydrophobicContact CD1-CG1 4.4Å; I324-I339 HydrophobicContact CD1-CG2 4.12Å; I324-I339 HydrophobicContact CG1-CD1 4.3Å; I324-I339 HydrophobicContact CG2-CD1 4.13Å; I324-I339 HydrophobicContact CG2-CG2 4.47Å; I331-I339 HydrophobicContact CD1-CD1 4.29Å; I331-I339 HydrophobicContact CG2-CD1 4.32Å; I335-I339 HydrophobicContact CG2-CD1 3.98Å; I335-I339 HydrophobicContact CG2-CG1 4.46Å; I335-I339 VanDerWaalsContact O-CG1 3.3Å; I335-I339 WeakPolarHBondContact O-CG1 3.44Å; I335-I339 PolarHBondContact O-N 3.09Å; L336-I339 WeakPolarHBondContact O-CB 3.28Å; L336-I339 PolarHBondContact O-N 3.26Å; Y337-I339 VanDerWaalsContact C-N 3.3Å; Y337-I339 PolarHBondContact O-N 3.46Å; I339-Q341 VanDerWaalsContact C-N 3.3Å; I339-Q341 PolarHBondContact O-N 3.28Å; I339-S342 WeakPolarHBondContact O-CB 3.39Å; I339-S342 PolarHBondContact O-N 3.46Å; I339-S342 VanDerWaalsContact O-N 3.1Å; I339-Y343 HydrophobicContact CG2-CD2 3.87Å; I339-Y343 HydrophobicContact CG2-CE1 4.38Å; I339-Y343 HydrophobicContact CG2-CE2 3.25Å; I339-Y343 PolarHBondContact O-N 2.7Å
340	M	97.9	Very high	96.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-40.6	177.9	-65	178.6	78.4	0	0	112.2	L336 Y337 Y343 K344 I357 F376 A379 F380 L383	L336-M340 WeakPolarHBondContact O-CG 3.33Å; L336-M340 PolarHBondContact O-N 3.04Å; L336-M340 VanDerWaalsContact O-N 3.08Å; Y337-M340 PolarHBondContact O-N 3.2Å; M340-Y343 PolarHBondContact O-N 3.25Å; M340-K344 PolarHBondContact O-N 3.32Å; M340-I357 HydrophobicContact CG-CD1 4.42Å; M340-I357 HydrophobicContact SD-CG2 4.08Å; M340-F376 HydrophobicContact SD-CD1 3.8Å; M340-F376 HydrophobicContact SD-CE1 4.23Å; M340-A379 HydrophobicContact CB-CB 4.07Å; M340-A379 HydrophobicContact CE-CB 3.65Å; M340-A379 HydrophobicContact SD-CB 4.01Å; M340-F380 HydrophobicContact CE-CD1 3.7Å; M340-F380 HydrophobicContact CE-CD2 3.86Å; M340-F380 HydrophobicContact CE-CE1 3.69Å; M340-F380 HydrophobicContact CE-CE2 3.83Å; M340-F380 HydrophobicContact CE-CG 3.81Å; M340-F380 HydrophobicContact CE-CZ 3.75Å; M340-L383 HydrophobicContact CB-CD1 4.23Å; M340-L383 HydrophobicContact CE-CD1 4.03Å
341	Q	97.3	Very high	96.4	Very high	43 Å²	43	42.7 Å²	42.7	20%	0.201	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-38.9	175.2	-65.6	-67.3	35.5	0	0	112.5	Y337 N338 I339 Y343 K344 E345	Y337-Q341 HydrophobicContact CD1-CG 4.28Å; Y337-Q341 HydrophobicContact CE1-CG 3.91Å; Y337-Q341 HydrophobicContact CE2-CG 4.43Å; Y337-Q341 WeakPolarHBondContact O-CG 3.37Å; Y337-Q341 PolarHBondContact O-N 3.26Å; Y337-Q341 PolarHBondContact OH-NE2 3.42Å; N338-Q341 PolarHBondContact O-N 3.17Å; I339-Q341 VanDerWaalsContact C-N 3.3Å; I339-Q341 PolarHBondContact O-N 3.28Å; Q341-Y343 VanDerWaalsContact C-N 3.32Å; Q341-Y343 PolarHBondContact O-N 2.79Å; Q341-K344 WeakPolarHBondContact O-CB 3.32Å; Q341-K344 PolarHBondContact O-N 2.88Å; Q341-E345 WeakPolarHBondContact O-CG 3.49Å; Q341-E345 PolarHBondContact O-N 2.98Å
342	S	97.7	Very high	96.3	Very high	11 Å²	11	47.2 Å²	47.2	8%	0.077	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-39.3	175.8	-57.1	0	0	0	0	111.3	F304 N338 I339 E345 L346	F304-S342 WeakPolarHBondContact CD1-OG 3.39Å; N338-S342 WeakPolarHBondContact O-CB 3.4Å; N338-S342 PolarHBondContact O-N 3.28Å; N338-S342 PolarHBondContact O-OG 3.27Å; I339-S342 WeakPolarHBondContact O-CB 3.39Å; I339-S342 PolarHBondContact O-N 3.46Å; I339-S342 VanDerWaalsContact O-N 3.1Å; S342-E345 PolarHBondContact O-N 3.44Å; S342-L346 WeakPolarHBondContact O-CB 3.3Å; S342-L346 VanDerWaalsContact O-CG 3.26Å; S342-L346 WeakPolarHBondContact O-CG 3.46Å; S342-L346 PolarHBondContact O-N 3.25Å
343	Y	97.5	Very high	96.4	Very high	2 Å²	2	44 Å²	44	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-39.1	174.2	-67.5	-28	0	0	0	112.9	T303 L317 I324 I339 M340 Q341 L346 L347 Y348 L353	T303-Y343 HydrophobicContact CG2-CD1 3.96Å; T303-Y343 HydrophobicContact CG2-CE1 3.54Å; L317-Y343 HydrophobicContact CD2-CD1 4.12Å; L317-Y343 HydrophobicContact CD2-CE1 3.9Å; I324-Y343 WeakPolarHBondContact CD1-OH 3.27Å; I339-Y343 HydrophobicContact CG2-CD2 3.87Å; I339-Y343 HydrophobicContact CG2-CE1 4.38Å; I339-Y343 HydrophobicContact CG2-CE2 3.25Å; I339-Y343 PolarHBondContact O-N 2.7Å; M340-Y343 PolarHBondContact O-N 3.25Å; Q341-Y343 VanDerWaalsContact C-N 3.32Å; Q341-Y343 PolarHBondContact O-N 2.79Å; Y343-L346 CarbonylContact O-C 3.57Å; Y343-L346 PolarHBondContact O-N 3.49Å; Y343-L347 PolarHBondContact O-N 3.1Å; Y343-Y348 WeakPolarHBondContact CB-O 3.48Å; Y343-Y348 AromaticContact CD1-CD1 3.62Å; Y343-Y348 HydrophobicContact CD1-CD1 3.62Å; Y343-Y348 HydrophobicContact CD1-CE1 4.45Å; Y343-Y348 HydrophobicContact CD1-CG 4.4Å; Y343-Y348 AromaticContact CE1-CD1 3.86Å; Y343-Y348 HydrophobicContact CE1-CD1 3.86Å; Y343-Y348 HydrophobicContact CE1-CE1 4.26Å; Y343-Y348 HydrophobicContact CG-CD1 4.05Å; Y343-Y348 PolarHBondContact O-N 3.23Å; Y343-L353 HydrophobicContact CD2-CD2 4.04Å; Y343-L353 HydrophobicContact CE2-CD2 3.3Å; Y343-L353 HydrophobicContact CE2-CG 4.45Å
344	K	95.6	Very high	96.5	Very high	78 Å²	78	42.5 Å²	42.5	34%	0.339	21%	0.208	S	C	.	.	H	α-helix	trans	-59.5	-48.5	172	179.5	-161.1	-179.6	175.2	0	111.1	M340 Q341 L346 L347 D382 L383	M340-K344 PolarHBondContact O-N 3.32Å; Q341-K344 WeakPolarHBondContact O-CB 3.32Å; Q341-K344 PolarHBondContact O-N 2.88Å; K344-L346 VanDerWaalsContact C-N 3.28Å; K344-L346 PolarHBondContact O-N 3.3Å; K344-L347 PolarHBondContact O-N 3.39Å; K344-L347 VanDerWaalsContact O-N 3.13Å; K344-D382 HydrophobicContact CD-CB 3.73Å; K344-D382 HydrophobicContact CG-CB 4.31Å; K344-D382 IonicContact NZ-OD1 3.99Å; K344-D382 IonicContact NZ-OD2 3.15Å; K344-D382 PolarHBondContact NZ-OD2 3.18Å; K344-L383 HydrophobicContact CB-CD2 3.96Å
345	E	95.9	Very high	96.6	Very high	125 Å²	125	42.6 Å²	42.6	58%	0.584	21%	0.211	S	C	*	.	H	α-helix	trans	-61.4	-36.8	178.8	-72.6	177.2	-172	0	0	112.5	A307 Q341 S342 L347	A307-E345 HydrophobicContact CB-CB 4.42Å; Q341-E345 WeakPolarHBondContact O-CG 3.49Å; Q341-E345 PolarHBondContact O-N 2.98Å; S342-E345 PolarHBondContact O-N 3.44Å; E345-L347 VanDerWaalsContact C-N 3.29Å; E345-L347 PolarHBondContact O-N 2.97Å
346	L	95.5	Very high	96.7	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.037	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	1.1	178.3	-68.8	170.8	0	0	0	113.9	M306 A307 F311 H312 L317 S342 Y343 K344 Y348	M306-L346 HydrophobicContact CB-CD1 3.84Å; M306-L346 HydrophobicContact CB-CD2 4.26Å; A307-L346 HydrophobicContact CB-CD1 4.08Å; A307-L346 HydrophobicContact CB-CG 4.08Å; F311-L346 WeakPolarHBondContact O-CD2 3.29Å; H312-L346 PolarHBondContact CD2-O 3.04Å; H312-L346 VanDerWaalsContact CD2-O 3.29Å; L317-L346 HydrophobicContact CD1-CB 4.26Å; L317-L346 HydrophobicContact CD1-CD1 4.13Å; L317-L346 HydrophobicContact CD2-CD1 3.72Å; L317-L346 HydrophobicContact CG-CD1 4.45Å; S342-L346 WeakPolarHBondContact O-CB 3.3Å; S342-L346 VanDerWaalsContact O-CG 3.26Å; S342-L346 WeakPolarHBondContact O-CG 3.46Å; S342-L346 PolarHBondContact O-N 3.25Å; Y343-L346 CarbonylContact O-C 3.57Å; Y343-L346 PolarHBondContact O-N 3.49Å; K344-L346 VanDerWaalsContact C-N 3.28Å; K344-L346 PolarHBondContact O-N 3.3Å; L346-Y348 PolarHBondContact O-N 2.9Å; L346-Y348 VanDerWaalsContact O-N 3.09Å
347	L	94.4	Very high	96.7	Very high	139 Å²	139	43.2 Å²	43.2	73%	0.728	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	30	-173.7	-54.7	175.2	0	0	0	112.8	Y343 K344 E345	Y343-L347 PolarHBondContact O-N 3.1Å; K344-L347 PolarHBondContact O-N 3.39Å; K344-L347 VanDerWaalsContact O-N 3.13Å; E345-L347 VanDerWaalsContact C-N 3.29Å; E345-L347 PolarHBondContact O-N 2.97Å
348	Y	96.2	Very high	96.7	Very high	21 Å²	21	41 Å²	41	8%	0.082	21%	0.209	C	C	.	.			trans	-95.7	128.5	-178.1	-177.3	-101.7	0	0	0	110.4	L317 K318 S321 Y343 L346 D350 L353	L317-Y348 HydrophobicContact CB-CD1 4.25Å; L317-Y348 HydrophobicContact CB-CD2 3.72Å; L317-Y348 HydrophobicContact CB-CE1 4.19Å; L317-Y348 HydrophobicContact CB-CE2 3.67Å; L317-Y348 HydrophobicContact CB-CG 4.02Å; L317-Y348 HydrophobicContact CD1-CD2 3.79Å; L317-Y348 HydrophobicContact CD1-CG 3.84Å; L317-Y348 HydrophobicContact CD2-CD1 4.43Å; L317-Y348 HydrophobicContact CD2-CG 4.38Å; L317-Y348 HydrophobicContact CG-CD2 4.32Å; L317-Y348 HydrophobicContact CG-CG 4.32Å; K318-Y348 WeakPolarHBondContact CA-OH 3.37Å; S321-Y348 PolarHBondContact OG-OH 2.75Å; Y343-Y348 WeakPolarHBondContact CB-O 3.48Å; Y343-Y348 AromaticContact CD1-CD1 3.62Å; Y343-Y348 HydrophobicContact CD1-CD1 3.62Å; Y343-Y348 HydrophobicContact CD1-CE1 4.45Å; Y343-Y348 HydrophobicContact CD1-CG 4.4Å; Y343-Y348 AromaticContact CE1-CD1 3.86Å; Y343-Y348 HydrophobicContact CE1-CD1 3.86Å; Y343-Y348 HydrophobicContact CE1-CE1 4.26Å; Y343-Y348 HydrophobicContact CG-CD1 4.05Å; Y343-Y348 PolarHBondContact O-N 3.23Å; L346-Y348 PolarHBondContact O-N 2.9Å; L346-Y348 VanDerWaalsContact O-N 3.09Å; Y348-D350 HydrophobicContact CE1-CB 4.13Å; Y348-L353 HydrophobicContact CE1-CD2 4.45Å
349	R	95.1	Very high	96.8	Very high	93 Å²	93	40.8 Å²	40.8	35%	0.351	21%	0.207	S	C	.	.			trans	-142.1	133.7	179	-66.8	170.4	-74.1	170	-0.8	107.8	L354 L383 F601	R349-L354 HydrophobicContact CB-CD1 4.4Å; R349-L383 WeakPolarHBondContact CD-O 3.24Å; R349-L383 HydrophobicContact CG-CD2 4.21Å; R349-F601 HydrophobicContact CB-CD1 3.9Å; R349-F601 HydrophobicContact CB-CD2 4.21Å; R349-F601 HydrophobicContact CB-CE1 3.51Å; R349-F601 HydrophobicContact CB-CE2 3.84Å; R349-F601 HydrophobicContact CB-CG 4.23Å; R349-F601 HydrophobicContact CB-CZ 3.47Å; R349-F601 VanDerWaalsContact CB-CZ 3.47Å
350	D	95.4	Very high	96.7	Very high	23 Å²	23	42 Å²	42	12%	0.123	21%	0.213	C	C	.	.			trans	-136.8	119.4	177.4	176.8	-77.9	0	0	0	106.2	K318 Y348 D352 L353 L354	K318-D350 IonicContact NZ-OD1 3.91Å; K318-D350 IonicContact NZ-OD2 2.73Å; K318-D350 PolarHBondContact NZ-OD2 2.94Å; Y348-D350 HydrophobicContact CE1-CB 4.13Å; D350-D352 VanDerWaalsContact C-N 3.34Å; D350-D352 PolarHBondContact O-N 2.82Å; D350-D352 PolarHBondContact OD1-N 3.18Å; D350-L353 HydrophobicContact CB-CB 3.95Å; D350-L353 PolarHBondContact O-N 2.95Å; D350-L353 WeakPolarHBondContact OD1-CB 3.24Å; D350-L353 PolarHBondContact OD1-N 2.82Å; D350-L354 VanDerWaalsContact O-CG 3.31Å; D350-L354 WeakPolarHBondContact O-CG 3.45Å; D350-L354 PolarHBondContact O-N 2.87Å
351	T	95.3	Very high	96.7	Very high	53 Å²	53	42 Å²	42	33%	0.325	21%	0.213	S	C	.	.	H	α-helix	trans	-62.2	-45.2	-171.4	-54.7	0	0	0	0	110.6	L353 L354 T355 F385 F601	T351-L353 VanDerWaalsContact C-N 3.34Å; T351-L353 PolarHBondContact O-N 3.15Å; T351-L354 PolarHBondContact O-N 3.02Å; T351-T355 WeakPolarHBondContact O-CB 3.4Å; T351-T355 PolarHBondContact O-N 3.12Å; T351-T355 PolarHBondContact O-OG1 3.48Å; T351-F385 HydrophobicContact CG2-CE2 4.33Å; T351-F601 WeakPolarHBondContact OG1-CE1 3.36Å
352	D	95.8	Very high	96.7	Very high	100 Å²	100	41.1 Å²	41.1	54%	0.535	21%	0.213	S	C	.	.	H	α-helix	trans	-62.1	-42.9	-178.4	-60	-20.2	0	0	0	111.5	D350 S356	D350-D352 VanDerWaalsContact C-N 3.34Å; D350-D352 PolarHBondContact O-N 2.82Å; D350-D352 PolarHBondContact OD1-N 3.18Å; D352-S356 VanDerWaalsContact O-CB 3.3Å; D352-S356 WeakPolarHBondContact O-CB 3.24Å; D352-S356 PolarHBondContact O-N 3.33Å; D352-S356 PolarHBondContact O-OG 3.37Å
353	L	97.1	Very high	96.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-48.8	175.3	177.3	67.7	0	0	0	111.8	I324 K325 Y343 Y348 D350 T351 S356 I357	I324-L353 HydrophobicContact CG2-CD1 4.45Å; K325-L353 HydrophobicContact CB-CD1 3.9Å; K325-L353 HydrophobicContact CG-CD1 4.45Å; Y343-L353 HydrophobicContact CD2-CD2 4.04Å; Y343-L353 HydrophobicContact CE2-CD2 3.3Å; Y343-L353 HydrophobicContact CE2-CG 4.45Å; Y348-L353 HydrophobicContact CE1-CD2 4.45Å; D350-L353 HydrophobicContact CB-CB 3.95Å; D350-L353 PolarHBondContact O-N 2.95Å; D350-L353 WeakPolarHBondContact OD1-CB 3.24Å; D350-L353 PolarHBondContact OD1-N 2.82Å; T351-L353 VanDerWaalsContact C-N 3.34Å; T351-L353 PolarHBondContact O-N 3.15Å; L353-S356 PolarHBondContact O-N 3.16Å; L353-I357 HydrophobicContact CD1-CD1 4.1Å; L353-I357 HydrophobicContact CD1-CG1 4.43Å; L353-I357 HydrophobicContact CG-CD1 3.99Å; L353-I357 VanDerWaalsContact O-CG1 3.28Å; L353-I357 WeakPolarHBondContact O-CG1 3.25Å; L353-I357 PolarHBondContact O-N 3.1Å
354	L	97.9	Very high	96.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-67.2	-38.6	-177.4	-66.5	178	0	0	0	111.9	R349 D350 T351 I357 S358 F380 L383 F385 F601	R349-L354 HydrophobicContact CB-CD1 4.4Å; D350-L354 VanDerWaalsContact O-CG 3.31Å; D350-L354 WeakPolarHBondContact O-CG 3.45Å; D350-L354 PolarHBondContact O-N 2.87Å; T351-L354 PolarHBondContact O-N 3.02Å; L354-I357 PolarHBondContact O-N 3.38Å; L354-S358 WeakPolarHBondContact O-CB 3.33Å; L354-S358 PolarHBondContact O-N 2.78Å; L354-F380 HydrophobicContact CB-CE1 4.27Å; L354-F380 HydrophobicContact CD2-CE1 4.25Å; L354-F380 WeakPolarHBondContact O-CE1 3.4Å; L354-L383 HydrophobicContact CD2-CD1 3.77Å; L354-F385 HydrophobicContact CB-CD1 3.97Å; L354-F385 HydrophobicContact CB-CD2 3.93Å; L354-F385 HydrophobicContact CB-CE1 3.94Å; L354-F385 HydrophobicContact CB-CE2 3.92Å; L354-F385 HydrophobicContact CB-CG 3.93Å; L354-F385 HydrophobicContact CB-CZ 3.92Å; L354-F385 HydrophobicContact CD1-CB 3.84Å; L354-F385 HydrophobicContact CD1-CD2 3.91Å; L354-F385 HydrophobicContact CD1-CG 3.88Å; L354-F601 HydrophobicContact CD1-CD1 4.35Å
355	T	97.6	Very high	96.6	Very high	51 Å²	51	43.6 Å²	43.6	31%	0.313	24%	0.237	S	C	.	.	H	α-helix	trans	-61	-48.5	170.4	-58.8	0	0	0	0	110.6	T351 I357 S358 D359	T351-T355 WeakPolarHBondContact O-CB 3.4Å; T351-T355 PolarHBondContact O-N 3.12Å; T351-T355 PolarHBondContact O-OG1 3.48Å; T355-I357 VanDerWaalsContact C-N 3.31Å; T355-I357 PolarHBondContact O-N 2.8Å; T355-S358 WeakPolarHBondContact O-CA 3.31Å; T355-S358 WeakPolarHBondContact O-CB 3.39Å; T355-S358 PolarHBondContact O-N 3.44Å; T355-D359 VanDerWaalsContact O-CG 3.3Å; T355-D359 PolarHBondContact O-N 3.26Å
356	S	97.9	Very high	96.5	Very high	37 Å²	37	45.1 Å²	45.1	26%	0.259	25%	0.249	S	C	.	.	H	α-helix	trans	-60.1	-39.4	178.7	-58.2	0	0	0	0	112.6	D352 L353 H360	D352-S356 VanDerWaalsContact O-CB 3.3Å; D352-S356 WeakPolarHBondContact O-CB 3.24Å; D352-S356 PolarHBondContact O-N 3.33Å; D352-S356 PolarHBondContact O-OG 3.37Å; L353-S356 PolarHBondContact O-N 3.16Å; S356-H360 VanDerWaalsContact O-CB 3.25Å; S356-H360 WeakPolarHBondContact O-CB 3.38Å; S356-H360 PolarHBondContact O-N 3.24Å
357	I	98.1	Very high	96.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.9	-44.3	174.4	-66.5	168.2	0	0	0	110.3	L328 L336 M340 L353 L354 T355 H360 V361 F380	L328-I357 HydrophobicContact CD1-CG1 4.23Å; L328-I357 HydrophobicContact CD2-CG1 3.81Å; L336-I357 HydrophobicContact CD1-CD1 4.25Å; L336-I357 HydrophobicContact CD1-CG1 4.24Å; L336-I357 HydrophobicContact CD1-CG2 4.36Å; L336-I357 HydrophobicContact CD2-CG2 4.31Å; M340-I357 HydrophobicContact CG-CD1 4.42Å; M340-I357 HydrophobicContact SD-CG2 4.08Å; L353-I357 HydrophobicContact CD1-CD1 4.1Å; L353-I357 HydrophobicContact CD1-CG1 4.43Å; L353-I357 HydrophobicContact CG-CD1 3.99Å; L353-I357 VanDerWaalsContact O-CG1 3.28Å; L353-I357 WeakPolarHBondContact O-CG1 3.25Å; L353-I357 PolarHBondContact O-N 3.1Å; L354-I357 PolarHBondContact O-N 3.38Å; T355-I357 VanDerWaalsContact C-N 3.31Å; T355-I357 PolarHBondContact O-N 2.8Å; I357-H360 PolarHBondContact O-N 2.78Å; I357-V361 HydrophobicContact CG2-CG2 4.4Å; I357-V361 VanDerWaalsContact O-CG2 3.3Å; I357-V361 WeakPolarHBondContact O-CG2 3.37Å; I357-V361 PolarHBondContact O-N 3.15Å; I357-F380 HydrophobicContact CB-CZ 4.2Å; I357-F380 HydrophobicContact CG2-CE2 4.5Å; I357-F380 HydrophobicContact CG2-CZ 3.8Å
358	S	98	Very high	96.5	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-48.8	177.6	176.3	0	0	0	0	111.1	L354 T355 V361 A362 P387	L354-S358 WeakPolarHBondContact O-CB 3.33Å; L354-S358 PolarHBondContact O-N 2.78Å; T355-S358 WeakPolarHBondContact O-CA 3.31Å; T355-S358 WeakPolarHBondContact O-CB 3.39Å; T355-S358 PolarHBondContact O-N 3.44Å; S358-V361 PolarHBondContact O-N 3.44Å; S358-A362 VanDerWaalsContact O-CB 3.29Å; S358-A362 WeakPolarHBondContact O-CB 3.26Å; S358-A362 PolarHBondContact O-N 3.41Å; S358-P387 WeakPolarHBondContact OG-CB 3.35Å
359	D	97.9	Very high	96.5	Very high	68 Å²	68	48.4 Å²	48.4	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-67.2	-36.9	179.8	-64.2	-18.6	0	0	0	111.9	T355 A362 S363 S389	T355-D359 VanDerWaalsContact O-CG 3.3Å; T355-D359 PolarHBondContact O-N 3.26Å; D359-A362 PolarHBondContact O-N 3.43Å; D359-S363 VanDerWaalsContact O-CB 3.3Å; D359-S363 WeakPolarHBondContact O-CB 3.48Å; D359-S363 PolarHBondContact O-N 2.8Å; D359-S363 PolarHBondContact O-OG 2.97Å; D359-S389 WeakPolarHBondContact OD1-CB 3.41Å; D359-S389 PolarHBondContact OD1-OG 2.9Å
360	H	97.4	Very high	96.3	Very high	27 Å²	27	46.2 Å²	46.2	13%	0.125	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-48.6	174.1	175	55.1	0	0	0	111.6	L328 S356 I357 A362 S363 T364	L328-H360 HydrophobicContact CB-CB 4.39Å; L328-H360 HydrophobicContact CD1-CB 4.23Å; S356-H360 VanDerWaalsContact O-CB 3.25Å; S356-H360 WeakPolarHBondContact O-CB 3.38Å; S356-H360 PolarHBondContact O-N 3.24Å; I357-H360 PolarHBondContact O-N 2.78Å; H360-A362 VanDerWaalsContact C-N 3.32Å; H360-A362 PolarHBondContact O-N 3.33Å; H360-S363 WeakPolarHBondContact CA-OG 3.28Å; H360-S363 PolarHBondContact O-N 3.47Å; H360-S363 PolarHBondContact O-OG 3.43Å; H360-T364 PolarHBondContact O-N 3.28Å; H360-T364 VanDerWaalsContact O-N 3.11Å; H360-T364 PolarHBondContact O-OG1 3.1Å
361	V	97.8	Very high	96.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-38.5	178.9	177.5	0	0	0	0	110.8	L336 I357 S358 T364 F365 W368 L373 F376 L390	L336-V361 HydrophobicContact CD2-CG2 4.46Å; I357-V361 HydrophobicContact CG2-CG2 4.4Å; I357-V361 VanDerWaalsContact O-CG2 3.3Å; I357-V361 WeakPolarHBondContact O-CG2 3.37Å; I357-V361 PolarHBondContact O-N 3.15Å; S358-V361 PolarHBondContact O-N 3.44Å; V361-T364 CarbonylContact O-C 3.49Å; V361-T364 PolarHBondContact O-N 3.29Å; V361-F365 WeakPolarHBondContact O-CA 3.46Å; V361-F365 PolarHBondContact O-N 3.38Å; V361-F365 VanDerWaalsContact O-N 3.08Å; V361-W368 PolarHBondContact O-NE1 3.33Å; V361-L373 HydrophobicContact CG1-CD2 3.97Å; V361-F376 HydrophobicContact CB-CD2 4.45Å; V361-F376 HydrophobicContact CG1-CD2 3.59Å; V361-F376 HydrophobicContact CG1-CE2 3.92Å; V361-F376 HydrophobicContact CG1-CG 4.24Å; V361-F376 HydrophobicContact CG2-CD1 4.25Å; V361-F376 HydrophobicContact CG2-CD2 3.9Å; V361-F376 HydrophobicContact CG2-CE1 4.14Å; V361-F376 HydrophobicContact CG2-CE2 3.74Å; V361-F376 HydrophobicContact CG2-CG 4.15Å; V361-F376 HydrophobicContact CG2-CZ 3.87Å; V361-L390 HydrophobicContact CG1-CD1 3.74Å; V361-L390 HydrophobicContact CG1-CD2 3.98Å; V361-L390 HydrophobicContact CG1-CG 4.48Å
362	A	97.6	Very high	96.4	Very high	23 Å²	23	49.9 Å²	49.9	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-42	176.2	0	0	0	0	0	113.1	S358 D359 H360 T364 F365 S389	S358-A362 VanDerWaalsContact O-CB 3.29Å; S358-A362 WeakPolarHBondContact O-CB 3.26Å; S358-A362 PolarHBondContact O-N 3.41Å; D359-A362 PolarHBondContact O-N 3.43Å; H360-A362 VanDerWaalsContact C-N 3.32Å; H360-A362 PolarHBondContact O-N 3.33Å; A362-T364 PolarHBondContact O-N 3.1Å; A362-F365 VanDerWaalsContact O-CB 3.25Å; A362-F365 WeakPolarHBondContact O-CB 3.26Å; A362-F365 PolarHBondContact O-N 3.49Å; A362-S389 WeakPolarHBondContact CB-O 3.49Å
363	S	96.8	Very high	96.5	Very high	94 Å²	94	45.1 Å²	45.1	66%	0.657	25%	0.249	S	C	*	.	H	α-helix	trans	-69.3	-20.3	176.9	56.2	0	0	0	0	113.5	D359 H360	D359-S363 VanDerWaalsContact O-CB 3.3Å; D359-S363 WeakPolarHBondContact O-CB 3.48Å; D359-S363 PolarHBondContact O-N 2.8Å; D359-S363 PolarHBondContact O-OG 2.97Å; H360-S363 WeakPolarHBondContact CA-OG 3.28Å; H360-S363 PolarHBondContact O-N 3.47Å; H360-S363 PolarHBondContact O-OG 3.43Å
364	T	95.8	Very high	96.5	Very high	27 Å²	27	45.2 Å²	45.2	17%	0.166	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	23.5	176.2	54.8	0	0	0	0	112.2	H360 V361 A362 D366 I367 W368	H360-T364 PolarHBondContact O-N 3.28Å; H360-T364 VanDerWaalsContact O-N 3.11Å; H360-T364 PolarHBondContact O-OG1 3.1Å; V361-T364 CarbonylContact O-C 3.49Å; V361-T364 PolarHBondContact O-N 3.29Å; A362-T364 PolarHBondContact O-N 3.1Å; T364-D366 VanDerWaalsContact C-N 3.29Å; T364-D366 PolarHBondContact O-N 3.09Å; T364-D366 VanDerWaalsContact O-N 3.16Å; T364-I367 HydrophobicContact CG2-CD1 4.01Å; T364-I367 WeakPolarHBondContact O-CB 3.34Å; T364-I367 PolarHBondContact O-N 2.95Å; T364-W368 PolarHBondContact O-NE1 3.05Å; T364-W368 PolarHBondContact OG1-NE1 3.16Å
365	F	95.9	Very high	96.4	Very high	23 Å²	23	47.6 Å²	47.6	10%	0.101	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-51.1	-43.9	-170	-171.9	-94.8	0	0	0	113.8	V361 A362 I367 W368 L373 L390 P393 Y394 K397	V361-F365 WeakPolarHBondContact O-CA 3.46Å; V361-F365 PolarHBondContact O-N 3.38Å; V361-F365 VanDerWaalsContact O-N 3.08Å; A362-F365 VanDerWaalsContact O-CB 3.25Å; A362-F365 WeakPolarHBondContact O-CB 3.26Å; A362-F365 PolarHBondContact O-N 3.49Å; F365-I367 PolarHBondContact O-N 3.29Å; F365-W368 PolarHBondContact O-N 3.5Å; F365-L373 HydrophobicContact CD2-CD1 4.31Å; F365-L373 HydrophobicContact CD2-CD2 3.96Å; F365-L373 HydrophobicContact CE1-CD1 4.35Å; F365-L373 HydrophobicContact CE2-CD1 3.88Å; F365-L373 HydrophobicContact CE2-CD2 4.07Å; F365-L373 HydrophobicContact CZ-CD1 3.91Å; F365-L390 HydrophobicContact CD2-CD1 3.99Å; F365-L390 HydrophobicContact CE2-CD1 4.1Å; F365-P393 HydrophobicContact CD2-CB 4.27Å; F365-P393 HydrophobicContact CD2-CG 4.12Å; F365-P393 HydrophobicContact CE2-CB 4.11Å; F365-P393 HydrophobicContact CE2-CG 4.13Å; F365-P393 HydrophobicContact CZ-CB 4.31Å; F365-Y394 HydrophobicContact CE2-CD2 4.06Å; F365-Y394 HydrophobicContact CZ-CD2 4.05Å; F365-K397 HydrophobicContact CE1-CB 4.45Å; F365-K397 HydrophobicContact CE1-CD 3.83Å; F365-K397 HydrophobicContact CZ-CB 4.2Å; F365-K397 HydrophobicContact CZ-CD 3.82Å
366	D	93.8	Very high	96.5	Very high	156 Å²	156	45.1 Å²	45.1	83%	0.834	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-70.4	-17	-177.6	-60.9	-41.3	0	0	0	114.1	T364 W368	T364-D366 VanDerWaalsContact C-N 3.29Å; T364-D366 PolarHBondContact O-N 3.09Å; T364-D366 VanDerWaalsContact O-N 3.16Å; D366-W368 VanDerWaalsContact C-N 3.34Å
367	I	94.5	Very high	96.5	Very high	128 Å²	128	43.5 Å²	43.5	66%	0.656	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-76.8	-27.2	177.2	-53.7	-176.7	0	0	0	110.4	T364 F365	T364-I367 HydrophobicContact CG2-CD1 4.01Å; T364-I367 WeakPolarHBondContact O-CB 3.34Å; T364-I367 PolarHBondContact O-N 2.95Å; F365-I367 PolarHBondContact O-N 3.29Å
368	W	95.4	Very high	96.5	Very high	30 Å²	30	44.6 Å²	44.6	11%	0.114	24%	0.24	C	C	.	.	S	Bend	trans	-90.1	136.9	-172.6	-53.1	111.5	0	0	0	112.5	F333 V361 T364 F365 D366 Q372 L373 F376	F333-W368 HydrophobicContact CB-CE3 4.28Å; F333-W368 HydrophobicContact CB-CH2 4.48Å; F333-W368 HydrophobicContact CB-CZ3 3.67Å; F333-W368 HydrophobicContact CD2-CE3 4.4Å; F333-W368 HydrophobicContact CD2-CZ3 4.41Å; V361-W368 PolarHBondContact O-NE1 3.33Å; T364-W368 PolarHBondContact O-NE1 3.05Å; T364-W368 PolarHBondContact OG1-NE1 3.16Å; F365-W368 PolarHBondContact O-N 3.5Å; D366-W368 VanDerWaalsContact C-N 3.34Å; W368-Q372 HydrophobicContact CB-CB 4.35Å; W368-L373 HydrophobicContact CB-CD1 4.43Å; W368-L373 HydrophobicContact CB-CD2 3.72Å; W368-L373 HydrophobicContact CB-CG 3.78Å; W368-L373 HydrophobicContact CG-CD2 4.13Å; W368-F376 HydrophobicContact CD2-CE2 4.1Å; W368-F376 HydrophobicContact CE3-CE2 4.34Å
369	T	94.8	Very high	96.4	Very high	79 Å²	79	44.5 Å²	44.5	49%	0.485	24%	0.24	S	C	.	.			trans	-68.8	155.4	168.8	63.9	0	0	0	0	111.2	K371 Q372 L373	T369-K371 PolarHBondContact O-N 3.32Å; T369-K371 VanDerWaalsContact O-N 3.14Å; T369-Q372 WeakPolarHBondContact O-CB 3.2Å; T369-Q372 PolarHBondContact O-N 2.55Å; T369-Q372 VanDerWaalsContact OG1-CD 3.31Å; T369-Q372 VanDerWaalsContact OG1-CG 3.27Å; T369-Q372 WeakPolarHBondContact OG1-CG 3.42Å; T369-Q372 PolarHBondContact OG1-N 3.31Å; T369-Q372 PolarHBondContact OG1-OE1 2.97Å; T369-L373 PolarHBondContact O-N 3.4Å
370	D	92.2	Very high	96.5	Very high	46 Å²	46	41.3 Å²	41.3	25%	0.246	22%	0.223	C	C	.	.	H	α-helix	trans	-54.4	-38.2	177.1	-69.6	-31.2	0	0	0	112.9	Q372 L373 V374 K397	D370-Q372 VanDerWaalsContact C-N 3.32Å; D370-Q372 PolarHBondContact O-N 3.16Å; D370-L373 PolarHBondContact O-N 2.91Å; D370-V374 WeakPolarHBondContact O-CG2 3.44Å; D370-V374 PolarHBondContact O-N 3.22Å; D370-K397 WeakPolarHBondContact OD1-CE 3.48Å; D370-K397 IonicContact OD1-NZ 2.82Å; D370-K397 PolarHBondContact OD1-NZ 3.27Å
371	K	94.8	Very high	96.4	Very high	113 Å²	113	42 Å²	42	49%	0.491	23%	0.226	S	C	.	.	H	α-helix	trans	-60.3	-41.8	176.3	-177.1	178.9	177.4	-174.4	0	112.1	T369 F375	T369-K371 PolarHBondContact O-N 3.32Å; T369-K371 VanDerWaalsContact O-N 3.14Å; K371-F375 HydrophobicContact CD-CE2 4.31Å; K371-F375 HydrophobicContact CG-CD2 4.26Å; K371-F375 HydrophobicContact CG-CE2 3.85Å; K371-F375 HydrophobicContact CG-CZ 4.1Å; K371-F375 WeakPolarHBondContact O-CD2 3.19Å; K371-F375 VanDerWaalsContact O-CG 3.29Å; K371-F375 WeakPolarHBondContact O-CG 3.41Å; K371-F375 PolarHBondContact O-N 2.85Å; K371-F375 VanDerWaalsContact O-N 3.1Å
372	Q	97	Very high	96.3	Very high	41 Å²	41	45 Å²	45	19%	0.192	24%	0.241	C	C	.	.	H	α-helix	trans	-70	-43.5	179.8	-71.8	167.3	-46	0	0	111.2	F333 W368 T369 D370 V374 F375 F376	F333-Q372 HydrophobicContact CD1-CG 3.81Å; F333-Q372 HydrophobicContact CD2-CB 3.66Å; F333-Q372 HydrophobicContact CD2-CG 3.59Å; F333-Q372 HydrophobicContact CE1-CG 3.87Å; F333-Q372 HydrophobicContact CE2-CB 3.53Å; F333-Q372 HydrophobicContact CE2-CG 3.67Å; F333-Q372 HydrophobicContact CG-CB 4.29Å; F333-Q372 HydrophobicContact CG-CG 3.7Å; F333-Q372 HydrophobicContact CZ-CB 4.05Å; F333-Q372 HydrophobicContact CZ-CG 3.83Å; W368-Q372 HydrophobicContact CB-CB 4.35Å; T369-Q372 WeakPolarHBondContact O-CB 3.2Å; T369-Q372 PolarHBondContact O-N 2.55Å; T369-Q372 VanDerWaalsContact OG1-CD 3.31Å; T369-Q372 VanDerWaalsContact OG1-CG 3.27Å; T369-Q372 WeakPolarHBondContact OG1-CG 3.42Å; T369-Q372 PolarHBondContact OG1-N 3.31Å; T369-Q372 PolarHBondContact OG1-OE1 2.97Å; D370-Q372 VanDerWaalsContact C-N 3.32Å; D370-Q372 PolarHBondContact O-N 3.16Å; Q372-V374 VanDerWaalsContact C-N 3.35Å; Q372-V374 PolarHBondContact O-N 3.03Å; Q372-F375 WeakPolarHBondContact O-CB 3.4Å; Q372-F375 PolarHBondContact O-N 2.93Å; Q372-F375 VanDerWaalsContact O-N 3.11Å; Q372-F376 VanDerWaalsContact O-CD2 3.32Å; Q372-F376 WeakPolarHBondContact O-CD2 3.31Å; Q372-F376 PolarHBondContact O-N 3.1Å
373	L	97.5	Very high	96.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.9	-45.5	175.8	-66.2	170.3	0	0	0	111.4	V361 F365 W368 T369 D370 F375 F376 L377 L390 Y394	V361-L373 HydrophobicContact CG1-CD2 3.97Å; F365-L373 HydrophobicContact CD2-CD1 4.31Å; F365-L373 HydrophobicContact CD2-CD2 3.96Å; F365-L373 HydrophobicContact CE1-CD1 4.35Å; F365-L373 HydrophobicContact CE2-CD1 3.88Å; F365-L373 HydrophobicContact CE2-CD2 4.07Å; F365-L373 HydrophobicContact CZ-CD1 3.91Å; W368-L373 HydrophobicContact CB-CD1 4.43Å; W368-L373 HydrophobicContact CB-CD2 3.72Å; W368-L373 HydrophobicContact CB-CG 3.78Å; W368-L373 HydrophobicContact CG-CD2 4.13Å; T369-L373 PolarHBondContact O-N 3.4Å; D370-L373 PolarHBondContact O-N 2.91Å; L373-F375 VanDerWaalsContact C-N 3.3Å; L373-F375 PolarHBondContact O-N 2.9Å; L373-F376 PolarHBondContact O-N 3.38Å; L373-L377 WeakPolarHBondContact O-CG 3.43Å; L373-L377 PolarHBondContact O-N 3.5Å; L373-L390 HydrophobicContact CD2-CD1 3.97Å; L373-Y394 HydrophobicContact CB-CD2 3.92Å; L373-Y394 HydrophobicContact CB-CE2 3.62Å; L373-Y394 HydrophobicContact CD1-CD2 4.03Å; L373-Y394 HydrophobicContact CD1-CE2 4.01Å; L373-Y394 HydrophobicContact CG-CE2 4.46Å
374	V	97.3	Very high	96.3	Very high	3 Å²	3	41 Å²	41	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-39.9	174.8	172.9	0	0	0	0	111.6	D370 Q372 L377 S378 Y394 H409 S412 V413	D370-V374 WeakPolarHBondContact O-CG2 3.44Å; D370-V374 PolarHBondContact O-N 3.22Å; Q372-V374 VanDerWaalsContact C-N 3.35Å; Q372-V374 PolarHBondContact O-N 3.03Å; V374-L377 PolarHBondContact O-N 3.45Å; V374-S378 PolarHBondContact O-N 2.84Å; V374-S378 PolarHBondContact O-OG 3Å; V374-Y394 WeakPolarHBondContact CG2-OH 3.35Å; V374-H409 HydrophobicContact CG1-CB 4.49Å; V374-H409 HydrophobicContact CG2-CB 4.05Å; V374-S412 WeakPolarHBondContact CG1-OG 3.47Å; V374-V413 HydrophobicContact CG2-CG2 4.21Å
375	F	97.4	Very high	96.3	Very high	51 Å²	51	40.4 Å²	40.4	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-39.7	176.7	-74.5	-18.6	0	0	0	112.7	F333 Y337 K371 Q372 L373 S378 A379	F333-F375 HydrophobicContact CE1-CD2 4.21Å; F333-F375 HydrophobicContact CE2-CB 4.38Å; F333-F375 HydrophobicContact CZ-CB 3.87Å; F333-F375 AromaticContact CZ-CD2 3.77Å; F333-F375 HydrophobicContact CZ-CD2 3.77Å; F333-F375 HydrophobicContact CZ-CG 4.34Å; Y337-F375 HydrophobicContact CD2-CB 4.06Å; Y337-F375 HydrophobicContact CE2-CB 3.77Å; Y337-F375 HydrophobicContact CE2-CG 4.44Å; Y337-F375 WeakPolarHBondContact CE2-O 3.28Å; K371-F375 HydrophobicContact CD-CE2 4.31Å; K371-F375 HydrophobicContact CG-CD2 4.26Å; K371-F375 HydrophobicContact CG-CE2 3.85Å; K371-F375 HydrophobicContact CG-CZ 4.1Å; K371-F375 WeakPolarHBondContact O-CD2 3.19Å; K371-F375 VanDerWaalsContact O-CG 3.29Å; K371-F375 WeakPolarHBondContact O-CG 3.41Å; K371-F375 PolarHBondContact O-N 2.85Å; K371-F375 VanDerWaalsContact O-N 3.1Å; Q372-F375 WeakPolarHBondContact O-CB 3.4Å; Q372-F375 PolarHBondContact O-N 2.93Å; Q372-F375 VanDerWaalsContact O-N 3.11Å; L373-F375 VanDerWaalsContact C-N 3.3Å; L373-F375 PolarHBondContact O-N 2.9Å; F375-S378 PolarHBondContact O-N 3.26Å; F375-A379 WeakPolarHBondContact O-CB 3.29Å; F375-A379 PolarHBondContact O-N 3.4Å
376	F	98.3	Very high	96.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-48.4	171.5	-73.5	-54.4	0	0	0	111.5	F333 L336 M340 V361 W368 Q372 L373 S378 A379 F380 L390	F333-F376 HydrophobicContact CD2-CD2 4.38Å; F333-F376 HydrophobicContact CD2-CE1 4.19Å; F333-F376 AromaticContact CD2-CE2 3.54Å; F333-F376 HydrophobicContact CD2-CE2 3.54Å; F333-F376 AromaticContact CD2-CZ 3.42Å; F333-F376 HydrophobicContact CD2-CZ 3.42Å; F333-F376 VanDerWaalsContact CD2-CZ 3.42Å; F333-F376 HydrophobicContact CE2-CD1 4.5Å; F333-F376 HydrophobicContact CE2-CD2 4.1Å; F333-F376 HydrophobicContact CE2-CE1 4.1Å; F333-F376 AromaticContact CE2-CE2 3.7Å; F333-F376 HydrophobicContact CE2-CE2 3.7Å; F333-F376 HydrophobicContact CE2-CG 4.49Å; F333-F376 AromaticContact CE2-CZ 3.7Å; F333-F376 HydrophobicContact CE2-CZ 3.7Å; L336-F376 HydrophobicContact CB-CE1 4.39Å; L336-F376 HydrophobicContact CD2-CE1 3.85Å; L336-F376 HydrophobicContact CD2-CZ 3.9Å; L336-F376 HydrophobicContact CG-CE1 3.94Å; L336-F376 HydrophobicContact CG-CZ 4.38Å; M340-F376 HydrophobicContact SD-CD1 3.8Å; M340-F376 HydrophobicContact SD-CE1 4.23Å; V361-F376 HydrophobicContact CB-CD2 4.45Å; V361-F376 HydrophobicContact CG1-CD2 3.59Å; V361-F376 HydrophobicContact CG1-CE2 3.92Å; V361-F376 HydrophobicContact CG1-CG 4.24Å; V361-F376 HydrophobicContact CG2-CD1 4.25Å; V361-F376 HydrophobicContact CG2-CD2 3.9Å; V361-F376 HydrophobicContact CG2-CE1 4.14Å; V361-F376 HydrophobicContact CG2-CE2 3.74Å; V361-F376 HydrophobicContact CG2-CG 4.15Å; V361-F376 HydrophobicContact CG2-CZ 3.87Å; W368-F376 HydrophobicContact CD2-CE2 4.1Å; W368-F376 HydrophobicContact CE3-CE2 4.34Å; Q372-F376 VanDerWaalsContact O-CD2 3.32Å; Q372-F376 WeakPolarHBondContact O-CD2 3.31Å; Q372-F376 PolarHBondContact O-N 3.1Å; L373-F376 PolarHBondContact O-N 3.38Å; F376-S378 VanDerWaalsContact C-N 3.31Å; F376-S378 PolarHBondContact O-N 3.45Å; F376-A379 WeakPolarHBondContact O-CB 3.23Å; F376-A379 PolarHBondContact O-N 2.94Å; F376-F380 HydrophobicContact CB-CE2 4.49Å; F376-F380 WeakPolarHBondContact O-CD2 3.34Å; F376-F380 PolarHBondContact O-N 3.37Å; F376-L390 HydrophobicContact CB-CD2 4.06Å
377	L	98.1	Very high	96.6	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-57.1	-42.9	176.9	-72.5	175.8	0	0	0	112.4	L373 V374 F380 K381 P387 L390 M391 Y394 T416	L373-L377 WeakPolarHBondContact O-CG 3.43Å; L373-L377 PolarHBondContact O-N 3.5Å; V374-L377 PolarHBondContact O-N 3.45Å; L377-F380 PolarHBondContact O-N 3.09Å; L377-K381 WeakPolarHBondContact O-CB 3.13Å; L377-K381 PolarHBondContact O-N 3.17Å; L377-P387 HydrophobicContact CD2-CG 4.2Å; L377-L390 HydrophobicContact CD2-CD2 3.93Å; L377-L390 HydrophobicContact CD2-CG 4.06Å; L377-L390 HydrophobicContact CG-CD2 4.25Å; L377-M391 HydrophobicContact CD2-CG 3.7Å; L377-Y394 HydrophobicContact CD1-CD1 3.53Å; L377-Y394 HydrophobicContact CD1-CD2 4.28Å; L377-Y394 HydrophobicContact CD1-CE1 3.71Å; L377-Y394 HydrophobicContact CD1-CE2 4.44Å; L377-Y394 HydrophobicContact CD1-CG 3.84Å; L377-T416 HydrophobicContact CB-CG2 4.19Å
378	S	97.5	Very high	96.6	Very high	23 Å²	23	29.4 Å²	29.4	16%	0.161	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-41	174	-59.9	0	0	0	0	112.7	V374 F375 F376 K381 D382 S412	V374-S378 PolarHBondContact O-N 2.84Å; V374-S378 PolarHBondContact O-OG 3Å; F375-S378 PolarHBondContact O-N 3.26Å; F376-S378 VanDerWaalsContact C-N 3.31Å; F376-S378 PolarHBondContact O-N 3.45Å; S378-K381 WeakPolarHBondContact O-CB 3.26Å; S378-K381 PolarHBondContact O-N 2.9Å; S378-D382 PolarHBondContact O-N 3.24Å; S378-S412 PolarHBondContact OG-OG 3.07Å
379	A	97.8	Very high	96.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-65.9	-41.6	178.9	0	0	0	0	0	111.6	Y337 M340 F375 F376 D382 L383	Y337-A379 HydrophobicContact CD2-CB 4.33Å; Y337-A379 HydrophobicContact CE2-CB 4.08Å; M340-A379 HydrophobicContact CB-CB 4.07Å; M340-A379 HydrophobicContact CE-CB 3.65Å; M340-A379 HydrophobicContact SD-CB 4.01Å; F375-A379 WeakPolarHBondContact O-CB 3.29Å; F375-A379 PolarHBondContact O-N 3.4Å; F376-A379 WeakPolarHBondContact O-CB 3.23Å; F376-A379 PolarHBondContact O-N 2.94Å; A379-D382 PolarHBondContact O-N 2.91Å; A379-L383 WeakPolarHBondContact O-CG 3.42Å; A379-L383 PolarHBondContact O-N 3.37Å
380	F	98.2	Very high	96.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-44	174.1	-78.2	-63.2	0	0	0	112.7	M340 L354 I357 F376 L377 D382 L383 L384 F385 P387 L390	M340-F380 HydrophobicContact CE-CD1 3.7Å; M340-F380 HydrophobicContact CE-CD2 3.86Å; M340-F380 HydrophobicContact CE-CE1 3.69Å; M340-F380 HydrophobicContact CE-CE2 3.83Å; M340-F380 HydrophobicContact CE-CG 3.81Å; M340-F380 HydrophobicContact CE-CZ 3.75Å; L354-F380 HydrophobicContact CB-CE1 4.27Å; L354-F380 HydrophobicContact CD2-CE1 4.25Å; L354-F380 WeakPolarHBondContact O-CE1 3.4Å; I357-F380 HydrophobicContact CB-CZ 4.2Å; I357-F380 HydrophobicContact CG2-CE2 4.5Å; I357-F380 HydrophobicContact CG2-CZ 3.8Å; F376-F380 HydrophobicContact CB-CE2 4.49Å; F376-F380 WeakPolarHBondContact O-CD2 3.34Å; F376-F380 PolarHBondContact O-N 3.37Å; L377-F380 PolarHBondContact O-N 3.09Å; F380-D382 VanDerWaalsContact C-N 3.27Å; F380-D382 PolarHBondContact O-N 3.11Å; F380-L383 CarbonylContact O-C 3.52Å; F380-L383 PolarHBondContact O-N 2.99Å; F380-L383 VanDerWaalsContact O-N 3.11Å; F380-L384 PolarHBondContact O-N 3.27Å; F380-F385 CarbonylContact C-O 3.58Å; F380-F385 HydrophobicContact CD1-CB 4.25Å; F380-F385 AromaticContact CD1-CD1 3.45Å; F380-F385 HydrophobicContact CD1-CD1 3.45Å; F380-F385 VanDerWaalsContact CD1-CD1 3.45Å; F380-F385 HydrophobicContact CD1-CE1 4.23Å; F380-F385 HydrophobicContact CD1-CG 4.25Å; F380-F385 AromaticContact CE1-CD1 3.73Å; F380-F385 HydrophobicContact CE1-CD1 3.73Å; F380-F385 HydrophobicContact CE1-CE1 4.07Å; F380-F385 HydrophobicContact CG-CD1 4.37Å; F380-F385 PolarHBondContact O-N 3.25Å; F380-P387 HydrophobicContact CB-CB 4.41Å; F380-P387 HydrophobicContact CB-CG 3.73Å; F380-P387 HydrophobicContact CD1-CB 4.12Å; F380-P387 HydrophobicContact CD1-CG 4.35Å; F380-P387 HydrophobicContact CD2-CB 3.7Å; F380-P387 HydrophobicContact CD2-CG 3.57Å; F380-P387 HydrophobicContact CE1-CB 4.24Å; F380-P387 HydrophobicContact CE2-CB 3.86Å; F380-P387 HydrophobicContact CE2-CG 4.21Å; F380-P387 HydrophobicContact CG-CB 3.84Å; F380-P387 HydrophobicContact CG-CG 3.64Å; F380-P387 HydrophobicContact CZ-CB 4.11Å; F380-L390 HydrophobicContact CD2-CD2 4.35Å; F380-L390 HydrophobicContact CE2-CD2 4.11Å
381	K	96.8	Very high	96.9	Very high	42 Å²	42	24.1 Å²	24.1	18%	0.183	13%	0.126	C	C	.	.	H	α-helix	trans	-53.8	-46.3	172.5	177.7	-160	168	162.9	0	111.6	L377 S378 L383 L384 A415 T416 L420	L377-K381 WeakPolarHBondContact O-CB 3.13Å; L377-K381 PolarHBondContact O-N 3.17Å; S378-K381 WeakPolarHBondContact O-CB 3.26Å; S378-K381 PolarHBondContact O-N 2.9Å; K381-L383 VanDerWaalsContact C-N 3.29Å; K381-L383 PolarHBondContact O-N 3.34Å; K381-L384 WeakPolarHBondContact O-CA 3.37Å; K381-L384 PolarHBondContact O-N 2.99Å; K381-A415 WeakPolarHBondContact CE-O 3.31Å; K381-A415 PolarHBondContact NZ-O 3.35Å; K381-T416 HydrophobicContact CB-CG2 4.17Å; K381-L420 HydrophobicContact CB-CD1 4.36Å
382	D	95.9	Very high	96.9	Very high	62 Å²	62	23 Å²	23	33%	0.332	12%	0.122	S	C	.	.	H	α-helix	trans	-68.1	-29	-179.3	-78.9	-16.9	0	0	0	113	K344 S378 A379 F380 L384	K344-D382 HydrophobicContact CD-CB 3.73Å; K344-D382 HydrophobicContact CG-CB 4.31Å; K344-D382 IonicContact NZ-OD1 3.99Å; K344-D382 IonicContact NZ-OD2 3.15Å; K344-D382 PolarHBondContact NZ-OD2 3.18Å; S378-D382 PolarHBondContact O-N 3.24Å; A379-D382 PolarHBondContact O-N 2.91Å; F380-D382 VanDerWaalsContact C-N 3.27Å; F380-D382 PolarHBondContact O-N 3.11Å; D382-L384 PolarHBondContact O-N 3.32Å
383	L	96.3	Very high	96.9	Very high	5 Å²	5	22.7 Å²	22.7	3%	0.026	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	1.3	171.2	-68.8	164.9	0	0	0	113	M340 K344 R349 L354 A379 F380 K381 F385	M340-L383 HydrophobicContact CB-CD1 4.23Å; M340-L383 HydrophobicContact CE-CD1 4.03Å; K344-L383 HydrophobicContact CB-CD2 3.96Å; R349-L383 WeakPolarHBondContact CD-O 3.24Å; R349-L383 HydrophobicContact CG-CD2 4.21Å; L354-L383 HydrophobicContact CD2-CD1 3.77Å; A379-L383 WeakPolarHBondContact O-CG 3.42Å; A379-L383 PolarHBondContact O-N 3.37Å; F380-L383 CarbonylContact O-C 3.52Å; F380-L383 PolarHBondContact O-N 2.99Å; F380-L383 VanDerWaalsContact O-N 3.11Å; K381-L383 VanDerWaalsContact C-N 3.29Å; K381-L383 PolarHBondContact O-N 3.34Å; L383-F385 PolarHBondContact O-N 3Å
384	L	96.6	Very high	96.9	Very high	30 Å²	30	22.8 Å²	22.8	16%	0.157	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	23.4	-176.3	-45	-172.5	0	0	0	113.2	F380 K381 D382 C600 F601 R607	F380-L384 PolarHBondContact O-N 3.27Å; K381-L384 WeakPolarHBondContact O-CA 3.37Å; K381-L384 PolarHBondContact O-N 2.99Å; D382-L384 PolarHBondContact O-N 3.32Å; L384-C600 CarbonylContact O-C 3.53Å; L384-C600 VanDerWaalsContact O-CA 3.28Å; L384-C600 WeakPolarHBondContact O-CA 3.25Å; L384-F601 PolarHBondContact O-N 2.76Å; L384-R607 VanDerWaalsContact CD2-NH1 3.35Å
385	F	97.4	Very high	96.9	Very high	13 Å²	13	22.6 Å²	22.6	6%	0.057	12%	0.123	C	C	.	.			trans	-103	141.9	-178	-178	-95.4	0	0	0	110.4	T351 L354 F380 L383 P387 L420 F601	T351-F385 HydrophobicContact CG2-CE2 4.33Å; L354-F385 HydrophobicContact CB-CD1 3.97Å; L354-F385 HydrophobicContact CB-CD2 3.93Å; L354-F385 HydrophobicContact CB-CE1 3.94Å; L354-F385 HydrophobicContact CB-CE2 3.92Å; L354-F385 HydrophobicContact CB-CG 3.93Å; L354-F385 HydrophobicContact CB-CZ 3.92Å; L354-F385 HydrophobicContact CD1-CB 3.84Å; L354-F385 HydrophobicContact CD1-CD2 3.91Å; L354-F385 HydrophobicContact CD1-CG 3.88Å; F380-F385 CarbonylContact C-O 3.58Å; F380-F385 HydrophobicContact CD1-CB 4.25Å; F380-F385 AromaticContact CD1-CD1 3.45Å; F380-F385 HydrophobicContact CD1-CD1 3.45Å; F380-F385 VanDerWaalsContact CD1-CD1 3.45Å; F380-F385 HydrophobicContact CD1-CE1 4.23Å; F380-F385 HydrophobicContact CD1-CG 4.25Å; F380-F385 AromaticContact CE1-CD1 3.73Å; F380-F385 HydrophobicContact CE1-CD1 3.73Å; F380-F385 HydrophobicContact CE1-CE1 4.07Å; F380-F385 HydrophobicContact CG-CD1 4.37Å; F380-F385 PolarHBondContact O-N 3.25Å; L383-F385 PolarHBondContact O-N 3Å; F385-P387 HydrophobicContact CD1-CB 4.23Å; F385-P387 HydrophobicContact CE1-CB 4.18Å; F385-P387 VanDerWaalsContact O-CD 3.28Å; F385-P387 WeakPolarHBondContact O-CD 3.34Å; F385-L420 WeakPolarHBondContact O-CD1 3.49Å; F385-L420 WeakPolarHBondContact O-CD2 3.27Å; F385-F601 HydrophobicContact CD2-CD1 4.41Å
386	C	97	Very high	96.8	Very high	11 Å²	11	24.9 Å²	24.9	7%	0.074	14%	0.135	C	C	.	.			trans	-101.4	100.5	179.5	-166.1	0	0	0	0	110.1	T388 C600	C386-T388 VanDerWaalsContact C-N 3.34Å; C386-T388 PolarHBondContact O-N 3.4Å; C386-C600 HydrophobicContact CB-CB 3.98Å
387	P	97	Very high	96.7	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.15	C	C	.	.			trans	-84.6	75	-174.4	35.6	-35.6	0	0	0	110.6	S358 L377 F380 F385 S389 L390 M391	S358-P387 WeakPolarHBondContact OG-CB 3.35Å; L377-P387 HydrophobicContact CD2-CG 4.2Å; F380-P387 HydrophobicContact CB-CB 4.41Å; F380-P387 HydrophobicContact CB-CG 3.73Å; F380-P387 HydrophobicContact CD1-CB 4.12Å; F380-P387 HydrophobicContact CD1-CG 4.35Å; F380-P387 HydrophobicContact CD2-CB 3.7Å; F380-P387 HydrophobicContact CD2-CG 3.57Å; F380-P387 HydrophobicContact CE1-CB 4.24Å; F380-P387 HydrophobicContact CE2-CB 3.86Å; F380-P387 HydrophobicContact CE2-CG 4.21Å; F380-P387 HydrophobicContact CG-CB 3.84Å; F380-P387 HydrophobicContact CG-CG 3.64Å; F380-P387 HydrophobicContact CZ-CB 4.11Å; F385-P387 HydrophobicContact CD1-CB 4.23Å; F385-P387 HydrophobicContact CE1-CB 4.18Å; F385-P387 VanDerWaalsContact O-CD 3.28Å; F385-P387 WeakPolarHBondContact O-CD 3.34Å; P387-S389 VanDerWaalsContact C-N 3.3Å; P387-S389 PolarHBondContact O-N 3.4Å; P387-L390 HydrophobicContact CB-CB 4.24Å; P387-L390 PolarHBondContact O-N 3.23Å; P387-M391 HydrophobicContact CG-CG 4Å; P387-M391 HydrophobicContact CG-SD 4.26Å; P387-M391 WeakPolarHBondContact O-CG 3.42Å; P387-M391 PolarHBondContact O-N 3.5Å
388	T	94.8	Very high	96.6	Very high	64 Å²	64	28.3 Å²	28.3	39%	0.393	15%	0.15	S	C	.	.	H	α-helix	trans	-51.7	-45.8	-175	-57.4	0	0	0	0	112.7	C386 L390 M391 E392 Y422	C386-T388 VanDerWaalsContact C-N 3.34Å; C386-T388 PolarHBondContact O-N 3.4Å; T388-L390 PolarHBondContact O-N 3.48Å; T388-M391 PolarHBondContact O-N 2.89Å; T388-E392 PolarHBondContact O-N 3.01Å; T388-Y422 HydrophobicContact CG2-CE2 3.97Å
389	S	95.6	Very high	96.6	Very high	45 Å²	45	29.6 Å²	29.6	32%	0.315	15%	0.154	S	C	.	.	H	α-helix	trans	-59.8	-28.7	-179.3	-36.4	0	0	0	0	113.5	D359 A362 P387 P393	D359-S389 WeakPolarHBondContact OD1-CB 3.41Å; D359-S389 PolarHBondContact OD1-OG 2.9Å; A362-S389 WeakPolarHBondContact CB-O 3.49Å; P387-S389 VanDerWaalsContact C-N 3.3Å; P387-S389 PolarHBondContact O-N 3.4Å; S389-P393 WeakPolarHBondContact O-CD 3.43Å; S389-P393 WeakPolarHBondContact O-CG 3.42Å
390	L	96.9	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-90.6	-38.6	176.5	177.3	58.9	0	0	0	112	V361 F365 L373 F376 L377 F380 P387 T388 E392 P393 Y394	V361-L390 HydrophobicContact CG1-CD1 3.74Å; V361-L390 HydrophobicContact CG1-CD2 3.98Å; V361-L390 HydrophobicContact CG1-CG 4.48Å; F365-L390 HydrophobicContact CD2-CD1 3.99Å; F365-L390 HydrophobicContact CE2-CD1 4.1Å; L373-L390 HydrophobicContact CD2-CD1 3.97Å; F376-L390 HydrophobicContact CB-CD2 4.06Å; L377-L390 HydrophobicContact CD2-CD2 3.93Å; L377-L390 HydrophobicContact CD2-CG 4.06Å; L377-L390 HydrophobicContact CG-CD2 4.25Å; F380-L390 HydrophobicContact CD2-CD2 4.35Å; F380-L390 HydrophobicContact CE2-CD2 4.11Å; P387-L390 HydrophobicContact CB-CB 4.24Å; P387-L390 PolarHBondContact O-N 3.23Å; T388-L390 PolarHBondContact O-N 3.48Å; L390-E392 VanDerWaalsContact C-N 3.35Å; L390-P393 WeakPolarHBondContact O-CD 3.29Å; L390-Y394 VanDerWaalsContact O-CB 3.22Å; L390-Y394 WeakPolarHBondContact O-CB 3.48Å; L390-Y394 PolarHBondContact O-N 3.12Å
391	M	97	Very high	96.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.7	-32.6	-177.3	-70.1	-172.7	75.9	0	0	112.4	L377 P387 T388 T395 T416 Y417 L420 Y422	L377-M391 HydrophobicContact CD2-CG 3.7Å; P387-M391 HydrophobicContact CG-CG 4Å; P387-M391 HydrophobicContact CG-SD 4.26Å; P387-M391 WeakPolarHBondContact O-CG 3.42Å; P387-M391 PolarHBondContact O-N 3.5Å; T388-M391 PolarHBondContact O-N 2.89Å; M391-T395 WeakPolarHBondContact O-CB 3.33Å; M391-T395 PolarHBondContact O-N 3.49Å; M391-T395 PolarHBondContact O-OG1 2.68Å; M391-T416 HydrophobicContact CE-CG2 4.44Å; M391-Y417 HydrophobicContact CE-CD1 3.47Å; M391-Y417 VanDerWaalsContact CE-CD1 3.47Å; M391-Y417 HydrophobicContact CE-CD2 3.64Å; M391-Y417 HydrophobicContact CE-CE1 3.42Å; M391-Y417 VanDerWaalsContact CE-CE1 3.42Å; M391-Y417 HydrophobicContact CE-CE2 3.59Å; M391-Y417 HydrophobicContact CE-CG 3.59Å; M391-Y417 VanDerWaalsContact CE-CZ 3.5Å; M391-Y417 PolarHBondContact O-OH 2.65Å; M391-L420 HydrophobicContact SD-CD1 4.13Å; M391-Y422 HydrophobicContact CB-CD1 4.29Å; M391-Y422 HydrophobicContact CB-CD2 3.96Å; M391-Y422 HydrophobicContact CB-CE1 4.11Å; M391-Y422 HydrophobicContact CB-CE2 3.77Å; M391-Y422 HydrophobicContact CB-CG 4.22Å; M391-Y422 HydrophobicContact CE-CD1 4.12Å; M391-Y422 HydrophobicContact CE-CD2 4.16Å; M391-Y422 HydrophobicContact CE-CG 3.64Å; M391-Y422 HydrophobicContact CG-CD2 4.49Å; M391-Y422 HydrophobicContact SD-CD2 3.83Å; M391-Y422 HydrophobicContact SD-CG 3.95Å
392	E	95	Very high	96.1	Very high	89 Å²	89	36.6 Å²	36.6	42%	0.416	21%	0.206	S	C	.	.	H	α-helix	trans	-60.8	-62.2	177.3	-177.3	167.2	-153.8	0	0	112.3	T388 L390 Y394 T395 E396 Y422	T388-E392 PolarHBondContact O-N 3.01Å; L390-E392 VanDerWaalsContact C-N 3.35Å; E392-Y394 VanDerWaalsContact C-N 3.25Å; E392-Y394 PolarHBondContact O-N 2.6Å; E392-T395 WeakPolarHBondContact O-CB 3.28Å; E392-T395 PolarHBondContact O-N 3.16Å; E392-T395 VanDerWaalsContact O-N 3.07Å; E392-E396 PolarHBondContact O-N 3.09Å; E392-Y422 WeakPolarHBondContact CB-OH 3.44Å; E392-Y422 PolarHBondContact N-OH 3.5Å
393	P	96.3	Very high	95.9	Very high	35 Å²	35	37.8 Å²	37.8	23%	0.227	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-29.5	178.4	25.6	-35	0	0	0	112.8	F365 S389 L390 T395 E396 K397	F365-P393 HydrophobicContact CD2-CB 4.27Å; F365-P393 HydrophobicContact CD2-CG 4.12Å; F365-P393 HydrophobicContact CE2-CB 4.11Å; F365-P393 HydrophobicContact CE2-CG 4.13Å; F365-P393 HydrophobicContact CZ-CB 4.31Å; S389-P393 WeakPolarHBondContact O-CD 3.43Å; S389-P393 WeakPolarHBondContact O-CG 3.42Å; L390-P393 WeakPolarHBondContact O-CD 3.29Å; P393-T395 VanDerWaalsContact C-N 3.35Å; P393-E396 PolarHBondContact O-N 3.04Å; P393-K397 PolarHBondContact O-N 3.11Å
394	Y	97.1	Very high	95.6	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-68.7	-34.4	175.2	-162.7	-94.6	0	0	0	112.5	F365 L373 V374 L377 L390 E392 K397 V398 V413 Y417	F365-Y394 HydrophobicContact CE2-CD2 4.06Å; F365-Y394 HydrophobicContact CZ-CD2 4.05Å; L373-Y394 HydrophobicContact CB-CD2 3.92Å; L373-Y394 HydrophobicContact CB-CE2 3.62Å; L373-Y394 HydrophobicContact CD1-CD2 4.03Å; L373-Y394 HydrophobicContact CD1-CE2 4.01Å; L373-Y394 HydrophobicContact CG-CE2 4.46Å; V374-Y394 WeakPolarHBondContact CG2-OH 3.35Å; L377-Y394 HydrophobicContact CD1-CD1 3.53Å; L377-Y394 HydrophobicContact CD1-CD2 4.28Å; L377-Y394 HydrophobicContact CD1-CE1 3.71Å; L377-Y394 HydrophobicContact CD1-CE2 4.44Å; L377-Y394 HydrophobicContact CD1-CG 3.84Å; L390-Y394 VanDerWaalsContact O-CB 3.22Å; L390-Y394 WeakPolarHBondContact O-CB 3.48Å; L390-Y394 PolarHBondContact O-N 3.12Å; E392-Y394 VanDerWaalsContact C-N 3.25Å; E392-Y394 PolarHBondContact O-N 2.6Å; Y394-K397 PolarHBondContact O-N 2.91Å; Y394-V398 HydrophobicContact CD1-CG2 3.86Å; Y394-V398 HydrophobicContact CE1-CG2 3.52Å; Y394-V398 WeakPolarHBondContact O-CG2 3.4Å; Y394-V398 PolarHBondContact O-N 3.01Å; Y394-V413 HydrophobicContact CE1-CG1 4.45Å; Y394-V413 HydrophobicContact CE1-CG2 3.69Å; Y394-Y417 HydrophobicContact CD1-CE2 4.42Å
395	T	97.2	Very high	95.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-47.6	174.6	-59.9	0	0	0	0	110.2	M391 E392 P393 K397 V398 I399 Y417 L424 Q427 F431	M391-T395 WeakPolarHBondContact O-CB 3.33Å; M391-T395 PolarHBondContact O-N 3.49Å; M391-T395 PolarHBondContact O-OG1 2.68Å; E392-T395 WeakPolarHBondContact O-CB 3.28Å; E392-T395 PolarHBondContact O-N 3.16Å; E392-T395 VanDerWaalsContact O-N 3.07Å; P393-T395 VanDerWaalsContact C-N 3.35Å; T395-K397 VanDerWaalsContact C-N 3.34Å; T395-K397 PolarHBondContact O-N 2.69Å; T395-V398 PolarHBondContact O-N 3.29Å; T395-I399 HydrophobicContact CG2-CD1 3.95Å; T395-I399 WeakPolarHBondContact O-CG1 3.46Å; T395-I399 PolarHBondContact O-N 3.42Å; T395-Y417 WeakPolarHBondContact OG1-CE1 3.23Å; T395-Y417 PolarHBondContact OG1-OH 3.35Å; T395-L424 HydrophobicContact CG2-CD2 3.55Å; T395-Q427 HydrophobicContact CG2-CB 4.41Å; T395-F431 HydrophobicContact CG2-CB 4.16Å; T395-F431 HydrophobicContact CG2-CD2 3.58Å; T395-F431 HydrophobicContact CG2-CE2 4.14Å; T395-F431 HydrophobicContact CG2-CG 4Å
396	E	96	Very high	95.3	Very high	99 Å²	99	41.1 Å²	41.1	46%	0.463	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-42.5	177.5	-63.9	-177.7	169	0	0	111.9	E392 P393 V398 I399 A400 Q427	E392-E396 PolarHBondContact O-N 3.09Å; P393-E396 PolarHBondContact O-N 3.04Å; E396-V398 VanDerWaalsContact C-N 3.35Å; E396-V398 PolarHBondContact O-N 3.34Å; E396-I399 PolarHBondContact O-N 2.75Å; E396-A400 WeakPolarHBondContact O-CB 3.43Å; E396-A400 PolarHBondContact O-N 2.87Å; E396-Q427 PolarHBondContact OE1-NE2 3.22Å
397	K	95.6	Very high	95.2	Very high	71 Å²	71	41.7 Å²	41.7	31%	0.309	24%	0.243	S	C	.	.	H	α-helix	trans	-59.4	-43.7	175.9	-168.2	-179.6	-161.3	172.9	0	112.5	F365 D370 P393 Y394 T395 A400 N401	F365-K397 HydrophobicContact CE1-CB 4.45Å; F365-K397 HydrophobicContact CE1-CD 3.83Å; F365-K397 HydrophobicContact CZ-CB 4.2Å; F365-K397 HydrophobicContact CZ-CD 3.82Å; D370-K397 WeakPolarHBondContact OD1-CE 3.48Å; D370-K397 IonicContact OD1-NZ 2.82Å; D370-K397 PolarHBondContact OD1-NZ 3.27Å; P393-K397 PolarHBondContact O-N 3.11Å; Y394-K397 PolarHBondContact O-N 2.91Å; T395-K397 VanDerWaalsContact C-N 3.34Å; T395-K397 PolarHBondContact O-N 2.69Å; K397-A400 PolarHBondContact O-N 3.12Å; K397-N401 PolarHBondContact O-N 2.89Å; K397-N401 VanDerWaalsContact O-N 3.1Å
398	V	96.4	Very high	95.1	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-38.6	178.8	173.3	0	0	0	0	111.5	Y394 T395 E396 A400 P402 L405 F431 L435	Y394-V398 HydrophobicContact CD1-CG2 3.86Å; Y394-V398 HydrophobicContact CE1-CG2 3.52Å; Y394-V398 WeakPolarHBondContact O-CG2 3.4Å; Y394-V398 PolarHBondContact O-N 3.01Å; T395-V398 PolarHBondContact O-N 3.29Å; E396-V398 VanDerWaalsContact C-N 3.35Å; E396-V398 PolarHBondContact O-N 3.34Å; V398-A400 VanDerWaalsContact C-N 3.35Å; V398-P402 WeakPolarHBondContact O-CA 3.44Å; V398-P402 WeakPolarHBondContact O-CB 3.34Å; V398-P402 VanDerWaalsContact O-CD 3.29Å; V398-P402 WeakPolarHBondContact O-CD 3.19Å; V398-P402 VanDerWaalsContact O-N 3.14Å; V398-L405 HydrophobicContact CG1-CD1 4.32Å; V398-L405 HydrophobicContact CG2-CD1 4.08Å; V398-F431 HydrophobicContact CB-CD2 4.25Å; V398-F431 HydrophobicContact CB-CE2 3.87Å; V398-F431 HydrophobicContact CG1-CD2 4.09Å; V398-F431 HydrophobicContact CG1-CE2 3.75Å; V398-F431 HydrophobicContact CG2-CE2 4.36Å; V398-L435 HydrophobicContact CG1-CD2 3.79Å; V398-L435 HydrophobicContact CG1-CG 4.31Å
399	I	97.1	Very high	95.2	Very high	49 Å²	49	46.8 Å²	46.8	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-43.2	175	-68.1	166.1	0	0	0	110.5	T395 E396 Q427 A430 F431	T395-I399 HydrophobicContact CG2-CD1 3.95Å; T395-I399 WeakPolarHBondContact O-CG1 3.46Å; T395-I399 PolarHBondContact O-N 3.42Å; E396-I399 PolarHBondContact O-N 2.75Å; I399-Q427 HydrophobicContact CD1-CB 4.06Å; I399-A430 HydrophobicContact CD1-CB 4.18Å; I399-A430 HydrophobicContact CG1-CB 4.43Å; I399-A430 HydrophobicContact CG2-CB 4.28Å; I399-F431 HydrophobicContact CD1-CB 4.11Å; I399-F431 HydrophobicContact CG1-CB 4.08Å; I399-F431 HydrophobicContact CG1-CD2 4.27Å
400	A	96.1	Very high	95.2	Very high	85 Å²	85	44.6 Å²	44.6	70%	0.702	25%	0.245	S	C	*	.	H	α-helix	trans	-68.7	-36.6	-176.7	0	0	0	0	0	113.3	E396 K397 V398	E396-A400 WeakPolarHBondContact O-CB 3.43Å; E396-A400 PolarHBondContact O-N 2.87Å; K397-A400 PolarHBondContact O-N 3.12Å; V398-A400 VanDerWaalsContact C-N 3.35Å
401	N	94.2	Very high	95.1	Very high	89 Å²	89	45.6 Å²	45.6	48%	0.476	25%	0.25	S	C	.	.			trans	-148.4	74.7	-178.6	-169.4	1.9	0	0	0	112.5	K397 D403 A404	K397-N401 PolarHBondContact O-N 2.89Å; K397-N401 VanDerWaalsContact O-N 3.1Å; N401-D403 VanDerWaalsContact C-N 3.27Å; N401-D403 PolarHBondContact O-N 3.36Å; N401-A404 PolarHBondContact O-N 3.4Å; N401-A404 PolarHBondContact OD1-N 2.9Å
402	P	92.5	Very high	95.1	Very high	16 Å²	16	46.8 Å²	46.8	10%	0.104	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-67.9	-27.3	-177.5	27.4	-34.8	0	0	0	112.9	V398 A404 L405 S434 A438	V398-P402 WeakPolarHBondContact O-CA 3.44Å; V398-P402 WeakPolarHBondContact O-CB 3.34Å; V398-P402 VanDerWaalsContact O-CD 3.29Å; V398-P402 WeakPolarHBondContact O-CD 3.19Å; V398-P402 VanDerWaalsContact O-N 3.14Å; P402-A404 VanDerWaalsContact C-N 3.25Å; P402-A404 PolarHBondContact O-N 2.9Å; P402-L405 PolarHBondContact O-N 3.28Å; P402-S434 WeakPolarHBondContact CB-O 3.44Å; P402-A438 HydrophobicContact CB-CB 4.04Å
403	D	91	Very high	95.2	Very high	87 Å²	87	42.6 Å²	42.6	47%	0.465	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-74.5	-13.3	-177	-60.7	-32.1	0	0	0	113.2	N401 L405 H437	N401-D403 VanDerWaalsContact C-N 3.27Å; N401-D403 PolarHBondContact O-N 3.36Å; D403-L405 PolarHBondContact O-N 3.43Å; D403-H437 IonicContact OD1-CE1 3.67Å; D403-H437 IonicContact OD1-ND1 3.49Å; D403-H437 PolarHBondContact OD1-ND1 3.46Å; D403-H437 IonicContact OD2-CE1 3.81Å
404	A	91.2	Very high	95.2	Very high	49 Å²	49	41 Å²	41	41%	0.405	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-66.7	-21	171.7	0	0	0	0	0	113	N401 P402	N401-A404 PolarHBondContact O-N 3.4Å; N401-A404 PolarHBondContact OD1-N 2.9Å; P402-A404 VanDerWaalsContact C-N 3.25Å; P402-A404 PolarHBondContact O-N 2.9Å
405	L	92.8	Very high	95.2	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	23%	0.23	C	C	.	.	S	Bend	trans	-80.7	128.5	-178.1	-63	179	0	0	0	111.6	V398 P402 D403 H409 L410 V413 Y442	V398-L405 HydrophobicContact CG1-CD1 4.32Å; V398-L405 HydrophobicContact CG2-CD1 4.08Å; P402-L405 PolarHBondContact O-N 3.28Å; D403-L405 PolarHBondContact O-N 3.43Å; L405-H409 HydrophobicContact CB-CB 4.49Å; L405-H409 HydrophobicContact CD2-CB 4.18Å; L405-L410 HydrophobicContact CB-CB 4.47Å; L405-L410 HydrophobicContact CD1-CD1 4.05Å; L405-V413 HydrophobicContact CD1-CG2 4.43Å; L405-Y442 PolarHBondContact O-OH 3.39Å
406	T	94.8	Very high	95.3	Very high	65 Å²	65	41.2 Å²	41.2	40%	0.399	23%	0.23	S	C	.	.			trans	-65.1	152.8	164	71.5	0	0	0	0	110.4	K408 H409 L410	T406-K408 PolarHBondContact O-N 3.2Å; T406-K408 VanDerWaalsContact O-N 3.12Å; T406-H409 WeakPolarHBondContact O-CA 3.35Å; T406-H409 WeakPolarHBondContact O-CB 3.44Å; T406-H409 PolarHBondContact O-N 3.43Å; T406-H409 PolarHBondContact OG1-N 2.97Å; T406-H409 PolarHBondContact OG1-ND1 3.11Å; T406-L410 PolarHBondContact O-N 3.07Å
407	L	95.3	Very high	95.3	Very high	23 Å²	23	36.8 Å²	36.8	12%	0.12	21%	0.209	C	C	.	.	H	α-helix	trans	-49.1	-42.2	175.6	177.5	60.6	0	0	0	112.7	H409 L410 M411 L439 Y442 M446	L407-H409 VanDerWaalsContact C-N 3.35Å; L407-H409 PolarHBondContact O-N 2.61Å; L407-L410 PolarHBondContact O-N 3.38Å; L407-M411 HydrophobicContact CD1-CG 4.15Å; L407-M411 HydrophobicContact CG-CG 4.49Å; L407-M411 VanDerWaalsContact O-CG 3.27Å; L407-M411 WeakPolarHBondContact O-CG 3.43Å; L407-M411 PolarHBondContact O-N 3.5Å; L407-L439 HydrophobicContact CD1-CD2 4.48Å; L407-Y442 HydrophobicContact CB-CD1 4.07Å; L407-Y442 HydrophobicContact CB-CD2 4.34Å; L407-Y442 HydrophobicContact CB-CE1 4.32Å; L407-Y442 HydrophobicContact CB-CG 4.09Å; L407-Y442 HydrophobicContact CD1-CD2 4.49Å; L407-Y442 HydrophobicContact CD1-CG 4.28Å; L407-M446 HydrophobicContact CD1-CE 4.2Å; L407-M446 HydrophobicContact CD1-CG 3.92Å; L407-M446 HydrophobicContact CD1-SD 4.1Å; L407-M446 HydrophobicContact CD2-CG 3.81Å
408	K	95.3	Very high	95.4	Very high	145 Å²	145	33.7 Å²	33.7	63%	0.63	20%	0.196	S	C	*	.	H	α-helix	trans	-61.8	-41.6	178	-176.7	179.6	177.8	179.9	0	112.5	T406 S412	T406-K408 PolarHBondContact O-N 3.2Å; T406-K408 VanDerWaalsContact O-N 3.12Å; K408-S412 PolarHBondContact O-N 2.89Å
409	H	95.5	Very high	95.4	Very high	26 Å²	26	34.6 Å²	34.6	12%	0.12	20%	0.203	C	C	.	.	H	α-helix	trans	-69.3	-43.1	177.6	-65.9	163.7	0	0	0	110.8	V374 L405 T406 L407 M411 S412 V413	V374-H409 HydrophobicContact CG1-CB 4.49Å; V374-H409 HydrophobicContact CG2-CB 4.05Å; L405-H409 HydrophobicContact CB-CB 4.49Å; L405-H409 HydrophobicContact CD2-CB 4.18Å; T406-H409 WeakPolarHBondContact O-CA 3.35Å; T406-H409 WeakPolarHBondContact O-CB 3.44Å; T406-H409 PolarHBondContact O-N 3.43Å; T406-H409 PolarHBondContact OG1-N 2.97Å; T406-H409 PolarHBondContact OG1-ND1 3.11Å; L407-H409 VanDerWaalsContact C-N 3.35Å; L407-H409 PolarHBondContact O-N 2.61Å; H409-M411 VanDerWaalsContact C-N 3.35Å; H409-M411 PolarHBondContact O-N 3.36Å; H409-S412 WeakPolarHBondContact O-CA 3.49Å; H409-S412 VanDerWaalsContact O-CB 3.29Å; H409-S412 WeakPolarHBondContact O-CB 3.18Å; H409-S412 PolarHBondContact O-N 3.38Å; H409-V413 WeakPolarHBondContact O-CG2 3.35Å; H409-V413 PolarHBondContact O-N 2.75Å
410	L	95.4	Very high	95.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.8	-45.8	176.9	-169.5	59.6	0	0	0	112.1	L405 T406 L407 S412 V413 L414 L435 A438 L439 Y442	L405-L410 HydrophobicContact CB-CB 4.47Å; L405-L410 HydrophobicContact CD1-CD1 4.05Å; T406-L410 PolarHBondContact O-N 3.07Å; L407-L410 PolarHBondContact O-N 3.38Å; L410-S412 VanDerWaalsContact C-N 3.28Å; L410-S412 PolarHBondContact O-N 2.87Å; L410-V413 PolarHBondContact O-N 3.43Å; L410-L414 WeakPolarHBondContact O-CG 3.44Å; L410-L414 PolarHBondContact O-N 2.94Å; L410-L435 HydrophobicContact CD1-CD2 3.36Å; L410-A438 HydrophobicContact CD1-CB 4.29Å; L410-A438 HydrophobicContact CD2-CB 3.82Å; L410-L439 HydrophobicContact CD2-CB 4.25Å; L410-L439 HydrophobicContact CD2-CD2 3.54Å; L410-L439 HydrophobicContact CD2-CG 3.6Å; L410-L439 HydrophobicContact CG-CD2 3.85Å; L410-L439 HydrophobicContact CG-CG 4Å; L410-Y442 HydrophobicContact CD2-CD2 4.24Å
411	M	96	Very high	95.3	Very high	21 Å²	21	30.4 Å²	30.4	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-36.5	173.6	-69.5	-55.7	-66.2	0	0	112.7	L407 H409 L414 A415 L439 M446 E450 K453 A454 Y457	L407-M411 HydrophobicContact CD1-CG 4.15Å; L407-M411 HydrophobicContact CG-CG 4.49Å; L407-M411 VanDerWaalsContact O-CG 3.27Å; L407-M411 WeakPolarHBondContact O-CG 3.43Å; L407-M411 PolarHBondContact O-N 3.5Å; H409-M411 VanDerWaalsContact C-N 3.35Å; H409-M411 PolarHBondContact O-N 3.36Å; M411-L414 HydrophobicContact SD-CD1 4.25Å; M411-A415 WeakPolarHBondContact O-CB 3.35Å; M411-A415 PolarHBondContact O-N 3.38Å; M411-L439 HydrophobicContact SD-CD2 4.33Å; M411-M446 HydrophobicContact SD-CE 4.35Å; M411-E450 WeakPolarHBondContact CE-O 3.23Å; M411-K453 HydrophobicContact CE-CB 3.42Å; M411-K453 VanDerWaalsContact CE-CB 3.42Å; M411-K453 HydrophobicContact CE-CD 4.41Å; M411-A454 HydrophobicContact CE-CB 4.22Å; M411-A454 HydrophobicContact SD-CB 4.02Å; M411-Y457 HydrophobicContact CE-CD2 4.46Å; M411-Y457 HydrophobicContact CE-CE2 4.33Å
412	S	97	Very high	95.3	Very high	25 Å²	25	27.3 Å²	27.3	18%	0.175	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-44.9	176.6	-167.1	0	0	0	0	111.9	V374 S378 K408 H409 L410 A415 T416	V374-S412 WeakPolarHBondContact CG1-OG 3.47Å; S378-S412 PolarHBondContact OG-OG 3.07Å; K408-S412 PolarHBondContact O-N 2.89Å; H409-S412 WeakPolarHBondContact O-CA 3.49Å; H409-S412 VanDerWaalsContact O-CB 3.29Å; H409-S412 WeakPolarHBondContact O-CB 3.18Å; H409-S412 PolarHBondContact O-N 3.38Å; L410-S412 VanDerWaalsContact C-N 3.28Å; L410-S412 PolarHBondContact O-N 2.87Å; S412-A415 PolarHBondContact O-N 3.4Å; S412-T416 WeakPolarHBondContact O-CB 3.38Å; S412-T416 PolarHBondContact O-N 3.47Å; S412-T416 PolarHBondContact O-OG1 3.35Å; S412-T416 VanDerWaalsContact O-OG1 3.11Å
413	V	97.1	Very high	95.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-59.2	-51.9	176.6	173.2	0	0	0	0	110	V374 Y394 L405 H409 L410 A415 T416 Y417 F431 L435	V374-V413 HydrophobicContact CG2-CG2 4.21Å; Y394-V413 HydrophobicContact CE1-CG1 4.45Å; Y394-V413 HydrophobicContact CE1-CG2 3.69Å; L405-V413 HydrophobicContact CD1-CG2 4.43Å; H409-V413 WeakPolarHBondContact O-CG2 3.35Å; H409-V413 PolarHBondContact O-N 2.75Å; L410-V413 PolarHBondContact O-N 3.43Å; V413-A415 VanDerWaalsContact C-N 3.3Å; V413-A415 PolarHBondContact O-N 3.07Å; V413-T416 PolarHBondContact O-N 2.66Å; V413-T416 VanDerWaalsContact O-N 3.08Å; V413-Y417 HydrophobicContact CG1-CD2 3.77Å; V413-Y417 HydrophobicContact CG1-CE2 3.85Å; V413-Y417 WeakPolarHBondContact O-CD2 3.38Å; V413-Y417 PolarHBondContact O-N 3.42Å; V413-F431 HydrophobicContact CG1-CZ 4.02Å; V413-L435 HydrophobicContact CG1-CD2 4.08Å
414	L	96.6	Very high	95.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-53.4	-48.3	174.3	-73.8	164.6	0	0	0	111.9	L410 M411 T416 S418 L435 L439 Y457 L458 M461	L410-L414 WeakPolarHBondContact O-CG 3.44Å; L410-L414 PolarHBondContact O-N 2.94Å; M411-L414 HydrophobicContact SD-CD1 4.25Å; L414-T416 VanDerWaalsContact C-N 3.26Å; L414-T416 PolarHBondContact O-N 3.35Å; L414-S418 WeakPolarHBondContact O-CB 3.06Å; L414-S418 PolarHBondContact O-N 3.3Å; L414-L435 HydrophobicContact CD2-CB 4.49Å; L414-L435 HydrophobicContact CD2-CD1 3.84Å; L414-L439 HydrophobicContact CD1-CD1 3.51Å; L414-L439 HydrophobicContact CD1-CD2 3.82Å; L414-L439 HydrophobicContact CD1-CG 4.06Å; L414-L439 HydrophobicContact CD2-CD1 4.36Å; L414-L439 HydrophobicContact CG-CD1 4.49Å; L414-Y457 HydrophobicContact CB-CD2 4.14Å; L414-Y457 HydrophobicContact CB-CG 4.42Å; L414-L458 HydrophobicContact CD2-CD2 3.56Å; L414-L458 HydrophobicContact CD2-CG 4.09Å; L414-M461 HydrophobicContact CD2-CE 3.8Å
415	A	97.1	Very high	95.4	Very high	7 Å²	7	33 Å²	33	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-66.4	-28.2	-178.2	0	0	0	0	0	112.9	K381 M411 S412 V413 S419 Y457	K381-A415 WeakPolarHBondContact CE-O 3.31Å; K381-A415 PolarHBondContact NZ-O 3.35Å; M411-A415 WeakPolarHBondContact O-CB 3.35Å; M411-A415 PolarHBondContact O-N 3.38Å; S412-A415 PolarHBondContact O-N 3.4Å; V413-A415 VanDerWaalsContact C-N 3.3Å; V413-A415 PolarHBondContact O-N 3.07Å; A415-S419 WeakPolarHBondContact O-CB 3.48Å; A415-S419 PolarHBondContact O-N 3.27Å; A415-Y457 HydrophobicContact CB-CD1 4.37Å; A415-Y457 HydrophobicContact CB-CD2 4.11Å; A415-Y457 HydrophobicContact CB-CE1 3.85Å; A415-Y457 HydrophobicContact CB-CE2 3.55Å; A415-Y457 VanDerWaalsContact CB-CZ 3.43Å
416	T	97.6	Very high	95.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-79.3	-53.9	177.2	-65.9	0	0	0	0	111.2	L377 K381 M391 S412 V413 L414 S418 S419 L420	L377-T416 HydrophobicContact CB-CG2 4.19Å; K381-T416 HydrophobicContact CB-CG2 4.17Å; M391-T416 HydrophobicContact CE-CG2 4.44Å; S412-T416 WeakPolarHBondContact O-CB 3.38Å; S412-T416 PolarHBondContact O-N 3.47Å; S412-T416 PolarHBondContact O-OG1 3.35Å; S412-T416 VanDerWaalsContact O-OG1 3.11Å; V413-T416 PolarHBondContact O-N 2.66Å; V413-T416 VanDerWaalsContact O-N 3.08Å; L414-T416 VanDerWaalsContact C-N 3.26Å; L414-T416 PolarHBondContact O-N 3.35Å; T416-S418 PolarHBondContact O-N 3.39Å; T416-S419 PolarHBondContact O-N 3.35Å; T416-S419 VanDerWaalsContact O-N 3.14Å; T416-L420 HydrophobicContact CG2-CD1 3.72Å; T416-L420 HydrophobicContact CG2-CG 4.46Å; T416-L420 WeakPolarHBondContact O-CB 3.2Å; T416-L420 PolarHBondContact O-N 3.35Å
417	Y	97.3	Very high	95.3	Very high	6 Å²	6	39.2 Å²	39.2	2%	0.024	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-42	-179	-80.7	-105.5	0	0	0	111.8	M391 Y394 T395 V413 S419 N421 Y422 L424 F431	M391-Y417 HydrophobicContact CE-CD1 3.47Å; M391-Y417 VanDerWaalsContact CE-CD1 3.47Å; M391-Y417 HydrophobicContact CE-CD2 3.64Å; M391-Y417 HydrophobicContact CE-CE1 3.42Å; M391-Y417 VanDerWaalsContact CE-CE1 3.42Å; M391-Y417 HydrophobicContact CE-CE2 3.59Å; M391-Y417 HydrophobicContact CE-CG 3.59Å; M391-Y417 VanDerWaalsContact CE-CZ 3.5Å; M391-Y417 PolarHBondContact O-OH 2.65Å; Y394-Y417 HydrophobicContact CD1-CE2 4.42Å; T395-Y417 WeakPolarHBondContact OG1-CE1 3.23Å; T395-Y417 PolarHBondContact OG1-OH 3.35Å; V413-Y417 HydrophobicContact CG1-CD2 3.77Å; V413-Y417 HydrophobicContact CG1-CE2 3.85Å; V413-Y417 WeakPolarHBondContact O-CD2 3.38Å; V413-Y417 PolarHBondContact O-N 3.42Å; Y417-S419 PolarHBondContact O-N 2.99Å; Y417-N421 WeakPolarHBondContact O-CA 3.36Å; Y417-N421 PolarHBondContact O-N 3.37Å; Y417-Y422 HydrophobicContact CD1-CD1 4.05Å; Y417-Y422 HydrophobicContact CD1-CG 4.5Å; Y417-Y422 AromaticContact CE1-CD1 3.74Å; Y417-Y422 HydrophobicContact CE1-CD1 3.74Å; Y417-Y422 HydrophobicContact CE1-CE1 4.37Å; Y417-Y422 HydrophobicContact CE1-CG 4.42Å; Y417-L424 HydrophobicContact CD1-CD2 4.04Å; Y417-L424 HydrophobicContact CE1-CD2 3.83Å; Y417-F431 AromaticContact CD1-CE1 3.64Å; Y417-F431 HydrophobicContact CD1-CE1 3.64Å; Y417-F431 AromaticContact CD1-CZ 3.65Å; Y417-F431 HydrophobicContact CD1-CZ 3.65Å; Y417-F431 AromaticContact CD2-CZ 3.97Å; Y417-F431 HydrophobicContact CD2-CZ 3.97Å; Y417-F431 AromaticContact CE1-CE1 3.99Å; Y417-F431 HydrophobicContact CE1-CE1 3.99Å; Y417-F431 HydrophobicContact CE1-CE2 4.21Å; Y417-F431 AromaticContact CE1-CZ 3.62Å; Y417-F431 HydrophobicContact CE1-CZ 3.62Å; Y417-F431 AromaticContact CE2-CZ 3.95Å; Y417-F431 HydrophobicContact CE2-CZ 3.95Å; Y417-F431 AromaticContact CG-CE1 3.92Å; Y417-F431 HydrophobicContact CG-CE1 3.92Å; Y417-F431 AromaticContact CG-CZ 3.82Å; Y417-F431 HydrophobicContact CG-CZ 3.82Å; Y417-F431 AromaticContact CZ-CZ 3.76Å
418	S	96.6	Very high	95.3	Very high	5 Å²	5	42.5 Å²	42.5	4%	0.035	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-40.1	174	-175.7	0	0	0	0	111.9	L414 T416 Y457 G608	L414-S418 WeakPolarHBondContact O-CB 3.06Å; L414-S418 PolarHBondContact O-N 3.3Å; T416-S418 PolarHBondContact O-N 3.39Å; S418-Y457 PolarHBondContact OG-O 3.3Å; S418-G608 WeakPolarHBondContact O-CA 3.41Å
419	S	96.3	Very high	95.3	Very high	23 Å²	23	40.8 Å²	40.8	16%	0.161	19%	0.19	C	C	.	.	H	α-helix	trans	-76.2	-39.8	-176.9	-179	0	0	0	0	113.9	A415 T416 Y417 N421 R607 G608	A415-S419 WeakPolarHBondContact O-CB 3.48Å; A415-S419 PolarHBondContact O-N 3.27Å; T416-S419 PolarHBondContact O-N 3.35Å; T416-S419 VanDerWaalsContact O-N 3.14Å; Y417-S419 PolarHBondContact O-N 2.99Å; S419-N421 VanDerWaalsContact C-N 3.33Å; S419-R607 VanDerWaalsContact O-CB 3.3Å; S419-R607 WeakPolarHBondContact O-CB 3.41Å; S419-R607 PolarHBondContact O-NE 3.36Å; S419-R607 PolarHBondContact OG-NH2 2.69Å; S419-G608 PolarHBondContact O-N 2.76Å
420	L	96.4	Very high	95.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-84.9	-13.3	-178.8	-66.7	175.9	0	0	0	111.9	K381 F385 M391 T416 Y422 C600	K381-L420 HydrophobicContact CB-CD1 4.36Å; F385-L420 WeakPolarHBondContact O-CD1 3.49Å; F385-L420 WeakPolarHBondContact O-CD2 3.27Å; M391-L420 HydrophobicContact SD-CD1 4.13Å; T416-L420 HydrophobicContact CG2-CD1 3.72Å; T416-L420 HydrophobicContact CG2-CG 4.46Å; T416-L420 WeakPolarHBondContact O-CB 3.2Å; T416-L420 PolarHBondContact O-N 3.35Å; L420-Y422 VanDerWaalsContact C-N 3.26Å; L420-Y422 PolarHBondContact O-N 3.2Å; L420-C600 PolarHBondContact O-SG 2.84Å; L420-C600 VanDerWaalsContact O-SG 3.39Å
421	N	95.4	Very high	95.4	Very high	46 Å²	46	41.6 Å²	41.6	25%	0.246	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	47.8	-179	-176	51.5	0	0	0	111.4	Y417 S419 D423 Q605 P606 T611	Y417-N421 WeakPolarHBondContact O-CA 3.36Å; Y417-N421 PolarHBondContact O-N 3.37Å; S419-N421 VanDerWaalsContact C-N 3.33Å; N421-D423 PolarHBondContact O-N 3.49Å; N421-Q605 PolarHBondContact O-NE2 2.92Å; N421-P606 WeakPolarHBondContact CB-O 3.46Å; N421-P606 PolarHBondContact ND2-O 3.2Å; N421-P606 VanDerWaalsContact ND2-O 3.13Å; N421-T611 PolarHBondContact ND2-OG1 2.89Å
422	Y	95.1	Very high	95.5	Very high	24 Å²	24	40.8 Å²	40.8	9%	0.094	20%	0.197	C	C	.	.			trans	-60.9	134.6	-179.9	178.3	-106.4	0	0	0	110.7	T388 M391 E392 Y417 L420 L424	T388-Y422 HydrophobicContact CG2-CE2 3.97Å; M391-Y422 HydrophobicContact CB-CD1 4.29Å; M391-Y422 HydrophobicContact CB-CD2 3.96Å; M391-Y422 HydrophobicContact CB-CE1 4.11Å; M391-Y422 HydrophobicContact CB-CE2 3.77Å; M391-Y422 HydrophobicContact CB-CG 4.22Å; M391-Y422 HydrophobicContact CE-CD1 4.12Å; M391-Y422 HydrophobicContact CE-CD2 4.16Å; M391-Y422 HydrophobicContact CE-CG 3.64Å; M391-Y422 HydrophobicContact CG-CD2 4.49Å; M391-Y422 HydrophobicContact SD-CD2 3.83Å; M391-Y422 HydrophobicContact SD-CG 3.95Å; E392-Y422 WeakPolarHBondContact CB-OH 3.44Å; E392-Y422 PolarHBondContact N-OH 3.5Å; Y417-Y422 HydrophobicContact CD1-CD1 4.05Å; Y417-Y422 HydrophobicContact CD1-CG 4.5Å; Y417-Y422 AromaticContact CE1-CD1 3.74Å; Y417-Y422 HydrophobicContact CE1-CD1 3.74Å; Y417-Y422 HydrophobicContact CE1-CE1 4.37Å; Y417-Y422 HydrophobicContact CE1-CG 4.42Å; L420-Y422 VanDerWaalsContact C-N 3.26Å; L420-Y422 PolarHBondContact O-N 3.2Å; Y422-L424 HydrophobicContact CD1-CD2 3.81Å; Y422-L424 HydrophobicContact CD1-CG 4.09Å; Y422-L424 HydrophobicContact CE1-CD2 4.06Å; Y422-L424 PolarHBondContact O-N 2.99Å; Y422-L424 VanDerWaalsContact O-N 3.16Å
423	D	92.1	Very high	95.4	Very high	91 Å²	91	43 Å²	43	49%	0.487	21%	0.207	S	C	.	.			trans	-79.8	98.4	178.6	179.5	19.3	0	0	0	110.1	N421 R425	N421-D423 PolarHBondContact O-N 3.49Å; D423-R425 PolarHBondContact O-N 3.04Å; D423-R425 PolarHBondContact OD1-N 3.13Å; D423-R425 WeakPolarHBondContact OD2-CG 3.28Å; D423-R425 IonicContact OD2-NE 3.9Å
424	L	91.6	Very high	95.3	Very high	9 Å²	9	44 Å²	44	5%	0.047	21%	0.214	C	C	.	.			trans	-73	-5.2	177.8	-68.1	162.9	0	0	0	113.3	T395 Y417 Y422 H426 Q427 R428 F431	T395-L424 HydrophobicContact CG2-CD2 3.55Å; Y417-L424 HydrophobicContact CD1-CD2 4.04Å; Y417-L424 HydrophobicContact CE1-CD2 3.83Å; Y422-L424 HydrophobicContact CD1-CD2 3.81Å; Y422-L424 HydrophobicContact CD1-CG 4.09Å; Y422-L424 HydrophobicContact CE1-CD2 4.06Å; Y422-L424 PolarHBondContact O-N 2.99Å; Y422-L424 VanDerWaalsContact O-N 3.16Å; L424-H426 PolarHBondContact O-N 3.24Å; L424-Q427 WeakPolarHBondContact O-CB 3.32Å; L424-Q427 PolarHBondContact O-N 2.8Å; L424-R428 HydrophobicContact CB-CB 3.83Å; L424-R428 HydrophobicContact CB-CG 4.37Å; L424-R428 HydrophobicContact CD1-CG 4.31Å; L424-R428 PolarHBondContact O-N 3.42Å; L424-F431 HydrophobicContact CD1-CB 4.41Å; L424-F431 HydrophobicContact CD1-CD1 3.51Å; L424-F431 HydrophobicContact CD1-CE1 4.08Å; L424-F431 HydrophobicContact CD1-CG 4.25Å; L424-F431 HydrophobicContact CD2-CB 4.31Å; L424-F431 HydrophobicContact CD2-CD1 3.85Å; L424-F431 HydrophobicContact CD2-CE1 4.22Å; L424-F431 HydrophobicContact CD2-CG 4.01Å; L424-F431 HydrophobicContact CG-CD1 4.36Å
425	R	92.4	Very high	95.3	Very high	172 Å²	172	44 Å²	44	65%	0.649	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	46.4	-127.1	-179.8	-58.7	176.7	179.1	172	0.5	111.5	D423 Q427 R428	D423-R425 PolarHBondContact O-N 3.04Å; D423-R425 PolarHBondContact OD1-N 3.13Å; D423-R425 WeakPolarHBondContact OD2-CG 3.28Å; D423-R425 IonicContact OD2-NE 3.9Å; R425-Q427 VanDerWaalsContact C-N 3.29Å; R425-Q427 PolarHBondContact O-N 3.47Å; R425-R428 WeakPolarHBondContact O-CB 3.31Å; R425-R428 PolarHBondContact O-N 3.23Å
426	H	91.3	Very high	95.1	Very high	165 Å²	165	44 Å²	44	76%	0.764	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-71.4	-18.5	-179.1	63	-86.6	0	0	0	113.8	L424 R428	L424-H426 PolarHBondContact O-N 3.24Å; H426-R428 VanDerWaalsContact C-N 3.3Å; H426-R428 PolarHBondContact O-N 2.73Å
427	Q	94.2	Very high	95	Very high	35 Å²	35	49.3 Å²	49.3	16%	0.164	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-83.9	-5	-179.1	-60.7	-178.7	-12.5	0	0	113.1	T395 E396 I399 L424 R425 Q429 A430 F431	T395-Q427 HydrophobicContact CG2-CB 4.41Å; E396-Q427 PolarHBondContact OE1-NE2 3.22Å; I399-Q427 HydrophobicContact CD1-CB 4.06Å; L424-Q427 WeakPolarHBondContact O-CB 3.32Å; L424-Q427 PolarHBondContact O-N 2.8Å; R425-Q427 VanDerWaalsContact C-N 3.29Å; R425-Q427 PolarHBondContact O-N 3.47Å; Q427-Q429 PolarHBondContact O-N 2.9Å; Q427-A430 PolarHBondContact O-N 3.14Å; Q427-F431 WeakPolarHBondContact O-CB 3.42Å; Q427-F431 PolarHBondContact O-N 3.32Å
428	R	95	Very high	94.9	Very high	91 Å²	91	49 Å²	49	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-50.3	-52	-173.5	-177.2	-177.3	-178.6	88.1	1.5	113.5	L424 R425 H426 L432 M461	L424-R428 HydrophobicContact CB-CB 3.83Å; L424-R428 HydrophobicContact CB-CG 4.37Å; L424-R428 HydrophobicContact CD1-CG 4.31Å; L424-R428 PolarHBondContact O-N 3.42Å; R425-R428 WeakPolarHBondContact O-CB 3.31Å; R425-R428 PolarHBondContact O-N 3.23Å; H426-R428 VanDerWaalsContact C-N 3.3Å; H426-R428 PolarHBondContact O-N 2.73Å; R428-L432 HydrophobicContact CG-CD1 3.86Å; R428-L432 WeakPolarHBondContact O-CB 3.3Å; R428-L432 VanDerWaalsContact O-CG 3.25Å; R428-L432 WeakPolarHBondContact O-CG 3.49Å; R428-L432 PolarHBondContact O-N 2.91Å; R428-M461 PolarHBondContact NH2-O 3.33Å
429	Q	94.9	Very high	94.8	Very high	109 Å²	109	48.8 Å²	48.8	51%	0.509	24%	0.236	S	C	.	.	H	α-helix	trans	-66.7	-50.7	-175	-171.1	59.9	37.2	0	0	111	Q427 F431 L432 D433	Q427-Q429 PolarHBondContact O-N 2.9Å; Q429-F431 VanDerWaalsContact C-N 3.29Å; Q429-F431 PolarHBondContact O-N 2.85Å; Q429-L432 PolarHBondContact O-N 2.97Å; Q429-D433 WeakPolarHBondContact CG-OD2 3.44Å; Q429-D433 PolarHBondContact NE2-OD1 2.82Å; Q429-D433 PolarHBondContact NE2-OD2 3.46Å; Q429-D433 WeakPolarHBondContact O-CB 3.14Å; Q429-D433 VanDerWaalsContact O-CG 3.26Å; Q429-D433 PolarHBondContact O-N 3.49Å
430	A	96.9	Very high	94.7	Very high	44 Å²	44	51.3 Å²	51.3	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-56.7	-41.9	178.4	0	0	0	0	0	112.3	I399 Q427 S434	I399-A430 HydrophobicContact CD1-CB 4.18Å; I399-A430 HydrophobicContact CG1-CB 4.43Å; I399-A430 HydrophobicContact CG2-CB 4.28Å; Q427-A430 PolarHBondContact O-N 3.14Å; A430-S434 VanDerWaalsContact O-CB 3.28Å; A430-S434 WeakPolarHBondContact O-CB 3.23Å; A430-S434 PolarHBondContact O-N 3.5Å; A430-S434 PolarHBondContact O-OG 3Å
431	F	97.6	Very high	94.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-65.2	-48.2	177.3	-178.9	-105.3	0	0	0	112.6	T395 V398 I399 V413 Y417 L424 Q427 Q429 D433 S434 L435	T395-F431 HydrophobicContact CG2-CB 4.16Å; T395-F431 HydrophobicContact CG2-CD2 3.58Å; T395-F431 HydrophobicContact CG2-CE2 4.14Å; T395-F431 HydrophobicContact CG2-CG 4Å; V398-F431 HydrophobicContact CB-CD2 4.25Å; V398-F431 HydrophobicContact CB-CE2 3.87Å; V398-F431 HydrophobicContact CG1-CD2 4.09Å; V398-F431 HydrophobicContact CG1-CE2 3.75Å; V398-F431 HydrophobicContact CG2-CE2 4.36Å; I399-F431 HydrophobicContact CD1-CB 4.11Å; I399-F431 HydrophobicContact CG1-CB 4.08Å; I399-F431 HydrophobicContact CG1-CD2 4.27Å; V413-F431 HydrophobicContact CG1-CZ 4.02Å; Y417-F431 AromaticContact CD1-CE1 3.64Å; Y417-F431 HydrophobicContact CD1-CE1 3.64Å; Y417-F431 AromaticContact CD1-CZ 3.65Å; Y417-F431 HydrophobicContact CD1-CZ 3.65Å; Y417-F431 AromaticContact CD2-CZ 3.97Å; Y417-F431 HydrophobicContact CD2-CZ 3.97Å; Y417-F431 AromaticContact CE1-CE1 3.99Å; Y417-F431 HydrophobicContact CE1-CE1 3.99Å; Y417-F431 HydrophobicContact CE1-CE2 4.21Å; Y417-F431 AromaticContact CE1-CZ 3.62Å; Y417-F431 HydrophobicContact CE1-CZ 3.62Å; Y417-F431 AromaticContact CE2-CZ 3.95Å; Y417-F431 HydrophobicContact CE2-CZ 3.95Å; Y417-F431 AromaticContact CG-CE1 3.92Å; Y417-F431 HydrophobicContact CG-CE1 3.92Å; Y417-F431 AromaticContact CG-CZ 3.82Å; Y417-F431 HydrophobicContact CG-CZ 3.82Å; Y417-F431 AromaticContact CZ-CZ 3.76Å; L424-F431 HydrophobicContact CD1-CB 4.41Å; L424-F431 HydrophobicContact CD1-CD1 3.51Å; L424-F431 HydrophobicContact CD1-CE1 4.08Å; L424-F431 HydrophobicContact CD1-CG 4.25Å; L424-F431 HydrophobicContact CD2-CB 4.31Å; L424-F431 HydrophobicContact CD2-CD1 3.85Å; L424-F431 HydrophobicContact CD2-CE1 4.22Å; L424-F431 HydrophobicContact CD2-CG 4.01Å; L424-F431 HydrophobicContact CG-CD1 4.36Å; Q427-F431 WeakPolarHBondContact O-CB 3.42Å; Q427-F431 PolarHBondContact O-N 3.32Å; Q429-F431 VanDerWaalsContact C-N 3.29Å; Q429-F431 PolarHBondContact O-N 2.85Å; F431-D433 VanDerWaalsContact C-N 3.34Å; F431-D433 PolarHBondContact O-N 2.89Å; F431-S434 PolarHBondContact O-N 3.38Å; F431-L435 HydrophobicContact CD1-CD1 3.76Å; F431-L435 HydrophobicContact CD1-CG 4.46Å; F431-L435 HydrophobicContact CE1-CD1 3.26Å; F431-L435 HydrophobicContact CE1-CG 4.2Å; F431-L435 HydrophobicContact CE2-CD1 4.24Å; F431-L435 HydrophobicContact CE2-CG 4.4Å; F431-L435 HydrophobicContact CG-CD1 4.45Å; F431-L435 HydrophobicContact CZ-CD1 3.55Å; F431-L435 HydrophobicContact CZ-CD2 4.46Å; F431-L435 HydrophobicContact CZ-CG 4.18Å; F431-L435 WeakPolarHBondContact O-CG 3.34Å; F431-L435 PolarHBondContact O-N 2.83Å
432	L	96.3	Very high	94.6	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-38.2	-179.6	-69.9	172.3	0	0	0	112.1	R428 Q429 S436 M461 H463	R428-L432 HydrophobicContact CG-CD1 3.86Å; R428-L432 WeakPolarHBondContact O-CB 3.3Å; R428-L432 VanDerWaalsContact O-CG 3.25Å; R428-L432 WeakPolarHBondContact O-CG 3.49Å; R428-L432 PolarHBondContact O-N 2.91Å; Q429-L432 PolarHBondContact O-N 2.97Å; L432-S436 WeakPolarHBondContact O-CB 3.27Å; L432-S436 PolarHBondContact O-N 3.36Å; L432-S436 PolarHBondContact O-OG 2.56Å; L432-M461 HydrophobicContact CD2-CB 4.38Å; L432-M461 HydrophobicContact CD2-CE 3.54Å; L432-M461 HydrophobicContact CD2-SD 4.29Å; L432-H463 HydrophobicContact CD1-CB 4.05Å; L432-H463 HydrophobicContact CD2-CB 4.09Å; L432-H463 HydrophobicContact CG-CB 4.47Å
433	D	95	Very high	94.5	Very high	73 Å²	73	55.1 Å²	55.1	39%	0.39	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-43.2	175.8	-68.4	-21.4	0	0	0	111.1	Q429 F431 L435 S436 H437 H463	Q429-D433 WeakPolarHBondContact CG-OD2 3.44Å; Q429-D433 PolarHBondContact NE2-OD1 2.82Å; Q429-D433 PolarHBondContact NE2-OD2 3.46Å; Q429-D433 WeakPolarHBondContact O-CB 3.14Å; Q429-D433 VanDerWaalsContact O-CG 3.26Å; Q429-D433 PolarHBondContact O-N 3.49Å; F431-D433 VanDerWaalsContact C-N 3.34Å; F431-D433 PolarHBondContact O-N 2.89Å; D433-L435 PolarHBondContact O-N 3.28Å; D433-S436 PolarHBondContact O-N 2.79Å; D433-H437 WeakPolarHBondContact O-CB 3.38Å; D433-H437 PolarHBondContact O-N 2.75Å; D433-H463 IonicContact OD1-CE1 3.81Å
434	S	96.4	Very high	94.5	Very high	20 Å²	20	56.1 Å²	56.1	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-45.7	176.2	-59.6	0	0	0	0	112.1	P402 A430 F431 S436 H437 A438	P402-S434 WeakPolarHBondContact CB-O 3.44Å; A430-S434 VanDerWaalsContact O-CB 3.28Å; A430-S434 WeakPolarHBondContact O-CB 3.23Å; A430-S434 PolarHBondContact O-N 3.5Å; A430-S434 PolarHBondContact O-OG 3Å; F431-S434 PolarHBondContact O-N 3.38Å; S434-S436 VanDerWaalsContact C-N 3.33Å; S434-S436 PolarHBondContact O-N 3.26Å; S434-H437 PolarHBondContact O-N 2.8Å; S434-A438 PolarHBondContact O-N 3.27Å; S434-A438 VanDerWaalsContact O-N 3.1Å
435	L	94.9	Very high	94.5	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.9	-40.2	175.4	-72.6	177.5	0	0	0	112.1	V398 L410 V413 L414 F431 D433 L439	V398-L435 HydrophobicContact CG1-CD2 3.79Å; V398-L435 HydrophobicContact CG1-CG 4.31Å; L410-L435 HydrophobicContact CD1-CD2 3.36Å; V413-L435 HydrophobicContact CG1-CD2 4.08Å; L414-L435 HydrophobicContact CD2-CB 4.49Å; L414-L435 HydrophobicContact CD2-CD1 3.84Å; F431-L435 HydrophobicContact CD1-CD1 3.76Å; F431-L435 HydrophobicContact CD1-CG 4.46Å; F431-L435 HydrophobicContact CE1-CD1 3.26Å; F431-L435 HydrophobicContact CE1-CG 4.2Å; F431-L435 HydrophobicContact CE2-CD1 4.24Å; F431-L435 HydrophobicContact CE2-CG 4.4Å; F431-L435 HydrophobicContact CG-CD1 4.45Å; F431-L435 HydrophobicContact CZ-CD1 3.55Å; F431-L435 HydrophobicContact CZ-CD2 4.46Å; F431-L435 HydrophobicContact CZ-CG 4.18Å; F431-L435 WeakPolarHBondContact O-CG 3.34Å; F431-L435 PolarHBondContact O-N 2.83Å; D433-L435 PolarHBondContact O-N 3.28Å; L435-L439 WeakPolarHBondContact O-CB 3.33Å; L435-L439 VanDerWaalsContact O-CG 3.26Å; L435-L439 WeakPolarHBondContact O-CG 3.45Å; L435-L439 PolarHBondContact O-N 3.09Å
436	S	94.4	Very high	94.5	Very high	8 Å²	8	56.4 Å²	56.4	6%	0.056	29%	0.287	C	S	.	.	H	α-helix	trans	-67.8	-43.3	179.9	-59.5	0	0	0	0	111.4	L432 D433 S434 L439 I440 H463 P465	L432-S436 WeakPolarHBondContact O-CB 3.27Å; L432-S436 PolarHBondContact O-N 3.36Å; L432-S436 PolarHBondContact O-OG 2.56Å; D433-S436 PolarHBondContact O-N 2.79Å; S434-S436 VanDerWaalsContact C-N 3.33Å; S434-S436 PolarHBondContact O-N 3.26Å; S436-L439 PolarHBondContact O-N 3.42Å; S436-I440 WeakPolarHBondContact O-CB 3.37Å; S436-I440 WeakPolarHBondContact O-CD1 3.49Å; S436-I440 WeakPolarHBondContact O-CG1 3.28Å; S436-I440 PolarHBondContact O-N 3.32Å; S436-H463 PolarHBondContact OG-CD2 2.89Å; S436-H463 PolarHBondContact OG-NE2 2.74Å; S436-P465 WeakPolarHBondContact OG-CG 3.27Å
437	H	94.6	Very high	94.6	Very high	112 Å²	112	50.7 Å²	50.7	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-55.1	-53.3	173.8	176.4	-89.6	0	0	0	111.2	D403 D433 S434 L439 I440 S441	D403-H437 IonicContact OD1-CE1 3.67Å; D403-H437 IonicContact OD1-ND1 3.49Å; D403-H437 PolarHBondContact OD1-ND1 3.46Å; D403-H437 IonicContact OD2-CE1 3.81Å; D433-H437 WeakPolarHBondContact O-CB 3.38Å; D433-H437 PolarHBondContact O-N 2.75Å; S434-H437 PolarHBondContact O-N 2.8Å; H437-L439 PolarHBondContact O-N 2.72Å; H437-I440 PolarHBondContact O-N 3.19Å; H437-S441 PolarHBondContact O-N 3.45Å; H437-S441 VanDerWaalsContact O-N 3.15Å
438	A	95.3	Very high	94.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-43.3	178.2	0	0	0	0	0	112	P402 L410 S434 I440 S441 Y442	P402-A438 HydrophobicContact CB-CB 4.04Å; L410-A438 HydrophobicContact CD1-CB 4.29Å; L410-A438 HydrophobicContact CD2-CB 3.82Å; S434-A438 PolarHBondContact O-N 3.27Å; S434-A438 VanDerWaalsContact O-N 3.1Å; A438-I440 PolarHBondContact O-N 3.31Å; A438-S441 WeakPolarHBondContact O-CB 3.41Å; A438-S441 PolarHBondContact O-N 3.31Å; A438-S441 PolarHBondContact O-OG 3.03Å; A438-Y442 WeakPolarHBondContact O-CD2 3.3Å; A438-Y442 PolarHBondContact O-N 3.14Å
439	L	94.8	Very high	94.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-44.3	177.7	-79.4	168	0	0	0	112.1	L407 L410 M411 L414 L435 S436 H437 S441 Y442 L443 M446 A454 L458 L468	L407-L439 HydrophobicContact CD1-CD2 4.48Å; L410-L439 HydrophobicContact CD2-CB 4.25Å; L410-L439 HydrophobicContact CD2-CD2 3.54Å; L410-L439 HydrophobicContact CD2-CG 3.6Å; L410-L439 HydrophobicContact CG-CD2 3.85Å; L410-L439 HydrophobicContact CG-CG 4Å; M411-L439 HydrophobicContact SD-CD2 4.33Å; L414-L439 HydrophobicContact CD1-CD1 3.51Å; L414-L439 HydrophobicContact CD1-CD2 3.82Å; L414-L439 HydrophobicContact CD1-CG 4.06Å; L414-L439 HydrophobicContact CD2-CD1 4.36Å; L414-L439 HydrophobicContact CG-CD1 4.49Å; L435-L439 WeakPolarHBondContact O-CB 3.33Å; L435-L439 VanDerWaalsContact O-CG 3.26Å; L435-L439 WeakPolarHBondContact O-CG 3.45Å; L435-L439 PolarHBondContact O-N 3.09Å; S436-L439 PolarHBondContact O-N 3.42Å; H437-L439 PolarHBondContact O-N 2.72Å; L439-S441 PolarHBondContact O-N 3.37Å; L439-Y442 PolarHBondContact O-N 3.36Å; L439-L443 PolarHBondContact O-N 3.46Å; L439-L443 VanDerWaalsContact O-N 3.14Å; L439-M446 HydrophobicContact CD2-CE 4.42Å; L439-A454 HydrophobicContact CD2-CB 4.37Å; L439-L458 HydrophobicContact CD1-CD1 3.82Å; L439-L468 HydrophobicContact CB-CD1 4.47Å; L439-L468 HydrophobicContact CD1-CD1 4.22Å
440	I	93.9	Very high	94.4	Very high	75 Å²	75	48.6 Å²	48.6	39%	0.385	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-35.5	179.5	-70.1	164.4	0	0	0	110.5	S436 H437 A438 Y442 L443	S436-I440 WeakPolarHBondContact O-CB 3.37Å; S436-I440 WeakPolarHBondContact O-CD1 3.49Å; S436-I440 WeakPolarHBondContact O-CG1 3.28Å; S436-I440 PolarHBondContact O-N 3.32Å; H437-I440 PolarHBondContact O-N 3.19Å; A438-I440 PolarHBondContact O-N 3.31Å; I440-Y442 PolarHBondContact O-N 3.12Å; I440-L443 WeakPolarHBondContact O-CB 3.33Å; I440-L443 PolarHBondContact O-N 2.8Å; I440-L443 VanDerWaalsContact O-N 3.16Å
441	S	94.7	Very high	94.4	Very high	67 Å²	67	46.6 Å²	46.6	47%	0.469	25%	0.245	S	C	.	.	H	α-helix	trans	-62.2	-28.6	174.8	83.9	0	0	0	0	113.6	H437 A438 L439	H437-S441 PolarHBondContact O-N 3.45Å; H437-S441 VanDerWaalsContact O-N 3.15Å; A438-S441 WeakPolarHBondContact O-CB 3.41Å; A438-S441 PolarHBondContact O-N 3.31Å; A438-S441 PolarHBondContact O-OG 3.03Å; L439-S441 PolarHBondContact O-N 3.37Å
442	Y	95.3	Very high	94.3	Very high	54 Å²	54	46.6 Å²	46.6	21%	0.212	25%	0.245	C	C	.	.	H	α-helix	trans	-91.1	-9.4	177.9	-72.6	-70.6	0	0	0	113.8	L405 L407 L410 A438 L439 I440 P444 K445 M446	L405-Y442 PolarHBondContact O-OH 3.39Å; L407-Y442 HydrophobicContact CB-CD1 4.07Å; L407-Y442 HydrophobicContact CB-CD2 4.34Å; L407-Y442 HydrophobicContact CB-CE1 4.32Å; L407-Y442 HydrophobicContact CB-CG 4.09Å; L407-Y442 HydrophobicContact CD1-CD2 4.49Å; L407-Y442 HydrophobicContact CD1-CG 4.28Å; L410-Y442 HydrophobicContact CD2-CD2 4.24Å; A438-Y442 WeakPolarHBondContact O-CD2 3.3Å; A438-Y442 PolarHBondContact O-N 3.14Å; L439-Y442 PolarHBondContact O-N 3.36Å; I440-Y442 PolarHBondContact O-N 3.12Å; Y442-P444 VanDerWaalsContact C-N 3.32Å; Y442-P444 VanDerWaalsContact O-N 3.13Å; Y442-K445 WeakPolarHBondContact O-CA 3.16Å; Y442-K445 PolarHBondContact O-N 3.38Å; Y442-M446 WeakPolarHBondContact O-CG 3.43Å; Y442-M446 PolarHBondContact O-N 3.04Å; Y442-M446 VanDerWaalsContact O-N 3.13Å
443	L	93.8	Very high	94.3	Very high	30 Å²	30	50 Å²	50	16%	0.157	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-48.6	-40.4	-172.3	-167.2	140.4	0	0	0	114.9	L439 I440 K445 Q471	L439-L443 PolarHBondContact O-N 3.46Å; L439-L443 VanDerWaalsContact O-N 3.14Å; I440-L443 WeakPolarHBondContact O-CB 3.33Å; I440-L443 PolarHBondContact O-N 2.8Å; I440-L443 VanDerWaalsContact O-N 3.16Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.24Å; L443-Q471 HydrophobicContact CD2-CB 4.43Å; L443-Q471 HydrophobicContact CD2-CG 4.21Å; L443-Q471 PolarHBondContact O-NE2 2.93Å
444	P	91.6	Very high	94.4	Very high	111 Å²	111	46.5 Å²	46.5	72%	0.721	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-70.4	-18.2	176.6	-19.4	33.6	0	0	0	115	Y442	Y442-P444 VanDerWaalsContact C-N 3.32Å; Y442-P444 VanDerWaalsContact O-N 3.13Å
445	K	91.3	Very high	94.4	Very high	171 Å²	171	45.6 Å²	45.6	74%	0.743	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-106.7	-9	-175.5	-60.2	177.5	-175.4	170	0	112.7	Y442 L443	Y442-K445 WeakPolarHBondContact O-CA 3.16Å; Y442-K445 PolarHBondContact O-N 3.38Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.24Å
446	M	93.3	Very high	94.5	Very high	16 Å²	16	47.9 Å²	47.9	8%	0.079	24%	0.243	C	C	.	.			trans	-72	136.4	-179.5	-74.1	179.6	73.2	0	0	110.4	L407 M411 L439 Y442 E450 A454	L407-M446 HydrophobicContact CD1-CE 4.2Å; L407-M446 HydrophobicContact CD1-CG 3.92Å; L407-M446 HydrophobicContact CD1-SD 4.1Å; L407-M446 HydrophobicContact CD2-CG 3.81Å; M411-M446 HydrophobicContact SD-CE 4.35Å; L439-M446 HydrophobicContact CD2-CE 4.42Å; Y442-M446 WeakPolarHBondContact O-CG 3.43Å; Y442-M446 PolarHBondContact O-N 3.04Å; Y442-M446 VanDerWaalsContact O-N 3.13Å; M446-E450 HydrophobicContact CB-CB 4.47Å; M446-E450 HydrophobicContact CE-CB 3.89Å; M446-A454 HydrophobicContact CE-CB 4.01Å
447	S	93.2	Very high	94.7	Very high	46 Å²	46	49.6 Å²	49.6	32%	0.322	25%	0.249	S	C	.	.			trans	-69.2	158.6	164.5	62.8	0	0	0	0	110.8	L449 E450 L451	S447-L449 PolarHBondContact O-N 2.95Å; S447-E450 WeakPolarHBondContact CB-OE2 3.48Å; S447-E450 PolarHBondContact N-OE2 2.84Å; S447-E450 WeakPolarHBondContact O-CB 3.26Å; S447-E450 PolarHBondContact O-N 3.25Å; S447-E450 VanDerWaalsContact OG-CG 3.23Å; S447-E450 WeakPolarHBondContact OG-CG 3.37Å; S447-E450 PolarHBondContact OG-N 3.09Å; S447-E450 PolarHBondContact OG-OE2 3.2Å; S447-L451 PolarHBondContact O-N 3.01Å
448	E	92.4	Very high	94.7	Very high	69 Å²	69	44.3 Å²	44.3	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-64.3	-31.1	-177.3	-51.6	70.1	-146.9	0	0	111.1	L451 L452 T477 Q480 L481	E448-L451 PolarHBondContact O-N 3.1Å; E448-L452 PolarHBondContact O-N 3.41Å; E448-T477 HydrophobicContact CB-CG2 3.94Å; E448-T477 HydrophobicContact CG-CG2 3.95Å; E448-Q480 VanDerWaalsContact CD-OE1 3.31Å; E448-Q480 HydrophobicContact CG-CB 4.08Å; E448-Q480 PolarHBondContact OE1-OE1 3.19Å; E448-L481 HydrophobicContact CB-CD1 3.98Å; E448-L481 HydrophobicContact CB-CD2 3.65Å; E448-L481 HydrophobicContact CB-CG 3.55Å
449	L	92.5	Very high	94.7	Very high	61 Å²	61	44.3 Å²	44.3	32%	0.319	23%	0.225	S	C	.	.	H	α-helix	trans	-70.8	-36.4	174.6	-178.7	62.7	0	0	0	112.4	S447 L451 K453 K490 M493	S447-L449 PolarHBondContact O-N 2.95Å; L449-L451 VanDerWaalsContact C-N 3.33Å; L449-K453 HydrophobicContact CG-CD 4.44Å; L449-K453 WeakPolarHBondContact O-CB 3.47Å; L449-K453 VanDerWaalsContact O-CG 3.29Å; L449-K453 WeakPolarHBondContact O-CG 3.44Å; L449-K453 PolarHBondContact O-N 3.46Å; L449-K453 VanDerWaalsContact O-N 3.08Å; L449-K490 HydrophobicContact CD1-CG 4.43Å; L449-M493 HydrophobicContact CD1-CE 4.44Å
450	E	95.1	Very high	94.7	Very high	60 Å²	60	44.8 Å²	44.8	28%	0.28	23%	0.229	S	C	.	.	H	α-helix	trans	-66.6	-40.2	174.1	-73.6	163.8	146.3	0	0	110.5	M411 M446 S447 K453 A454	M411-E450 WeakPolarHBondContact CE-O 3.23Å; M446-E450 HydrophobicContact CB-CB 4.47Å; M446-E450 HydrophobicContact CE-CB 3.89Å; S447-E450 WeakPolarHBondContact CB-OE2 3.48Å; S447-E450 PolarHBondContact N-OE2 2.84Å; S447-E450 WeakPolarHBondContact O-CB 3.26Å; S447-E450 PolarHBondContact O-N 3.25Å; S447-E450 VanDerWaalsContact OG-CG 3.23Å; S447-E450 WeakPolarHBondContact OG-CG 3.37Å; S447-E450 PolarHBondContact OG-N 3.09Å; S447-E450 PolarHBondContact OG-OE2 3.2Å; E450-K453 PolarHBondContact O-N 3.48Å; E450-A454 WeakPolarHBondContact O-CB 3.49Å; E450-A454 PolarHBondContact O-N 2.97Å
451	L	95.7	Very high	94.7	Very high	3 Å²	3	42 Å²	42	2%	0.016	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-48.5	176.3	-171.9	63.2	0	0	0	112	S447 E448 L449 K453 A454 A455 L468 Q471 L472 T477	S447-L451 PolarHBondContact O-N 3.01Å; E448-L451 PolarHBondContact O-N 3.1Å; L449-L451 VanDerWaalsContact C-N 3.33Å; L451-K453 VanDerWaalsContact C-N 3.33Å; L451-K453 PolarHBondContact O-N 3.14Å; L451-A454 PolarHBondContact O-N 3.46Å; L451-A455 PolarHBondContact O-N 3.4Å; L451-L468 HydrophobicContact CD1-CD1 4.48Å; L451-L468 HydrophobicContact CD1-CD2 3.91Å; L451-L468 HydrophobicContact CD1-CG 3.66Å; L451-Q471 HydrophobicContact CD2-CB 4.15Å; L451-Q471 HydrophobicContact CD2-CG 3.94Å; L451-L472 HydrophobicContact CD2-CB 4.02Å; L451-L472 HydrophobicContact CD2-CD1 4.36Å; L451-L472 HydrophobicContact CG-CB 4.02Å; L451-L472 HydrophobicContact CG-CD1 4.19Å; L451-T477 HydrophobicContact CD2-CG2 4.08Å
452	L	96.1	Very high	94.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-42.7	175.4	177.1	59.4	0	0	0	112.1	E448 Y456 L472 L481 K490 M493 F494	E448-L452 PolarHBondContact O-N 3.41Å; L452-Y456 WeakPolarHBondContact O-CB 3.5Å; L452-Y456 PolarHBondContact O-N 2.88Å; L452-L472 HydrophobicContact CB-CD1 3.97Å; L452-L472 HydrophobicContact CD1-CD1 4.27Å; L452-L472 HydrophobicContact CD1-CD2 4.19Å; L452-L481 HydrophobicContact CB-CD1 4.46Å; L452-K490 HydrophobicContact CD2-CB 4.3Å; L452-K490 HydrophobicContact CD2-CG 4.43Å; L452-M493 HydrophobicContact CD1-CB 4Å; L452-M493 HydrophobicContact CD2-CB 4.05Å; L452-M493 HydrophobicContact CG-CB 3.92Å; L452-M493 HydrophobicContact CG-SD 4.34Å; L452-F494 HydrophobicContact CD1-CD1 3.72Å; L452-F494 HydrophobicContact CD1-CD2 4.18Å; L452-F494 HydrophobicContact CD1-CE1 3.71Å; L452-F494 HydrophobicContact CD1-CE2 4.18Å; L452-F494 HydrophobicContact CD1-CG 3.97Å; L452-F494 HydrophobicContact CD1-CZ 3.96Å; L452-F494 HydrophobicContact CD2-CD2 4Å; L452-F494 HydrophobicContact CD2-CE2 3.73Å; L452-F494 HydrophobicContact CD2-CZ 4.12Å
453	K	96.6	Very high	94.7	Very high	73 Å²	73	40.7 Å²	40.7	32%	0.317	21%	0.206	S	C	.	.	H	α-helix	trans	-64.8	-41.7	177.2	-77.3	173.6	-179.5	175.6	0	111.8	M411 L449 E450 L451 Y456 Y457 M493	M411-K453 HydrophobicContact CE-CB 3.42Å; M411-K453 VanDerWaalsContact CE-CB 3.42Å; M411-K453 HydrophobicContact CE-CD 4.41Å; L449-K453 HydrophobicContact CG-CD 4.44Å; L449-K453 WeakPolarHBondContact O-CB 3.47Å; L449-K453 VanDerWaalsContact O-CG 3.29Å; L449-K453 WeakPolarHBondContact O-CG 3.44Å; L449-K453 PolarHBondContact O-N 3.46Å; L449-K453 VanDerWaalsContact O-N 3.08Å; E450-K453 PolarHBondContact O-N 3.48Å; L451-K453 VanDerWaalsContact C-N 3.33Å; L451-K453 PolarHBondContact O-N 3.14Å; K453-Y456 WeakPolarHBondContact O-CB 3.49Å; K453-Y456 PolarHBondContact O-N 3.39Å; K453-Y457 HydrophobicContact CB-CE2 4.06Å; K453-Y457 WeakPolarHBondContact O-CD2 3.44Å; K453-Y457 PolarHBondContact O-N 3.24Å; K453-M493 HydrophobicContact CG-SD 3.84Å
454	A	97.3	Very high	94.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-49.7	179.7	0	0	0	0	0	110.5	M411 L439 M446 E450 L451 Y456 Y457 L458 L468	M411-A454 HydrophobicContact CE-CB 4.22Å; M411-A454 HydrophobicContact SD-CB 4.02Å; L439-A454 HydrophobicContact CD2-CB 4.37Å; M446-A454 HydrophobicContact CE-CB 4.01Å; E450-A454 WeakPolarHBondContact O-CB 3.49Å; E450-A454 PolarHBondContact O-N 2.97Å; L451-A454 PolarHBondContact O-N 3.46Å; A454-Y456 VanDerWaalsContact C-N 3.34Å; A454-Y456 PolarHBondContact O-N 2.92Å; A454-Y457 PolarHBondContact O-N 3.3Å; A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CG 3.29Å; A454-L458 WeakPolarHBondContact O-CG 3.45Å; A454-L458 PolarHBondContact O-N 3.36Å; A454-L468 HydrophobicContact CB-CD1 4Å
455	A	96.8	Very high	94.9	Very high	1 Å²	1	36 Å²	36	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-56.8	-47.2	174.1	0	0	0	0	0	111.7	L451 Y457 L458 C459 L468 L469 L472 V497	L451-A455 PolarHBondContact O-N 3.4Å; A455-Y457 VanDerWaalsContact C-N 3.34Å; A455-Y457 PolarHBondContact O-N 2.9Å; A455-L458 PolarHBondContact O-N 3.12Å; A455-C459 VanDerWaalsContact O-CB 3.32Å; A455-C459 WeakPolarHBondContact O-CB 3.43Å; A455-C459 PolarHBondContact O-N 3.17Å; A455-C459 PolarHBondContact O-SG 3.4Å; A455-L468 HydrophobicContact CB-CD2 3.62Å; A455-L469 HydrophobicContact CB-CD2 4.09Å; A455-L472 HydrophobicContact CB-CD2 3.45Å; A455-L472 VanDerWaalsContact CB-CD2 3.45Å; A455-V497 HydrophobicContact CB-CG2 4.11Å
456	Y	96.4	Very high	95	Very high	48 Å²	48	30 Å²	30	19%	0.188	15%	0.154	C	C	.	.	H	α-helix	trans	-55.5	-44.8	177.4	166.9	-92.9	0	0	0	113.1	L452 K453 A454 G460 M493 R496	L452-Y456 WeakPolarHBondContact O-CB 3.5Å; L452-Y456 PolarHBondContact O-N 2.88Å; K453-Y456 WeakPolarHBondContact O-CB 3.49Å; K453-Y456 PolarHBondContact O-N 3.39Å; A454-Y456 VanDerWaalsContact C-N 3.34Å; A454-Y456 PolarHBondContact O-N 2.92Å; Y456-G460 PolarHBondContact O-N 2.96Å; Y456-M493 HydrophobicContact CD1-CG 4.47Å; Y456-M493 HydrophobicContact CD2-CB 3.91Å; Y456-M493 HydrophobicContact CD2-CG 3.64Å; Y456-M493 HydrophobicContact CE2-CG 4.01Å; Y456-M493 HydrophobicContact CG-CB 4.3Å; Y456-M493 HydrophobicContact CG-CG 3.87Å; Y456-M493 HydrophobicContact CG-SD 4.41Å; Y456-R496 HydrophobicContact CD2-CB 3.83Å; Y456-R496 HydrophobicContact CD2-CG 4.11Å; Y456-R496 HydrophobicContact CE2-CB 3.92Å; Y456-R496 HydrophobicContact CE2-CG 4.16Å; Y456-R496 VanDerWaalsContact CE2-CZ 3.47Å; Y456-R496 VanDerWaalsContact CE2-NE 3.3Å; Y456-R496 VanDerWaalsContact CZ-CZ 3.48Å; Y456-R496 PolarHBondContact OH-NH1 3.38Å; Y456-R496 PolarHBondContact OH-NH2 3.24Å
457	Y	97.2	Very high	95	Very high	44 Å²	44	31 Å²	31	17%	0.173	17%	0.165	C	C	.	.	H	α-helix	trans	-71	-43.4	179.5	-66	-48.4	0	0	0	112.1	M411 L414 A415 S418 K453 A454 A455 G460 M461	M411-Y457 HydrophobicContact CE-CD2 4.46Å; M411-Y457 HydrophobicContact CE-CE2 4.33Å; L414-Y457 HydrophobicContact CB-CD2 4.14Å; L414-Y457 HydrophobicContact CB-CG 4.42Å; A415-Y457 HydrophobicContact CB-CD1 4.37Å; A415-Y457 HydrophobicContact CB-CD2 4.11Å; A415-Y457 HydrophobicContact CB-CE1 3.85Å; A415-Y457 HydrophobicContact CB-CE2 3.55Å; A415-Y457 VanDerWaalsContact CB-CZ 3.43Å; S418-Y457 PolarHBondContact OG-O 3.3Å; K453-Y457 HydrophobicContact CB-CE2 4.06Å; K453-Y457 WeakPolarHBondContact O-CD2 3.44Å; K453-Y457 PolarHBondContact O-N 3.24Å; A454-Y457 PolarHBondContact O-N 3.3Å; A455-Y457 VanDerWaalsContact C-N 3.34Å; A455-Y457 PolarHBondContact O-N 2.9Å; Y457-G460 PolarHBondContact O-N 3.14Å; Y457-M461 WeakPolarHBondContact O-CG 3.38Å; Y457-M461 PolarHBondContact O-N 3.35Å; Y457-M461 VanDerWaalsContact O-N 3.09Å
458	L	96.4	Very high	95.1	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-47	-179.5	-71.4	172.4	0	0	0	112.2	L414 L439 A454 A455 G460 M461 N462 H463 P465 L468	L414-L458 HydrophobicContact CD2-CD2 3.56Å; L414-L458 HydrophobicContact CD2-CG 4.09Å; L439-L458 HydrophobicContact CD1-CD1 3.82Å; A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CG 3.29Å; A454-L458 WeakPolarHBondContact O-CG 3.45Å; A454-L458 PolarHBondContact O-N 3.36Å; A455-L458 PolarHBondContact O-N 3.12Å; L458-G460 VanDerWaalsContact C-N 3.26Å; L458-G460 PolarHBondContact O-N 3.29Å; L458-M461 HydrophobicContact CD2-CE 3.7Å; L458-M461 CarbonylContact O-C 3.31Å; L458-M461 VanDerWaalsContact O-C 3.31Å; L458-M461 WeakPolarHBondContact O-CA 3.39Å; L458-M461 WeakPolarHBondContact O-CB 3.31Å; L458-M461 PolarHBondContact O-N 3.45Å; L458-N462 PolarHBondContact O-N 3.33Å; L458-N462 VanDerWaalsContact O-N 3.17Å; L458-H463 CarbonylContact C-O 3.13Å; L458-H463 WeakPolarHBondContact CB-O 3.35Å; L458-H463 HydrophobicContact CD2-CB 4.38Å; L458-H463 PolarHBondContact O-N 3.5Å; L458-P465 HydrophobicContact CD1-CG 3.91Å; L458-L468 HydrophobicContact CD1-CD1 3.94Å
459	C	95.5	Very high	95.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-40.4	174.4	-68	0	0	0	0	111.3	A455 M461 N462 H463 F464 C500 R615	A455-C459 VanDerWaalsContact O-CB 3.32Å; A455-C459 WeakPolarHBondContact O-CB 3.43Å; A455-C459 PolarHBondContact O-N 3.17Å; A455-C459 PolarHBondContact O-SG 3.4Å; C459-M461 PolarHBondContact O-N 3.37Å; C459-N462 PolarHBondContact O-N 3.02Å; C459-H463 PolarHBondContact N-O 2.85Å; C459-F464 HydrophobicContact CB-CD1 4.48Å; C459-F464 HydrophobicContact CB-CE1 3.94Å; C459-C500 HydrophobicContact CB-CB 3.8Å; C459-R615 PolarHBondContact O-NH2 2.8Å
460	G	93.4	Very high	95.3	Very high	10 Å²	10	26.9 Å²	26.9	10%	0.103	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-36.2	173.1	0	0	0	0	0	112.9	Y456 Y457 L458 N462	Y456-G460 PolarHBondContact O-N 2.96Å; Y457-G460 PolarHBondContact O-N 3.14Å; L458-G460 VanDerWaalsContact C-N 3.26Å; L458-G460 PolarHBondContact O-N 3.29Å; G460-N462 VanDerWaalsContact C-N 3.26Å; G460-N462 PolarHBondContact O-N 2.84Å
461	M	94.5	Very high	95.3	Very high	17 Å²	17	26.5 Å²	26.5	8%	0.084	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	11.8	174.2	-63.1	-171.3	-51.1	0	0	113.7	L414 R428 L432 Y457 L458 C459 H463	L414-M461 HydrophobicContact CD2-CE 3.8Å; R428-M461 PolarHBondContact NH2-O 3.33Å; L432-M461 HydrophobicContact CD2-CB 4.38Å; L432-M461 HydrophobicContact CD2-CE 3.54Å; L432-M461 HydrophobicContact CD2-SD 4.29Å; Y457-M461 WeakPolarHBondContact O-CG 3.38Å; Y457-M461 PolarHBondContact O-N 3.35Å; Y457-M461 VanDerWaalsContact O-N 3.09Å; L458-M461 HydrophobicContact CD2-CE 3.7Å; L458-M461 CarbonylContact O-C 3.31Å; L458-M461 VanDerWaalsContact O-C 3.31Å; L458-M461 WeakPolarHBondContact O-CA 3.39Å; L458-M461 WeakPolarHBondContact O-CB 3.31Å; L458-M461 PolarHBondContact O-N 3.45Å; C459-M461 PolarHBondContact O-N 3.37Å; M461-H463 VanDerWaalsContact C-N 3.28Å; M461-H463 PolarHBondContact O-N 3.5Å
462	N	94.3	Very high	95.2	Very high	70 Å²	70	26.4 Å²	26.4	37%	0.374	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	35	-176.6	-151.4	42.6	0	0	0	114.1	L458 C459 G460 F464 R615	L458-N462 PolarHBondContact O-N 3.33Å; L458-N462 VanDerWaalsContact O-N 3.17Å; C459-N462 PolarHBondContact O-N 3.02Å; G460-N462 VanDerWaalsContact C-N 3.26Å; G460-N462 PolarHBondContact O-N 2.84Å; N462-F464 WeakPolarHBondContact OD1-CE2 3.17Å; N462-R615 PolarHBondContact OD1-NH2 3.42Å
463	H	95.4	Very high	95.1	Very high	24 Å²	24	27.5 Å²	27.5	11%	0.111	14%	0.143	C	C	.	.			trans	-123.7	132.9	177.5	-165.1	57	0	0	0	110.4	L432 D433 S436 L458 C459 M461	L432-H463 HydrophobicContact CD1-CB 4.05Å; L432-H463 HydrophobicContact CD2-CB 4.09Å; L432-H463 HydrophobicContact CG-CB 4.47Å; D433-H463 IonicContact OD1-CE1 3.81Å; S436-H463 PolarHBondContact OG-CD2 2.89Å; S436-H463 PolarHBondContact OG-NE2 2.74Å; L458-H463 CarbonylContact C-O 3.13Å; L458-H463 WeakPolarHBondContact CB-O 3.35Å; L458-H463 HydrophobicContact CD2-CB 4.38Å; L458-H463 PolarHBondContact O-N 3.5Å; C459-H463 PolarHBondContact N-O 2.85Å; M461-H463 VanDerWaalsContact C-N 3.28Å; M461-H463 PolarHBondContact O-N 3.5Å
464	F	95.6	Very high	94.9	Very high	27 Å²	27	25.8 Å²	25.8	12%	0.118	14%	0.14	C	C	.	.			trans	-134.4	71.9	-167.1	-57.3	-88.2	0	0	0	112.4	C459 N462 S466 L469 C500 L501 D504 P506 L508	C459-F464 HydrophobicContact CB-CD1 4.48Å; C459-F464 HydrophobicContact CB-CE1 3.94Å; N462-F464 WeakPolarHBondContact OD1-CE2 3.17Å; F464-S466 PolarHBondContact O-N 3.16Å; F464-L469 HydrophobicContact CB-CD1 3.91Å; F464-L469 HydrophobicContact CD1-CD1 4.31Å; F464-C500 HydrophobicContact CE1-CB 3.8Å; F464-C500 HydrophobicContact CZ-CB 4.11Å; F464-L501 HydrophobicContact CD1-CD2 4.17Å; F464-D504 HydrophobicContact CE2-CB 4.14Å; F464-D504 HydrophobicContact CZ-CB 3.78Å; F464-P506 HydrophobicContact CB-CB 3.75Å; F464-P506 HydrophobicContact CB-CG 4.04Å; F464-P506 HydrophobicContact CD1-CB 4.22Å; F464-P506 HydrophobicContact CD1-CG 3.84Å; F464-P506 HydrophobicContact CD2-CB 3.53Å; F464-P506 HydrophobicContact CD2-CG 4.04Å; F464-P506 HydrophobicContact CE1-CG 4.25Å; F464-P506 HydrophobicContact CE2-CB 4.12Å; F464-P506 HydrophobicContact CE2-CG 4.43Å; F464-P506 HydrophobicContact CG-CB 3.57Å; F464-P506 HydrophobicContact CG-CG 3.71Å; F464-L508 HydrophobicContact CB-CD2 4.33Å
465	P	94.5	Very high	94.5	Very high	16 Å²	16	29.9 Å²	29.9	10%	0.104	17%	0.168	C	C	.	.			trans	-64.7	118.8	176.9	-20.8	34.4	0	0	0	111.3	S436 L458 A467 L468 L469	S436-P465 WeakPolarHBondContact OG-CG 3.27Å; L458-P465 HydrophobicContact CD1-CG 3.91Å; P465-A467 PolarHBondContact O-N 3.21Å; P465-L468 HydrophobicContact CB-CB 4.22Å; P465-L468 PolarHBondContact O-N 2.69Å; P465-L469 WeakPolarHBondContact O-CG 2.96Å; P465-L469 PolarHBondContact O-N 3Å
466	S	93.6	Very high	94.1	Very high	43 Å²	43	33.2 Å²	33.2	30%	0.301	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-49.5	-174.3	59.8	0	0	0	0	112.5	F464 L468 L469 E470	F464-S466 PolarHBondContact O-N 3.16Å; S466-L468 PolarHBondContact O-N 2.78Å; S466-L468 VanDerWaalsContact O-N 3.17Å; S466-L469 PolarHBondContact O-N 3.1Å; S466-L469 VanDerWaalsContact O-N 3.09Å; S466-E470 WeakPolarHBondContact O-CB 2.97Å; S466-E470 VanDerWaalsContact O-CG 3.29Å; S466-E470 WeakPolarHBondContact O-CG 3.02Å; S466-E470 PolarHBondContact O-N 3.39Å
467	A	93.3	Very high	93.7	Very high	39 Å²	39	31.4 Å²	31.4	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-37.8	-178.6	0	0	0	0	0	113.1	P465 Q471	P465-A467 PolarHBondContact O-N 3.21Å; A467-Q471 PolarHBondContact O-N 3.26Å
468	L	94.5	Very high	93.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-71.9	-44.5	179.2	-168.8	153.5	0	0	0	111.2	L439 L451 A454 A455 L458 P465 S466 L472	L439-L468 HydrophobicContact CB-CD1 4.47Å; L439-L468 HydrophobicContact CD1-CD1 4.22Å; L451-L468 HydrophobicContact CD1-CD1 4.48Å; L451-L468 HydrophobicContact CD1-CD2 3.91Å; L451-L468 HydrophobicContact CD1-CG 3.66Å; A454-L468 HydrophobicContact CB-CD1 4Å; A455-L468 HydrophobicContact CB-CD2 3.62Å; L458-L468 HydrophobicContact CD1-CD1 3.94Å; P465-L468 HydrophobicContact CB-CB 4.22Å; P465-L468 PolarHBondContact O-N 2.69Å; S466-L468 PolarHBondContact O-N 2.78Å; S466-L468 VanDerWaalsContact O-N 3.17Å; L468-L472 WeakPolarHBondContact O-CB 3.41Å; L468-L472 PolarHBondContact O-N 2.84Å
469	L	95.1	Very high	92.9	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-69	-40.1	179.8	-66.9	168.9	0	0	0	112	A455 F464 P465 S466 L472 L473 V497 L501 L508 L512	A455-L469 HydrophobicContact CB-CD2 4.09Å; F464-L469 HydrophobicContact CB-CD1 3.91Å; F464-L469 HydrophobicContact CD1-CD1 4.31Å; P465-L469 WeakPolarHBondContact O-CG 2.96Å; P465-L469 PolarHBondContact O-N 3Å; S466-L469 PolarHBondContact O-N 3.1Å; S466-L469 VanDerWaalsContact O-N 3.09Å; L469-L472 PolarHBondContact O-N 3.4Å; L469-L473 WeakPolarHBondContact O-CB 3.44Å; L469-L473 WeakPolarHBondContact O-CG 3.2Å; L469-L473 PolarHBondContact O-N 3.47Å; L469-V497 HydrophobicContact CD2-CG1 4.32Å; L469-L501 HydrophobicContact CD1-CD2 4.12Å; L469-L508 HydrophobicContact CD1-CD1 4.31Å; L469-L508 HydrophobicContact CD1-CD2 4.3Å; L469-L512 HydrophobicContact CB-CD1 3.46Å; L469-L512 VanDerWaalsContact CB-CD1 3.46Å
470	E	94.3	Very high	92.4	Very high	86 Å²	86	41.3 Å²	41.3	40%	0.402	23%	0.234	S	C	.	.	H	α-helix	trans	-61.1	-46	175.9	-74.2	168.4	-161.4	0	0	111.3	S466 L473 S474 L512	S466-E470 WeakPolarHBondContact O-CB 2.97Å; S466-E470 VanDerWaalsContact O-CG 3.29Å; S466-E470 WeakPolarHBondContact O-CG 3.02Å; S466-E470 PolarHBondContact O-N 3.39Å; E470-L473 PolarHBondContact O-N 3.23Å; E470-S474 PolarHBondContact O-N 3.36Å; E470-L512 HydrophobicContact CG-CD1 4.1Å; E470-L512 HydrophobicContact CG-CD2 4.16Å
471	Q	94.4	Very high	91.9	Very high	53 Å²	53	41.1 Å²	41.1	25%	0.248	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-38.9	176.5	-168.6	-159.6	14.3	0	0	112	L443 L451 A467 L473 S474 T477	L443-Q471 HydrophobicContact CD2-CB 4.43Å; L443-Q471 HydrophobicContact CD2-CG 4.21Å; L443-Q471 PolarHBondContact O-NE2 2.93Å; L451-Q471 HydrophobicContact CD2-CB 4.15Å; L451-Q471 HydrophobicContact CD2-CG 3.94Å; A467-Q471 PolarHBondContact O-N 3.26Å; Q471-L473 VanDerWaalsContact C-N 3.29Å; Q471-L473 PolarHBondContact O-N 3.36Å; Q471-S474 WeakPolarHBondContact O-CB 3.34Å; Q471-S474 PolarHBondContact O-N 2.97Å; Q471-S474 PolarHBondContact O-OG 2.9Å; Q471-T477 WeakPolarHBondContact O-CB 3.3Å; Q471-T477 PolarHBondContact O-OG1 3.11Å
472	L	95	Very high	91.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-41.6	177.7	176.6	61.5	0	0	0	111.5	L451 L452 A455 L468 L469 S474 T477 L481 F494	L451-L472 HydrophobicContact CD2-CB 4.02Å; L451-L472 HydrophobicContact CD2-CD1 4.36Å; L451-L472 HydrophobicContact CG-CB 4.02Å; L451-L472 HydrophobicContact CG-CD1 4.19Å; L452-L472 HydrophobicContact CB-CD1 3.97Å; L452-L472 HydrophobicContact CD1-CD1 4.27Å; L452-L472 HydrophobicContact CD1-CD2 4.19Å; A455-L472 HydrophobicContact CB-CD2 3.45Å; A455-L472 VanDerWaalsContact CB-CD2 3.45Å; L468-L472 WeakPolarHBondContact O-CB 3.41Å; L468-L472 PolarHBondContact O-N 2.84Å; L469-L472 PolarHBondContact O-N 3.4Å; L472-S474 VanDerWaalsContact C-N 3.35Å; L472-T477 HydrophobicContact CD1-CG2 4.37Å; L472-L481 HydrophobicContact CD1-CD1 4.1Å; L472-F494 HydrophobicContact CD1-CE1 4.24Å; L472-F494 HydrophobicContact CG-CE1 4.44Å
473	L	93.6	Very high	90	Very high	24 Å²	24	43.7 Å²	43.7	13%	0.126	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	3.9	-175.5	-60.7	176.1	0	0	0	113.4	L469 E470 Q471 L478 L501 L512 V514	L469-L473 WeakPolarHBondContact O-CB 3.44Å; L469-L473 WeakPolarHBondContact O-CG 3.2Å; L469-L473 PolarHBondContact O-N 3.47Å; E470-L473 PolarHBondContact O-N 3.23Å; Q471-L473 VanDerWaalsContact C-N 3.29Å; Q471-L473 PolarHBondContact O-N 3.36Å; L473-L478 HydrophobicContact CD2-CD2 4.49Å; L473-L501 HydrophobicContact CD1-CD1 4.24Å; L473-L512 HydrophobicContact CD1-CB 3.76Å; L473-L512 HydrophobicContact CD1-CD1 4.3Å; L473-L512 HydrophobicContact CD1-CD2 4.5Å; L473-L512 HydrophobicContact CD1-CG 4.41Å; L473-V514 HydrophobicContact CD2-CB 4.48Å; L473-V514 HydrophobicContact CD2-CG1 4.48Å; L473-V514 HydrophobicContact CD2-CG2 4.05Å
474	S	92.6	Very high	88.5	Confident	37 Å²	37	46.2 Å²	46.2	26%	0.259	28%	0.276	S	S	.	.	S	Bend	trans	-64.4	144	170.2	70.1	0	0	0	0	111.2	E470 Q471 L472 S476 T477 L478	E470-S474 PolarHBondContact O-N 3.36Å; Q471-S474 WeakPolarHBondContact O-CB 3.34Å; Q471-S474 PolarHBondContact O-N 2.97Å; Q471-S474 PolarHBondContact O-OG 2.9Å; L472-S474 VanDerWaalsContact C-N 3.35Å; S474-S476 VanDerWaalsContact C-N 3.26Å; S474-S476 PolarHBondContact O-N 3.43Å; S474-S476 PolarHBondContact OG-OG 3.2Å; S474-T477 PolarHBondContact O-N 3.22Å; S474-T477 VanDerWaalsContact O-N 3.13Å; S474-T477 PolarHBondContact OG-OG1 2.95Å; S474-L478 WeakPolarHBondContact O-CG 3.24Å; S474-L478 PolarHBondContact O-N 3.5Å; S474-L478 VanDerWaalsContact O-N 3.11Å
475	S	88.1	Confident	87.4	Confident	86 Å²	86	50 Å²	50	60%	0.601	31%	0.305	S	S	*	.	H	α-helix	trans	-55	-41.2	-176.4	-51.2	0	0	0	0	112.5	T477 L478 E479	S475-T477 PolarHBondContact O-N 2.94Å; S475-L478 PolarHBondContact O-N 3.39Å; S475-E479 WeakPolarHBondContact O-CB 3.39Å; S475-E479 VanDerWaalsContact O-CG 3.27Å; S475-E479 WeakPolarHBondContact O-CG 3.43Å; S475-E479 PolarHBondContact O-N 3.35Å
476	S	88.2	Confident	86.6	Confident	70 Å²	70	51 Å²	51	49%	0.49	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-44.8	178.6	51.4	0	0	0	0	112.9	S474 Q480	S474-S476 VanDerWaalsContact C-N 3.26Å; S474-S476 PolarHBondContact O-N 3.43Å; S474-S476 PolarHBondContact OG-OG 3.2Å; S476-Q480 WeakPolarHBondContact O-CB 3.46Å; S476-Q480 VanDerWaalsContact O-CG 3.26Å; S476-Q480 WeakPolarHBondContact O-CG 3.21Å; S476-Q480 PolarHBondContact O-N 3.46Å; S476-Q480 VanDerWaalsContact O-N 3.09Å
477	T	87.9	Confident	86.1	Confident	10 Å²	10	52.2 Å²	52.2	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-42.3	-179.3	-58.3	0	0	0	0	110.9	E448 L451 Q471 L472 S474 S475 Q480 L481	E448-T477 HydrophobicContact CB-CG2 3.94Å; E448-T477 HydrophobicContact CG-CG2 3.95Å; L451-T477 HydrophobicContact CD2-CG2 4.08Å; Q471-T477 WeakPolarHBondContact O-CB 3.3Å; Q471-T477 PolarHBondContact O-OG1 3.11Å; L472-T477 HydrophobicContact CD1-CG2 4.37Å; S474-T477 PolarHBondContact O-N 3.22Å; S474-T477 VanDerWaalsContact O-N 3.13Å; S474-T477 PolarHBondContact OG-OG1 2.95Å; S475-T477 PolarHBondContact O-N 2.94Å; T477-Q480 PolarHBondContact O-N 2.91Å; T477-L481 HydrophobicContact CG2-CD1 3.99Å; T477-L481 WeakPolarHBondContact O-CB 3.44Å; T477-L481 WeakPolarHBondContact O-CG 3.44Å; T477-L481 PolarHBondContact O-N 3.42Å
478	L	89.7	Confident	85.7	Confident	19 Å²	19	57.9 Å²	57.9	10%	0.099	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-43.4	179.5	-67.2	176.8	0	0	0	111.9	L473 S474 S475 Q480 L481 A482 F494 P515 V518	L473-L478 HydrophobicContact CD2-CD2 4.49Å; S474-L478 WeakPolarHBondContact O-CG 3.24Å; S474-L478 PolarHBondContact O-N 3.5Å; S474-L478 VanDerWaalsContact O-N 3.11Å; S475-L478 PolarHBondContact O-N 3.39Å; L478-Q480 VanDerWaalsContact C-N 3.34Å; L478-Q480 PolarHBondContact O-N 2.85Å; L478-L481 PolarHBondContact O-N 3.06Å; L478-A482 VanDerWaalsContact O-CB 3.24Å; L478-A482 WeakPolarHBondContact O-CB 3.19Å; L478-A482 PolarHBondContact O-N 3.1Å; L478-F494 HydrophobicContact CD2-CE1 3.74Å; L478-F494 HydrophobicContact CD2-CZ 3.79Å; L478-P515 HydrophobicContact CD1-CG 3.64Å; L478-V518 HydrophobicContact CD2-CG1 4.29Å
479	E	86.6	Confident	85.3	Confident	139 Å²	139	60.8 Å²	60.8	65%	0.65	35%	0.353	S	S	*	.	H	α-helix	trans	-60.3	-43.8	175.1	-76.1	173.6	-166	0	0	111.4	S475 A482 S483	S475-E479 WeakPolarHBondContact O-CB 3.39Å; S475-E479 VanDerWaalsContact O-CG 3.27Å; S475-E479 WeakPolarHBondContact O-CG 3.43Å; S475-E479 PolarHBondContact O-N 3.35Å; E479-A482 CarbonylContact O-C 3.56Å; E479-A482 PolarHBondContact O-N 3.17Å; E479-S483 WeakPolarHBondContact O-CB 3.49Å; E479-S483 PolarHBondContact O-N 2.9Å
480	Q	85.1	Confident	85	Confident	96 Å²	96	62 Å²	62	45%	0.449	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-42.2	176.3	-74.1	172.4	-9.9	0	0	112.3	E448 S476 T477 L478 A482 S483	E448-Q480 VanDerWaalsContact CD-OE1 3.31Å; E448-Q480 HydrophobicContact CG-CB 4.08Å; E448-Q480 PolarHBondContact OE1-OE1 3.19Å; S476-Q480 WeakPolarHBondContact O-CB 3.46Å; S476-Q480 VanDerWaalsContact O-CG 3.26Å; S476-Q480 WeakPolarHBondContact O-CG 3.21Å; S476-Q480 PolarHBondContact O-N 3.46Å; S476-Q480 VanDerWaalsContact O-N 3.09Å; T477-Q480 PolarHBondContact O-N 2.91Å; L478-Q480 VanDerWaalsContact C-N 3.34Å; L478-Q480 PolarHBondContact O-N 2.85Å; Q480-A482 VanDerWaalsContact C-N 3.29Å; Q480-A482 PolarHBondContact O-N 3.34Å; Q480-S483 PolarHBondContact O-N 3.32Å; Q480-S483 PolarHBondContact O-OG 2.99Å
481	L	83.9	Confident	84.8	Confident	5 Å²	5	59.7 Å²	59.7	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-33.1	175.8	-78.4	169.6	0	0	0	113.1	E448 L452 L472 T477 L478 K490 F494	E448-L481 HydrophobicContact CB-CD1 3.98Å; E448-L481 HydrophobicContact CB-CD2 3.65Å; E448-L481 HydrophobicContact CB-CG 3.55Å; L452-L481 HydrophobicContact CB-CD1 4.46Å; L472-L481 HydrophobicContact CD1-CD1 4.1Å; T477-L481 HydrophobicContact CG2-CD1 3.99Å; T477-L481 WeakPolarHBondContact O-CB 3.44Å; T477-L481 WeakPolarHBondContact O-CG 3.44Å; T477-L481 PolarHBondContact O-N 3.42Å; L478-L481 PolarHBondContact O-N 3.06Å; L481-K490 PolarHBondContact O-NZ 3.32Å; L481-F494 HydrophobicContact CB-CZ 4.49Å; L481-F494 HydrophobicContact CD1-CE2 4.21Å; L481-F494 HydrophobicContact CD1-CZ 3.6Å
482	A	79.1	Confident	84.6	Confident	46 Å²	46	62 Å²	62	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-84.2	-21.7	178.6	0	0	0	0	0	114	L478 E479 Q480 T484	L478-A482 VanDerWaalsContact O-CB 3.24Å; L478-A482 WeakPolarHBondContact O-CB 3.19Å; L478-A482 PolarHBondContact O-N 3.1Å; E479-A482 CarbonylContact O-C 3.56Å; E479-A482 PolarHBondContact O-N 3.17Å; Q480-A482 VanDerWaalsContact C-N 3.29Å; Q480-A482 PolarHBondContact O-N 3.34Å; A482-T484 CarbonylContact C-O 3.59Å; A482-T484 CarbonylContact O-C 3.46Å; A482-T484 PolarHBondContact O-N 3.34Å; A482-T484 VanDerWaalsContact O-N 3.14Å
483	S	69.9	Low	84.5	Confident	96 Å²	96	62.8 Å²	62.8	67%	0.671	36%	0.358	S	S	*	.	H	α-helix	trans	-57.5	-28.3	-179.2	71.4	0	0	0	0	113.8	E479 Q480	E479-S483 WeakPolarHBondContact O-CB 3.49Å; E479-S483 PolarHBondContact O-N 2.9Å; Q480-S483 PolarHBondContact O-N 3.32Å; Q480-S483 PolarHBondContact O-OG 2.99Å
484	T	63.5	Low	84.5	Confident	77 Å²	77	61.7 Å²	61.7	47%	0.472	35%	0.352	S	S	.	.	S	Bend	trans	-100.5	130	166.5	59.6	0	0	0	0	107.8	A482 L486 K490	A482-T484 CarbonylContact C-O 3.59Å; A482-T484 CarbonylContact O-C 3.46Å; A482-T484 PolarHBondContact O-N 3.34Å; A482-T484 VanDerWaalsContact O-N 3.14Å; T484-L486 PolarHBondContact O-N 2.9Å; T484-K490 PolarHBondContact OG1-NZ 3.48Å; T484-K490 VanDerWaalsContact OG1-NZ 3.09Å
485	S	72.2	Confident	84.5	Confident	106 Å²	106	61.3 Å²	61.3	74%	0.741	35%	0.346	S	S	*	.			trans	-38.5	117.6	178.4	61.1	0	0	0	0	110.9	T487	S485-T487 PolarHBondContact O-N 3.4Å; S485-T487 VanDerWaalsContact O-N 3.09Å
486	L	77.6	Confident	84.8	Confident	37 Å²	37	58.7 Å²	58.7	19%	0.194	32%	0.323	C	S	.	.			trans	-56.3	119.2	-176.3	-84.5	157.6	0	0	0	108.9	T484 K490 E491 F494 V518	T484-L486 PolarHBondContact O-N 2.9Å; L486-K490 HydrophobicContact CD2-CB 3.88Å; L486-K490 HydrophobicContact CD2-CD 4.12Å; L486-E491 HydrophobicContact CB-CG 4.03Å; L486-F494 HydrophobicContact CD2-CE2 4.31Å; L486-V518 HydrophobicContact CD1-CB 4.38Å; L486-V518 HydrophobicContact CD1-CG1 4.34Å
487	T	84.1	Confident	85.2	Confident	69 Å²	69	55.4 Å²	55.4	42%	0.423	30%	0.3	S	S	.	.			trans	-75	147.7	174	66.2	0	0	0	0	108.3	S485 S489 K490 E491	S485-T487 PolarHBondContact O-N 3.4Å; S485-T487 VanDerWaalsContact O-N 3.09Å; T487-S489 PolarHBondContact O-N 3.24Å; T487-K490 WeakPolarHBondContact O-CA 3.37Å; T487-K490 WeakPolarHBondContact O-CB 3.34Å; T487-K490 PolarHBondContact O-N 2.84Å; T487-E491 PolarHBondContact O-N 2.74Å; T487-E491 VanDerWaalsContact O-N 3.13Å
488	K	85.1	Confident	85.5	Confident	158 Å²	158	55.6 Å²	55.6	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-50.5	-27.1	174.8	-66.8	-172.7	176	-174.9	0	113.8	E491 R492	K488-E491 WeakPolarHBondContact CA-OE2 3.32Å; K488-R492 VanDerWaalsContact O-CG 3.27Å; K488-R492 WeakPolarHBondContact O-CG 3.5Å; K488-R492 PolarHBondContact O-N 3.18Å; K488-R492 VanDerWaalsContact O-N 3.15Å
489	S	85.7	Confident	85.8	Confident	61 Å²	61	54.7 Å²	54.7	43%	0.427	30%	0.296	S	S	.	.	H	α-helix	trans	-71.5	-38.3	175.5	-173.7	0	0	0	0	113	T487 M493	T487-S489 PolarHBondContact O-N 3.24Å; S489-M493 WeakPolarHBondContact O-CE 3.04Å; S489-M493 WeakPolarHBondContact O-CG 3.36Å; S489-M493 PolarHBondContact O-N 3.39Å
490	K	89.5	Confident	86.2	Confident	27 Å²	27	48.1 Å²	48.1	12%	0.117	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-45.2	175.7	-70.3	178.6	177.7	-177.7	0	110.4	L449 L452 L481 T484 L486 T487 R492 M493 F494	L449-K490 HydrophobicContact CD1-CG 4.43Å; L452-K490 HydrophobicContact CD2-CB 4.3Å; L452-K490 HydrophobicContact CD2-CG 4.43Å; L481-K490 PolarHBondContact O-NZ 3.32Å; T484-K490 PolarHBondContact OG1-NZ 3.48Å; T484-K490 VanDerWaalsContact OG1-NZ 3.09Å; L486-K490 HydrophobicContact CD2-CB 3.88Å; L486-K490 HydrophobicContact CD2-CD 4.12Å; T487-K490 WeakPolarHBondContact O-CA 3.37Å; T487-K490 WeakPolarHBondContact O-CB 3.34Å; T487-K490 PolarHBondContact O-N 2.84Å; K490-R492 VanDerWaalsContact C-N 3.34Å; K490-R492 PolarHBondContact O-N 3.38Å; K490-M493 WeakPolarHBondContact O-CA 3.14Å; K490-M493 WeakPolarHBondContact O-CB 3.49Å; K490-M493 PolarHBondContact O-N 2.95Å; K490-F494 WeakPolarHBondContact O-CD2 3.42Å; K490-F494 PolarHBondContact O-N 2.99Å
491	E	90.1	Very high	86.7	Confident	37 Å²	37	44.4 Å²	44.4	17%	0.173	25%	0.248	C	C	.	.	H	α-helix	trans	-54.5	-49.4	175.8	-64	173.1	159.4	0	0	111	L486 T487 K488 M493 F494 Q495	L486-E491 HydrophobicContact CB-CG 4.03Å; T487-E491 PolarHBondContact O-N 2.74Å; T487-E491 VanDerWaalsContact O-N 3.13Å; K488-E491 WeakPolarHBondContact CA-OE2 3.32Å; E491-M493 VanDerWaalsContact C-N 3.27Å; E491-M493 PolarHBondContact O-N 3.45Å; E491-F494 PolarHBondContact O-N 3.26Å; E491-F494 VanDerWaalsContact O-N 3.14Å; E491-Q495 WeakPolarHBondContact O-CB 3.39Å; E491-Q495 VanDerWaalsContact O-CG 3.27Å; E491-Q495 WeakPolarHBondContact O-CG 3.44Å; E491-Q495 PolarHBondContact O-N 3.24Å
492	R	88.8	Confident	87.2	Confident	102 Å²	102	48.7 Å²	48.7	39%	0.385	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-33.2	176	-75.2	177.7	-168.9	-168.4	-0.3	114	K488 K490 R496	K488-R492 VanDerWaalsContact O-CG 3.27Å; K488-R492 WeakPolarHBondContact O-CG 3.5Å; K488-R492 PolarHBondContact O-N 3.18Å; K488-R492 VanDerWaalsContact O-N 3.15Å; K490-R492 VanDerWaalsContact C-N 3.34Å; K490-R492 PolarHBondContact O-N 3.38Å; R492-R496 PolarHBondContact O-N 2.7Å; R492-R496 VanDerWaalsContact O-N 3.07Å
493	M	93.5	Very high	87.9	Confident	17 Å²	17	47.4 Å²	47.4	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-45.4	175.8	-74.7	-174.9	-95.1	0	0	110.5	L449 L452 K453 Y456 S489 K490 E491 R496 V497	L449-M493 HydrophobicContact CD1-CE 4.44Å; L452-M493 HydrophobicContact CD1-CB 4Å; L452-M493 HydrophobicContact CD2-CB 4.05Å; L452-M493 HydrophobicContact CG-CB 3.92Å; L452-M493 HydrophobicContact CG-SD 4.34Å; K453-M493 HydrophobicContact CG-SD 3.84Å; Y456-M493 HydrophobicContact CD1-CG 4.47Å; Y456-M493 HydrophobicContact CD2-CB 3.91Å; Y456-M493 HydrophobicContact CD2-CG 3.64Å; Y456-M493 HydrophobicContact CE2-CG 4.01Å; Y456-M493 HydrophobicContact CG-CB 4.3Å; Y456-M493 HydrophobicContact CG-CG 3.87Å; Y456-M493 HydrophobicContact CG-SD 4.41Å; S489-M493 WeakPolarHBondContact O-CE 3.04Å; S489-M493 WeakPolarHBondContact O-CG 3.36Å; S489-M493 PolarHBondContact O-N 3.39Å; K490-M493 WeakPolarHBondContact O-CA 3.14Å; K490-M493 WeakPolarHBondContact O-CB 3.49Å; K490-M493 PolarHBondContact O-N 2.95Å; E491-M493 VanDerWaalsContact C-N 3.27Å; E491-M493 PolarHBondContact O-N 3.45Å; M493-R496 PolarHBondContact O-N 3.48Å; M493-V497 WeakPolarHBondContact O-CG2 3.45Å; M493-V497 PolarHBondContact O-N 2.95Å
494	F	94.1	Very high	89.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-44.7	174.4	-81.6	-63.5	0	0	0	112.8	L452 L472 L478 L481 L486 K490 E491 R496 V497 D498 V514 V518 L519	L452-F494 HydrophobicContact CD1-CD1 3.72Å; L452-F494 HydrophobicContact CD1-CD2 4.18Å; L452-F494 HydrophobicContact CD1-CE1 3.71Å; L452-F494 HydrophobicContact CD1-CE2 4.18Å; L452-F494 HydrophobicContact CD1-CG 3.97Å; L452-F494 HydrophobicContact CD1-CZ 3.96Å; L452-F494 HydrophobicContact CD2-CD2 4Å; L452-F494 HydrophobicContact CD2-CE2 3.73Å; L452-F494 HydrophobicContact CD2-CZ 4.12Å; L472-F494 HydrophobicContact CD1-CE1 4.24Å; L472-F494 HydrophobicContact CG-CE1 4.44Å; L478-F494 HydrophobicContact CD2-CE1 3.74Å; L478-F494 HydrophobicContact CD2-CZ 3.79Å; L481-F494 HydrophobicContact CB-CZ 4.49Å; L481-F494 HydrophobicContact CD1-CE2 4.21Å; L481-F494 HydrophobicContact CD1-CZ 3.6Å; L486-F494 HydrophobicContact CD2-CE2 4.31Å; K490-F494 WeakPolarHBondContact O-CD2 3.42Å; K490-F494 PolarHBondContact O-N 2.99Å; E491-F494 PolarHBondContact O-N 3.26Å; E491-F494 VanDerWaalsContact O-N 3.14Å; F494-R496 PolarHBondContact O-N 3.39Å; F494-V497 PolarHBondContact O-N 3.12Å; F494-V497 VanDerWaalsContact O-N 3.07Å; F494-D498 WeakPolarHBondContact O-CB 3.42Å; F494-D498 PolarHBondContact O-N 2.75Å; F494-V514 HydrophobicContact CB-CG1 4.42Å; F494-V514 HydrophobicContact CD1-CG1 4.08Å; F494-V518 HydrophobicContact CB-CG2 4.1Å; F494-V518 HydrophobicContact CD1-CB 4.47Å; F494-V518 HydrophobicContact CD1-CG2 3.83Å; F494-V518 HydrophobicContact CD2-CB 3.83Å; F494-V518 HydrophobicContact CD2-CG2 4.06Å; F494-V518 HydrophobicContact CE1-CG2 4.17Å; F494-V518 HydrophobicContact CE2-CB 4.02Å; F494-V518 HydrophobicContact CE2-CG1 4.36Å; F494-V518 HydrophobicContact CE2-CG2 4.38Å; F494-V518 HydrophobicContact CG-CB 4.05Å; F494-V518 HydrophobicContact CG-CG2 3.75Å; F494-V518 HydrophobicContact CZ-CB 4.42Å; F494-V518 HydrophobicContact CZ-CG2 4.42Å; F494-L519 HydrophobicContact CB-CD2 4.28Å
495	Q	92.8	Very high	90.4	Very high	30 Å²	30	50.6 Å²	50.6	14%	0.14	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-39	174.4	-70.4	170.6	-10.2	0	0	111.8	E491 I499 L519 F557	E491-Q495 WeakPolarHBondContact O-CB 3.39Å; E491-Q495 VanDerWaalsContact O-CG 3.27Å; E491-Q495 WeakPolarHBondContact O-CG 3.44Å; E491-Q495 PolarHBondContact O-N 3.24Å; Q495-I499 WeakPolarHBondContact O-CB 3.43Å; Q495-I499 WeakPolarHBondContact O-CG2 3.22Å; Q495-I499 PolarHBondContact O-N 3.1Å; Q495-L519 HydrophobicContact CG-CB 4.48Å; Q495-L519 HydrophobicContact CG-CD2 4.24Å; Q495-L519 WeakPolarHBondContact CG-O 3.13Å; Q495-L519 PolarHBondContact NE2-O 2.83Å; Q495-F557 HydrophobicContact CB-CD2 3.65Å; Q495-F557 HydrophobicContact CB-CE2 3.7Å
496	R	93.6	Very high	91.4	Very high	31 Å²	31	46.5 Å²	46.5	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-66.7	-43.6	174.1	-176.9	173.6	-63.7	-174	-4.4	112	Y456 R492 M493 F494 D498 I499 C500 F557 L612	Y456-R496 HydrophobicContact CD2-CB 3.83Å; Y456-R496 HydrophobicContact CD2-CG 4.11Å; Y456-R496 HydrophobicContact CE2-CB 3.92Å; Y456-R496 HydrophobicContact CE2-CG 4.16Å; Y456-R496 VanDerWaalsContact CE2-CZ 3.47Å; Y456-R496 VanDerWaalsContact CE2-NE 3.3Å; Y456-R496 VanDerWaalsContact CZ-CZ 3.48Å; Y456-R496 PolarHBondContact OH-NH1 3.38Å; Y456-R496 PolarHBondContact OH-NH2 3.24Å; R492-R496 PolarHBondContact O-N 2.7Å; R492-R496 VanDerWaalsContact O-N 3.07Å; M493-R496 PolarHBondContact O-N 3.48Å; F494-R496 PolarHBondContact O-N 3.39Å; R496-D498 VanDerWaalsContact C-N 3.33Å; R496-I499 VanDerWaalsContact O-CG2 3.29Å; R496-I499 WeakPolarHBondContact O-CG2 3.49Å; R496-C500 WeakPolarHBondContact O-CB 3.45Å; R496-C500 PolarHBondContact O-N 2.86Å; R496-C500 VanDerWaalsContact O-N 3.12Å; R496-C500 PolarHBondContact O-SG 3.09Å; R496-F557 HydrophobicContact CB-CE2 4.4Å; R496-F557 HydrophobicContact CB-CZ 4.04Å; R496-L612 HydrophobicContact CG-CD2 3.78Å
497	V	96	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-45.8	177.7	172.9	0	0	0	0	110	A455 L469 M493 F494 C500 L501 V514	A455-V497 HydrophobicContact CB-CG2 4.11Å; L469-V497 HydrophobicContact CD2-CG1 4.32Å; M493-V497 WeakPolarHBondContact O-CG2 3.45Å; M493-V497 PolarHBondContact O-N 2.95Å; F494-V497 PolarHBondContact O-N 3.12Å; F494-V497 VanDerWaalsContact O-N 3.07Å; V497-C500 PolarHBondContact O-N 3.44Å; V497-L501 HydrophobicContact CG1-CD1 4.01Å; V497-L501 HydrophobicContact CG1-CG 4.47Å; V497-L501 WeakPolarHBondContact O-CG 3.24Å; V497-L501 PolarHBondContact O-N 3.24Å; V497-V514 HydrophobicContact CG1-CG2 4.16Å
498	D	95.3	Very high	92.1	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.08	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-54.2	177.2	175.3	68.6	0	0	0	112.4	F494 R496 C500 L501 R502 V514 L519	F494-D498 WeakPolarHBondContact O-CB 3.42Å; F494-D498 PolarHBondContact O-N 2.75Å; R496-D498 VanDerWaalsContact C-N 3.33Å; D498-C500 VanDerWaalsContact C-N 3.28Å; D498-C500 PolarHBondContact O-N 2.9Å; D498-L501 PolarHBondContact O-N 2.79Å; D498-L501 VanDerWaalsContact O-N 3.16Å; D498-R502 WeakPolarHBondContact O-CG 3.44Å; D498-R502 PolarHBondContact O-N 3.32Å; D498-R502 IonicContact OD1-NE 3.68Å; D498-R502 PolarHBondContact OD1-NE 3.14Å; D498-R502 IonicContact OD2-CZ 3.77Å; D498-R502 VanDerWaalsContact OD2-CZ 3.27Å; D498-R502 IonicContact OD2-NE 3.12Å; D498-R502 PolarHBondContact OD2-NE 3.42Å; D498-R502 IonicContact OD2-NH2 3.9Å; D498-R502 PolarHBondContact OD2-NH2 3.5Å; D498-V514 HydrophobicContact CB-CB 3.85Å; D498-V514 HydrophobicContact CB-CG1 4.37Å; D498-V514 HydrophobicContact CB-CG2 3.76Å; D498-L519 HydrophobicContact CB-CD2 3.8Å
499	I	94.4	Very high	92.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-35.1	-177.3	-166.4	68	0	0	0	112	Q495 R496 R502 L503 E555 F557 Y558	Q495-I499 WeakPolarHBondContact O-CB 3.43Å; Q495-I499 WeakPolarHBondContact O-CG2 3.22Å; Q495-I499 PolarHBondContact O-N 3.1Å; R496-I499 VanDerWaalsContact O-CG2 3.29Å; R496-I499 WeakPolarHBondContact O-CG2 3.49Å; I499-R502 VanDerWaalsContact CD1-NH2 3.29Å; I499-L503 HydrophobicContact CD1-CD1 3.64Å; I499-L503 HydrophobicContact CD1-CG 3.85Å; I499-L503 HydrophobicContact CG1-CD1 3.75Å; I499-L503 HydrophobicContact CG1-CG 4.14Å; I499-L503 WeakPolarHBondContact O-CB 3.12Å; I499-L503 WeakPolarHBondContact O-CG 3.39Å; I499-L503 PolarHBondContact O-N 3.04Å; I499-E555 HydrophobicContact CD1-CB 3.4Å; I499-E555 VanDerWaalsContact CD1-CB 3.4Å; I499-E555 HydrophobicContact CD1-CG 3.84Å; I499-F557 HydrophobicContact CB-CD1 4.5Å; I499-F557 HydrophobicContact CG1-CD1 4.42Å; I499-F557 HydrophobicContact CG2-CD1 3.96Å; I499-F557 HydrophobicContact CG2-CE1 3.98Å; I499-F557 HydrophobicContact CG2-CG 4.35Å; I499-F557 HydrophobicContact CG2-CZ 4.38Å; I499-Y558 HydrophobicContact CG1-CE2 4.03Å
500	C	96.1	Very high	92.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-45.9	174.2	-69.5	0	0	0	0	111.5	C459 F464 R496 V497 D498 R502 D504	C459-C500 HydrophobicContact CB-CB 3.8Å; F464-C500 HydrophobicContact CE1-CB 3.8Å; F464-C500 HydrophobicContact CZ-CB 4.11Å; R496-C500 WeakPolarHBondContact O-CB 3.45Å; R496-C500 PolarHBondContact O-N 2.86Å; R496-C500 VanDerWaalsContact O-N 3.12Å; R496-C500 PolarHBondContact O-SG 3.09Å; V497-C500 PolarHBondContact O-N 3.44Å; D498-C500 VanDerWaalsContact C-N 3.28Å; D498-C500 PolarHBondContact O-N 2.9Å; C500-R502 VanDerWaalsContact C-N 3.31Å; C500-R502 PolarHBondContact O-N 2.97Å; C500-D504 VanDerWaalsContact CA-OD2 3.31Å; C500-D504 WeakPolarHBondContact CA-OD2 3.46Å; C500-D504 WeakPolarHBondContact CB-OD2 3.39Å; C500-D504 WeakPolarHBondContact O-CA 3.37Å; C500-D504 WeakPolarHBondContact O-CB 3.29Å; C500-D504 PolarHBondContact O-N 3.06Å
501	L	95.4	Very high	92.2	Very high	18 Å²	18	55.3 Å²	55.3	9%	0.094	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-39.9	178.2	-69.5	174.1	0	0	0	112.1	F464 L469 L473 V497 D498 P506 L508 L512 V514	F464-L501 HydrophobicContact CD1-CD2 4.17Å; L469-L501 HydrophobicContact CD1-CD2 4.12Å; L473-L501 HydrophobicContact CD1-CD1 4.24Å; V497-L501 HydrophobicContact CG1-CD1 4.01Å; V497-L501 HydrophobicContact CG1-CG 4.47Å; V497-L501 WeakPolarHBondContact O-CG 3.24Å; V497-L501 PolarHBondContact O-N 3.24Å; D498-L501 PolarHBondContact O-N 2.79Å; D498-L501 VanDerWaalsContact O-N 3.16Å; L501-P506 HydrophobicContact CD2-CG 4Å; L501-L508 HydrophobicContact CD2-CD1 3.98Å; L501-L512 HydrophobicContact CD1-CB 4.33Å; L501-V514 HydrophobicContact CD1-CG2 4.06Å
502	R	94.1	Very high	92.2	Very high	96 Å²	96	55.2 Å²	55.2	36%	0.362	28%	0.277	S	S	.	.	H	α-helix	trans	-74.2	-42.2	-179.1	-69.8	-170.1	-64.7	105.7	-5.1	113.7	D498 I499 C500 R505 E555	D498-R502 WeakPolarHBondContact O-CG 3.44Å; D498-R502 PolarHBondContact O-N 3.32Å; D498-R502 IonicContact OD1-NE 3.68Å; D498-R502 PolarHBondContact OD1-NE 3.14Å; D498-R502 IonicContact OD2-CZ 3.77Å; D498-R502 VanDerWaalsContact OD2-CZ 3.27Å; D498-R502 IonicContact OD2-NE 3.12Å; D498-R502 PolarHBondContact OD2-NE 3.42Å; D498-R502 IonicContact OD2-NH2 3.9Å; D498-R502 PolarHBondContact OD2-NH2 3.5Å; I499-R502 VanDerWaalsContact CD1-NH2 3.29Å; C500-R502 VanDerWaalsContact C-N 3.31Å; C500-R502 PolarHBondContact O-N 2.97Å; R502-R505 WeakPolarHBondContact O-CG 3.43Å; R502-E555 IonicContact CZ-OE2 3.18Å; R502-E555 IonicContact NH1-OE2 3.46Å; R502-E555 PolarHBondContact NH1-OE2 3.36Å; R502-E555 IonicContact NH2-OE2 3.91Å
503	L	94.7	Very high	92.3	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.099	29%	0.292	C	S	.	.	H	α-helix	trans	-90.2	-43.3	-174.9	-62.2	-172.2	0	0	0	113.3	I499 R505 H616 I619 L620	I499-L503 HydrophobicContact CD1-CD1 3.64Å; I499-L503 HydrophobicContact CD1-CG 3.85Å; I499-L503 HydrophobicContact CG1-CD1 3.75Å; I499-L503 HydrophobicContact CG1-CG 4.14Å; I499-L503 WeakPolarHBondContact O-CB 3.12Å; I499-L503 WeakPolarHBondContact O-CG 3.39Å; I499-L503 PolarHBondContact O-N 3.04Å; L503-R505 VanDerWaalsContact C-N 3.3Å; L503-R505 PolarHBondContact O-N 3.43Å; L503-H616 HydrophobicContact CD1-CB 3.66Å; L503-I619 HydrophobicContact CB-CG2 4.41Å; L503-L620 HydrophobicContact CD1-CD1 3.95Å; L503-L620 HydrophobicContact CD1-CD2 4.42Å; L503-L620 HydrophobicContact CD1-CG 4.1Å; L503-L620 HydrophobicContact CD2-CD2 3.74Å; L503-L620 HydrophobicContact CD2-CG 4.23Å
504	D	94.3	Very high	92.2	Very high	29 Å²	29	56.1 Å²	56.1	16%	0.155	29%	0.289	C	S	.	.	H	α-helix	trans	-77	-19.9	-177.8	-58.1	-56.8	0	0	0	112.4	F464 C500 R615 H616	F464-D504 HydrophobicContact CE2-CB 4.14Å; F464-D504 HydrophobicContact CZ-CB 3.78Å; C500-D504 VanDerWaalsContact CA-OD2 3.31Å; C500-D504 WeakPolarHBondContact CA-OD2 3.46Å; C500-D504 WeakPolarHBondContact CB-OD2 3.39Å; C500-D504 WeakPolarHBondContact O-CA 3.37Å; C500-D504 WeakPolarHBondContact O-CB 3.29Å; C500-D504 PolarHBondContact O-N 3.06Å; D504-R615 IonicContact OD1-CZ 3.81Å; D504-R615 VanDerWaalsContact OD1-CZ 3.31Å; D504-R615 IonicContact OD1-NE 3.04Å; D504-R615 PolarHBondContact OD1-NE 2.94Å; D504-R615 IonicContact OD1-NH2 2.72Å; D504-R615 PolarHBondContact OD1-NH2 3.42Å; D504-R615 VanDerWaalsContact OD1-NH2 3.12Å; D504-R615 IonicContact OD2-CZ 3.66Å; D504-R615 IonicContact OD2-NE 2.68Å; D504-R615 IonicContact OD2-NH2 3.65Å; D504-R615 PolarHBondContact OD2-NH2 2.91Å; D504-H616 IonicContact OD1-CD2 3.29Å; D504-H616 IonicContact OD1-NE2 3.74Å; D504-H616 PolarHBondContact OD1-NE2 3.23Å; D504-H616 IonicContact OD2-CE1 2.69Å; D504-H616 IonicContact OD2-NE2 3.51Å; D504-H616 PolarHBondContact OD2-NE2 2.87Å; D504-H616 VanDerWaalsContact OD2-NE2 3.15Å
505	R	91.6	Very high	92	Very high	210 Å²	210	58 Å²	58	79%	0.792	30%	0.301	S	S	*	.			trans	44.5	59	178	-60.2	-176.3	-176.1	168.9	1.4	113	R502 L503	R502-R505 WeakPolarHBondContact O-CG 3.43Å; L503-R505 VanDerWaalsContact C-N 3.3Å; L503-R505 PolarHBondContact O-N 3.43Å
506	P	92	Very high	91.7	Very high	21 Å²	21	61.9 Å²	61.9	14%	0.136	33%	0.329	C	S	.	.			trans	-60.9	147.2	-178.3	26.4	-34.9	0	0	0	111.8	F464 L501 L508	F464-P506 HydrophobicContact CB-CB 3.75Å; F464-P506 HydrophobicContact CB-CG 4.04Å; F464-P506 HydrophobicContact CD1-CB 4.22Å; F464-P506 HydrophobicContact CD1-CG 3.84Å; F464-P506 HydrophobicContact CD2-CB 3.53Å; F464-P506 HydrophobicContact CD2-CG 4.04Å; F464-P506 HydrophobicContact CE1-CG 4.25Å; F464-P506 HydrophobicContact CE2-CB 4.12Å; F464-P506 HydrophobicContact CE2-CG 4.43Å; F464-P506 HydrophobicContact CG-CB 3.57Å; F464-P506 HydrophobicContact CG-CG 3.71Å; L501-P506 HydrophobicContact CD2-CG 4Å; P506-L508 HydrophobicContact CB-CG 4.19Å; P506-L508 HydrophobicContact CG-CD1 3.9Å; P506-L508 HydrophobicContact CG-CG 3.96Å; P506-L508 PolarHBondContact O-N 3.14Å
507	P	88.3	Confident	91.3	Very high	139 Å²	139	65.1 Å²	65.1	90%	0.903	36%	0.356	S	S	*	.			trans	-75.6	69.2	-179.7	33	-36.2	0	0	0	111.1
508	L	90	Very high	90.9	Very high	35 Å²	35	65.3 Å²	65.3	18%	0.183	36%	0.357	C	S	.	.			trans	-81.6	151.9	178.9	-64.2	173	0	0	0	111.2	F464 L469 L501 P506 Q510 L512	F464-L508 HydrophobicContact CB-CD2 4.33Å; L469-L508 HydrophobicContact CD1-CD1 4.31Å; L469-L508 HydrophobicContact CD1-CD2 4.3Å; L501-L508 HydrophobicContact CD2-CD1 3.98Å; P506-L508 HydrophobicContact CB-CG 4.19Å; P506-L508 HydrophobicContact CG-CD1 3.9Å; P506-L508 HydrophobicContact CG-CG 3.96Å; P506-L508 PolarHBondContact O-N 3.14Å; L508-Q510 WeakPolarHBondContact CB-O 3.04Å; L508-Q510 PolarHBondContact O-N 3.22Å; L508-L512 HydrophobicContact CD1-CB 4.33Å; L508-L512 HydrophobicContact CD1-CD1 3.98Å; L508-L512 HydrophobicContact CD1-CG 4.19Å
509	P	87.8	Confident	90.3	Very high	101 Å²	101	66.2 Å²	66.2	66%	0.656	36%	0.362	S	S	*	.	S	Bend	trans	-57.4	-33.4	176.4	-24.1	33.8	0	0	0	113.3
510	Q	86.4	Confident	89.6	Confident	135 Å²	135	67.9 Å²	67.9	63%	0.631	38%	0.379	S	S	*	.	S	Bend	trans	-139.3	146.3	176.1	-62.9	-179.2	6.9	0	0	110	L508 L512	L508-Q510 WeakPolarHBondContact CB-O 3.04Å; L508-Q510 PolarHBondContact O-N 3.22Å; Q510-L512 PolarHBondContact O-N 3.05Å
511	P	86.5	Confident	88.4	Confident	126 Å²	126	72.1 Å²	72.1	82%	0.818	41%	0.409	S	S	*	.			trans	-63.1	123.2	174.5	-20.4	32.4	0	0	0	111.2
512	L	91.4	Very high	87	Confident	36 Å²	36	75.3 Å²	75.3	19%	0.188	43%	0.43	C	S	.	.			trans	-102.6	131.1	176.1	-67.4	179.7	0	0	0	110.2	L469 E470 L473 L501 L508 Q510	L469-L512 HydrophobicContact CB-CD1 3.46Å; L469-L512 VanDerWaalsContact CB-CD1 3.46Å; E470-L512 HydrophobicContact CG-CD1 4.1Å; E470-L512 HydrophobicContact CG-CD2 4.16Å; L473-L512 HydrophobicContact CD1-CB 3.76Å; L473-L512 HydrophobicContact CD1-CD1 4.3Å; L473-L512 HydrophobicContact CD1-CD2 4.5Å; L473-L512 HydrophobicContact CD1-CG 4.41Å; L501-L512 HydrophobicContact CD1-CB 4.33Å; L508-L512 HydrophobicContact CD1-CB 4.33Å; L508-L512 HydrophobicContact CD1-CD1 3.98Å; L508-L512 HydrophobicContact CD1-CG 4.19Å; Q510-L512 PolarHBondContact O-N 3.05Å
513	I	90.8	Very high	85.4	Confident	134 Å²	134	74.2 Å²	74.2	69%	0.687	44%	0.435	S	S	*	.			trans	-122.7	131.9	-178.6	-57.6	175.9	0	0	0	108.8	P515	I513-P515 WeakPolarHBondContact O-CD 3.49Å
514	V	91.6	Very high	83.6	Confident	3 Å²	3	77.8 Å²	77.8	2%	0.018	46%	0.459	C	S	.	.			trans	-80.6	126	174.5	-174.9	0	0	0	0	109	L473 F494 V497 D498 L501 V518 L519	L473-V514 HydrophobicContact CD2-CB 4.48Å; L473-V514 HydrophobicContact CD2-CG1 4.48Å; L473-V514 HydrophobicContact CD2-CG2 4.05Å; F494-V514 HydrophobicContact CB-CG1 4.42Å; F494-V514 HydrophobicContact CD1-CG1 4.08Å; V497-V514 HydrophobicContact CG1-CG2 4.16Å; D498-V514 HydrophobicContact CB-CB 3.85Å; D498-V514 HydrophobicContact CB-CG1 4.37Å; D498-V514 HydrophobicContact CB-CG2 3.76Å; L501-V514 HydrophobicContact CD1-CG2 4.06Å; V514-V518 HydrophobicContact CG1-CG2 3.56Å; V514-L519 HydrophobicContact CB-CD2 4.42Å; V514-L519 HydrophobicContact CG1-CD2 3.77Å; V514-L519 HydrophobicContact CG1-CG 4.4Å
515	P	89.6	Confident	81.9	Confident	40 Å²	40	83.4 Å²	83.4	26%	0.26	49%	0.489	S	S	.	.			trans	-64.4	139.5	-178.5	-29.9	41	0	0	0	113.1	L478 I513 S517 V518	L478-P515 HydrophobicContact CD1-CG 3.64Å; I513-P515 WeakPolarHBondContact O-CD 3.49Å; P515-S517 PolarHBondContact O-N 2.87Å; P515-V518 VanDerWaalsContact O-CG2 3.22Å; P515-V518 WeakPolarHBondContact O-CG2 3.45Å; P515-V518 PolarHBondContact O-N 3.02Å; P515-V518 VanDerWaalsContact O-N 3.16Å
516	P	86.9	Confident	80.7	Confident	111 Å²	111	75.5 Å²	75.5	72%	0.721	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-57.5	-26.1	179	-26.8	34.5	0	0	0	114.4	V518 L519	P516-V518 PolarHBondContact O-N 3.19Å; P516-L519 PolarHBondContact O-N 3.24Å
517	S	85	Confident	79.8	Confident	100 Å²	100	77.7 Å²	77.7	70%	0.699	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-60.5	-25.3	179.4	54.1	0	0	0	0	114	P515	P515-S517 PolarHBondContact O-N 2.87Å
518	V	86.3	Confident	79.3	Confident	3 Å²	3	74 Å²	74	2%	0.018	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-100.4	-5.1	-179.4	-59.7	0	0	0	0	114.1	L478 L486 F494 V514 P515 P516	L478-V518 HydrophobicContact CD2-CG1 4.29Å; L486-V518 HydrophobicContact CD1-CB 4.38Å; L486-V518 HydrophobicContact CD1-CG1 4.34Å; F494-V518 HydrophobicContact CB-CG2 4.1Å; F494-V518 HydrophobicContact CD1-CB 4.47Å; F494-V518 HydrophobicContact CD1-CG2 3.83Å; F494-V518 HydrophobicContact CD2-CB 3.83Å; F494-V518 HydrophobicContact CD2-CG2 4.06Å; F494-V518 HydrophobicContact CE1-CG2 4.17Å; F494-V518 HydrophobicContact CE2-CB 4.02Å; F494-V518 HydrophobicContact CE2-CG1 4.36Å; F494-V518 HydrophobicContact CE2-CG2 4.38Å; F494-V518 HydrophobicContact CG-CB 4.05Å; F494-V518 HydrophobicContact CG-CG2 3.75Å; F494-V518 HydrophobicContact CZ-CB 4.42Å; F494-V518 HydrophobicContact CZ-CG2 4.42Å; V514-V518 HydrophobicContact CG1-CG2 3.56Å; P515-V518 VanDerWaalsContact O-CG2 3.22Å; P515-V518 WeakPolarHBondContact O-CG2 3.45Å; P515-V518 PolarHBondContact O-N 3.02Å; P515-V518 VanDerWaalsContact O-N 3.16Å; P516-V518 PolarHBondContact O-N 3.19Å
519	L	83.4	Confident	79	Confident	35 Å²	35	74.2 Å²	74.2	18%	0.183	46%	0.457	C	S	.	.	S	Bend	trans	-82.9	-12.2	-176.2	-62.4	-179.7	0	0	0	113.4	F494 Q495 D498 V514 P516	F494-L519 HydrophobicContact CB-CD2 4.28Å; Q495-L519 HydrophobicContact CG-CB 4.48Å; Q495-L519 HydrophobicContact CG-CD2 4.24Å; Q495-L519 WeakPolarHBondContact CG-O 3.13Å; Q495-L519 PolarHBondContact NE2-O 2.83Å; D498-L519 HydrophobicContact CB-CD2 3.8Å; V514-L519 HydrophobicContact CB-CD2 4.42Å; V514-L519 HydrophobicContact CG1-CD2 3.77Å; V514-L519 HydrophobicContact CG1-CG 4.4Å; P516-L519 PolarHBondContact O-N 3.24Å
520	G	79.3	Confident	78.8	Confident	35 Å²	35	73.7 Å²	73.7	36%	0.361	45%	0.454	S	S	.	.			trans	63.5	-173.6	179.6	0	0	0	0	0	113.5
521	S	71.7	Confident	78.8	Confident	88 Å²	88	71 Å²	71	62%	0.615	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-86.8	150.5	177.4	61.3	0	0	0	0	112.1
522	P	65.8	Low	78.8	Confident	85 Å²	85	65.2 Å²	65.2	55%	0.552	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-54.7	143.4	173.1	-20.6	30.6	0	0	0	111.8
523	T	60.3	Low	78.6	Confident	73 Å²	73	64 Å²	64	45%	0.448	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-68.1	146.2	175.4	39.1	0	0	0	0	111.6
524	P	57.2	Low	78.5	Confident	95 Å²	95	61 Å²	61	62%	0.617	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-57.6	151.3	176.7	-19	29.6	0	0	0	112.2
525	N	57.8	Low	78.3	Confident	146 Å²	146	60.9 Å²	60.9	78%	0.781	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-53.8	123	-178.5	-68.3	-13.9	0	0	0	111.3
526	P	67	Low	78.3	Confident	44 Å²	44	59 Å²	59	29%	0.286	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-69.6	155	174.4	20.4	-20.2	0	0	0	111.2	M551 V559	P526-M551 HydrophobicContact CB-SD 4.13Å; P526-M551 HydrophobicContact CG-SD 3.82Å; P526-V559 HydrophobicContact CB-CG1 4.37Å; P526-V559 HydrophobicContact CG-CB 4.2Å; P526-V559 HydrophobicContact CG-CG1 3.28Å; P526-V559 HydrophobicContact CG-CG2 3.93Å
527	S	71.5	Confident	78.4	Confident	68 Å²	68	58.5 Å²	58.5	48%	0.476	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-79.7	133.2	177	54.7	0	0	0	0	111	M551	S527-M551 WeakPolarHBondContact O-CE 3.35Å
528	V	78.6	Confident	78.5	Confident	60 Å²	60	58.9 Å²	58.9	36%	0.364	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-56.3	133.9	173.5	-174.8	0	0	0	0	110.8	P530 M551	V528-P530 VanDerWaalsContact O-CD 3.28Å; V528-P530 WeakPolarHBondContact O-CD 3.47Å; V528-M551 VanDerWaalsContact CA-CE 3.48Å; V528-M551 HydrophobicContact CB-CE 4.46Å; V528-M551 HydrophobicContact CB-CG 4.39Å; V528-M551 HydrophobicContact CG2-CG 3.57Å
529	N	83.2	Confident	78.5	Confident	41 Å²	41	58.8 Å²	58.8	22%	0.219	34%	0.34	C	S	.	.			trans	-73.8	110.4	168.1	-177.4	-34.6	0	0	0	108.5	R531 L532 S533	N529-R531 VanDerWaalsContact C-N 3.28Å; N529-R531 PolarHBondContact O-N 3.36Å; N529-R531 PolarHBondContact OD1-N 3.5Å; N529-R531 VanDerWaalsContact OD1-N 3.16Å; N529-L532 HydrophobicContact CB-CB 4.11Å; N529-L532 PolarHBondContact O-N 2.79Å; N529-L532 PolarHBondContact OD1-N 3.43Å; N529-S533 WeakPolarHBondContact O-CB 3.41Å; N529-S533 PolarHBondContact O-N 2.84Å
530	P	85.1	Confident	78.7	Confident	90 Å²	90	58 Å²	58	58%	0.584	34%	0.336	S	S	*	.	H	α-helix	trans	-66	-31.9	-169.5	26.9	-35	0	0	0	112.4	V528 N534	V528-P530 VanDerWaalsContact O-CD 3.28Å; V528-P530 WeakPolarHBondContact O-CD 3.47Å; P530-N534 WeakPolarHBondContact O-CB 3.42Å; P530-N534 PolarHBondContact O-N 2.99Å; P530-N534 PolarHBondContact O-ND2 2.96Å; P530-N534 PolarHBondContact O-OD1 3.45Å
531	R	84.9	Confident	78.8	Confident	79 Å²	79	60.1 Å²	60.1	30%	0.298	35%	0.35	S	S	.	.	H	α-helix	trans	-70.6	-44.9	-179.3	-162.5	179.5	-172.9	-179.6	0.5	110.9	N529 S535 L632 L635 M640	N529-R531 VanDerWaalsContact C-N 3.28Å; N529-R531 PolarHBondContact O-N 3.36Å; N529-R531 PolarHBondContact OD1-N 3.5Å; N529-R531 VanDerWaalsContact OD1-N 3.16Å; R531-S535 PolarHBondContact O-N 3.44Å; R531-S535 PolarHBondContact O-OG 2.84Å; R531-L632 PolarHBondContact NE-O 2.67Å; R531-L632 PolarHBondContact NH1-O 3.39Å; R531-L635 PolarHBondContact NH2-O 3.39Å; R531-M640 HydrophobicContact CG-CE 4.23Å; R531-M640 HydrophobicContact CG-SD 4.46Å
532	L	86.4	Confident	78.9	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.021	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-44.6	175.5	179.5	59.2	0	0	0	111.2	N529 S535 L536 D561 V591 V627 L632 L644	N529-L532 HydrophobicContact CB-CB 4.11Å; N529-L532 PolarHBondContact O-N 2.79Å; N529-L532 PolarHBondContact OD1-N 3.43Å; L532-S535 PolarHBondContact O-N 3.44Å; L532-L536 HydrophobicContact CD1-CD1 3.94Å; L532-L536 HydrophobicContact CD1-CG 4.07Å; L532-L536 HydrophobicContact CG-CD1 3.86Å; L532-L536 HydrophobicContact CG-CG 4.41Å; L532-L536 WeakPolarHBondContact O-CB 3.37Å; L532-L536 VanDerWaalsContact O-CG 3.3Å; L532-L536 WeakPolarHBondContact O-CG 3.47Å; L532-L536 PolarHBondContact O-N 3.24Å; L532-D561 HydrophobicContact CD2-CB 3.95Å; L532-V591 HydrophobicContact CD1-CG1 4.24Å; L532-V591 HydrophobicContact CD2-CG1 4.49Å; L532-V627 HydrophobicContact CD1-CG1 4.23Å; L532-V627 HydrophobicContact CD1-CG2 4.26Å; L532-L632 HydrophobicContact CB-CD2 4.37Å; L532-L632 HydrophobicContact CD1-CD2 4.49Å; L532-L644 HydrophobicContact CD1-CD1 4.22Å
533	S	88.7	Confident	79.5	Confident	10 Å²	10	59.4 Å²	59.4	7%	0.07	33%	0.333	C	S	.	.	H	α-helix	trans	-56.9	-51.9	177.2	178.8	0	0	0	0	112.1	N529 S535 L536 Q537 E550	N529-S533 WeakPolarHBondContact O-CB 3.41Å; N529-S533 PolarHBondContact O-N 2.84Å; S533-S535 PolarHBondContact O-N 3.4Å; S533-L536 PolarHBondContact O-N 3.09Å; S533-Q537 VanDerWaalsContact O-CG 3.31Å; S533-Q537 WeakPolarHBondContact O-CG 3.43Å; S533-Q537 PolarHBondContact O-N 2.89Å; S533-Q537 PolarHBondContact OG-NE2 2.93Å; S533-E550 WeakPolarHBondContact CA-OE1 3.5Å; S533-E550 WeakPolarHBondContact CB-OE1 3.43Å; S533-E550 VanDerWaalsContact OG-CD 3.31Å; S533-E550 PolarHBondContact OG-OE1 3.26Å; S533-E550 PolarHBondContact OG-OE2 2.98Å
534	N	87.9	Confident	79.9	Confident	71 Å²	71	60.8 Å²	60.8	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-59.1	-44.3	179.2	-71.9	-13	0	0	0	112.4	P530 Q537 R538	P530-N534 WeakPolarHBondContact O-CB 3.42Å; P530-N534 PolarHBondContact O-N 2.99Å; P530-N534 PolarHBondContact O-ND2 2.96Å; P530-N534 PolarHBondContact O-OD1 3.45Å; N534-Q537 PolarHBondContact O-N 3.22Å; N534-R538 WeakPolarHBondContact O-CG 3.47Å; N534-R538 PolarHBondContact O-N 3.32Å; N534-R538 VanDerWaalsContact O-N 3.09Å
535	S	87.6	Confident	80.9	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.007	36%	0.355	C	S	.	.	H	α-helix	trans	-67.6	-39.9	178.9	-68.5	0	0	0	0	112.3	R531 L532 S533 R538 V539 M640	R531-S535 PolarHBondContact O-N 3.44Å; R531-S535 PolarHBondContact O-OG 2.84Å; L532-S535 PolarHBondContact O-N 3.44Å; S533-S535 PolarHBondContact O-N 3.4Å; S535-R538 PolarHBondContact O-N 2.92Å; S535-V539 WeakPolarHBondContact O-CG2 3.28Å; S535-V539 PolarHBondContact O-N 3.49Å; S535-M640 PolarHBondContact OG-SD 2.87Å
536	L	89.5	Confident	82.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-41.4	175	-72.7	171.5	0	0	0	112.2	L532 S533 R538 V539 L540 L548 A562 V591 L644 I648	L532-L536 HydrophobicContact CD1-CD1 3.94Å; L532-L536 HydrophobicContact CD1-CG 4.07Å; L532-L536 HydrophobicContact CG-CD1 3.86Å; L532-L536 HydrophobicContact CG-CG 4.41Å; L532-L536 WeakPolarHBondContact O-CB 3.37Å; L532-L536 VanDerWaalsContact O-CG 3.3Å; L532-L536 WeakPolarHBondContact O-CG 3.47Å; L532-L536 PolarHBondContact O-N 3.24Å; S533-L536 PolarHBondContact O-N 3.09Å; L536-R538 VanDerWaalsContact C-N 3.28Å; L536-R538 PolarHBondContact O-N 3.4Å; L536-V539 PolarHBondContact O-N 3.04Å; L536-L540 WeakPolarHBondContact O-CB 3.25Å; L536-L540 VanDerWaalsContact O-CG 3.29Å; L536-L540 WeakPolarHBondContact O-CG 3.47Å; L536-L540 PolarHBondContact O-N 3.31Å; L536-L548 HydrophobicContact CB-CD1 4.35Å; L536-L548 HydrophobicContact CB-CD2 4.27Å; L536-L548 HydrophobicContact CD1-CD1 4.35Å; L536-A562 HydrophobicContact CD1-CB 3.38Å; L536-V591 HydrophobicContact CD1-CG1 4.34Å; L536-V591 HydrophobicContact CD2-CG1 4.42Å; L536-V591 HydrophobicContact CD2-CG2 4.22Å; L536-L644 HydrophobicContact CD2-CD1 4.26Å; L536-L644 HydrophobicContact CG-CD1 4.46Å; L536-I648 HydrophobicContact CD2-CD1 3.61Å
537	Q	89.2	Confident	83.2	Confident	99 Å²	99	57.9 Å²	57.9	46%	0.463	33%	0.334	S	S	.	.	H	α-helix	trans	-60.5	-38.3	175.1	-72.6	175.3	12.4	0	0	111.7	S533 N534 L540 A541 L548	S533-Q537 VanDerWaalsContact O-CG 3.31Å; S533-Q537 WeakPolarHBondContact O-CG 3.43Å; S533-Q537 PolarHBondContact O-N 2.89Å; S533-Q537 PolarHBondContact OG-NE2 2.93Å; N534-Q537 PolarHBondContact O-N 3.22Å; Q537-L540 PolarHBondContact O-N 2.85Å; Q537-A541 PolarHBondContact O-N 2.85Å; Q537-L548 HydrophobicContact CG-CD2 3.99Å
538	R	87.2	Confident	84	Confident	109 Å²	109	57 Å²	57	41%	0.411	32%	0.324	S	S	.	.	H	α-helix	trans	-68.8	-43.5	174.8	-71.6	-178.9	-170.8	141.8	-3.6	113	N534 S535 L536 L540 A541 E637 T641	N534-R538 WeakPolarHBondContact O-CG 3.47Å; N534-R538 PolarHBondContact O-N 3.32Å; N534-R538 VanDerWaalsContact O-N 3.09Å; S535-R538 PolarHBondContact O-N 2.92Å; L536-R538 VanDerWaalsContact C-N 3.28Å; L536-R538 PolarHBondContact O-N 3.4Å; R538-L540 PolarHBondContact O-N 3.27Å; R538-A541 WeakPolarHBondContact O-CB 3.26Å; R538-A541 PolarHBondContact O-N 3.42Å; R538-E637 IonicContact CZ-OE2 2.94Å; R538-E637 VanDerWaalsContact CZ-OE2 3.23Å; R538-E637 IonicContact NH1-OE2 3.7Å; R538-E637 PolarHBondContact NH1-OE2 3.2Å; R538-E637 IonicContact NH2-OE2 2.73Å; R538-E637 PolarHBondContact NH2-OE2 3.33Å; R538-T641 HydrophobicContact CB-CG2 3.89Å
539	V	87	Confident	84.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57	-37	175.6	171.6	0	0	0	0	111	S535 L536 T641 L644 R645 F649	S535-V539 WeakPolarHBondContact O-CG2 3.28Å; S535-V539 PolarHBondContact O-N 3.49Å; L536-V539 PolarHBondContact O-N 3.04Å; V539-T641 HydrophobicContact CG2-CG2 3.61Å; V539-T641 VanDerWaalsContact CG2-O 3.26Å; V539-T641 WeakPolarHBondContact CG2-O 3.36Å; V539-L644 HydrophobicContact CG2-CB 3.88Å; V539-R645 HydrophobicContact CG1-CB 4.21Å; V539-R645 HydrophobicContact CG1-CG 4.45Å; V539-R645 HydrophobicContact CG2-CB 4.37Å; V539-F649 HydrophobicContact CG1-CD2 4.08Å; V539-F649 HydrophobicContact CG1-CE2 3.83Å
540	L	86.6	Confident	84.7	Confident	20 Å²	20	60 Å²	60	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-89.7	-12.5	-176.2	-63.4	172.8	0	0	0	114.2	L536 Q537 R538 D542 Q543 A546 L548 V564 F649	L536-L540 WeakPolarHBondContact O-CB 3.25Å; L536-L540 VanDerWaalsContact O-CG 3.29Å; L536-L540 WeakPolarHBondContact O-CG 3.47Å; L536-L540 PolarHBondContact O-N 3.31Å; Q537-L540 PolarHBondContact O-N 2.85Å; R538-L540 PolarHBondContact O-N 3.27Å; L540-D542 PolarHBondContact O-N 3.45Å; L540-Q543 HydrophobicContact CD2-CB 4.48Å; L540-Q543 PolarHBondContact O-N 2.96Å; L540-A546 HydrophobicContact CD2-CB 3.59Å; L540-L548 HydrophobicContact CD1-CB 3.56Å; L540-L548 HydrophobicContact CD1-CD1 3.89Å; L540-L548 HydrophobicContact CD1-CD2 4.13Å; L540-L548 HydrophobicContact CD1-CG 4.05Å; L540-V564 HydrophobicContact CD1-CG1 4.49Å; L540-V564 HydrophobicContact CD1-CG2 4.18Å; L540-V564 HydrophobicContact CD2-CG1 3.83Å; L540-F649 HydrophobicContact CD2-CE2 3.98Å; L540-F649 HydrophobicContact CD2-CZ 3.83Å
541	A	82.5	Confident	84.8	Confident	79 Å²	79	57.2 Å²	57.2	65%	0.653	31%	0.312	S	S	*	.	H	α-helix	trans	-58.2	-31.7	177.1	0	0	0	0	0	112.2	Q537 R538	Q537-A541 PolarHBondContact O-N 2.85Å; R538-A541 WeakPolarHBondContact O-CB 3.26Å; R538-A541 PolarHBondContact O-N 3.42Å
542	D	72.5	Confident	84.9	Confident	110 Å²	110	55.8 Å²	55.8	59%	0.588	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.3	-179.7	-52.4	-39.3	0	0	0	113.3	L540 R645	L540-D542 PolarHBondContact O-N 3.45Å; D542-R645 IonicContact OD2-CZ 3.86Å; D542-R645 IonicContact OD2-NH1 3.64Å; D542-R645 PolarHBondContact OD2-NH1 3.06Å; D542-R645 VanDerWaalsContact OD2-NH1 3.15Å; D542-R645 IonicContact OD2-NH2 3.42Å; D542-R645 PolarHBondContact OD2-NH2 3.14Å
543	Q	78.3	Confident	85	Confident	47 Å²	47	58.1 Å²	58.1	22%	0.22	32%	0.324	C	S	.	.			trans	-116.3	88.1	-168.3	-65.9	-69.9	-15	0	0	111.7	L540 N545 A546 F649 D652	L540-Q543 HydrophobicContact CD2-CB 4.48Å; L540-Q543 PolarHBondContact O-N 2.96Å; Q543-N545 PolarHBondContact O-N 2.83Å; Q543-A546 HydrophobicContact CB-CB 3.97Å; Q543-A546 PolarHBondContact O-N 3.34Å; Q543-F649 HydrophobicContact CB-CZ 4.26Å; Q543-F649 HydrophobicContact CG-CE1 4.17Å; Q543-F649 HydrophobicContact CG-CE2 4.08Å; Q543-F649 HydrophobicContact CG-CZ 3.82Å; Q543-D652 PolarHBondContact NE2-OD2 2.97Å
544	A	68.4	Low	84.9	Confident	102 Å²	102	58.2 Å²	58.2	84%	0.843	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.8	-173.2	0	0	0	0	0	115.3
545	N	79.3	Confident	84.8	Confident	128 Å²	128	58.2 Å²	58.2	68%	0.684	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	5.8	-175.2	-63.2	-27.8	0	0	0	113.9	Q543 P567	Q543-N545 PolarHBondContact O-N 2.83Å; N545-P567 HydrophobicContact CB-CG 3.79Å
546	A	83.9	Confident	84.6	Confident	18 Å²	18	63.9 Å²	63.9	15%	0.149	35%	0.353	C	S	.	.			trans	-106.5	137	-178.7	0	0	0	0	0	111.3	L540 Q543 V564 T565 K566 F649	L540-A546 HydrophobicContact CD2-CB 3.59Å; Q543-A546 HydrophobicContact CB-CB 3.97Å; Q543-A546 PolarHBondContact O-N 3.34Å; A546-V564 HydrophobicContact CB-CG1 4.43Å; A546-T565 CarbonylContact C-O 3.56Å; A546-T565 WeakPolarHBondContact CA-O 3.48Å; A546-K566 HydrophobicContact CB-CB 4.39Å; A546-F649 HydrophobicContact CB-CE1 4.45Å; A546-F649 HydrophobicContact CB-CZ 3.99Å
547	T	87.9	Confident	84.4	Confident	78 Å²	78	66.1 Å²	66.1	48%	0.479	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.5	178.4	58.8	0	0	0	0	111.3	V564 T565	T547-V564 CarbonylContact O-C 3.51Å; T547-V564 WeakPolarHBondContact O-CA 3.37Å; T547-T565 PolarHBondContact N-O 3.03Å; T547-T565 PolarHBondContact O-N 2.91Å; T547-T565 WeakPolarHBondContact OG1-CB 3.18Å
548	L	88.8	Confident	84.4	Confident	50 Å²	50	61.9 Å²	61.9	26%	0.262	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.6	177.6	-173.5	60.4	0	0	0	110.6	L536 Q537 L540 E550 A562 V564	L536-L548 HydrophobicContact CB-CD1 4.35Å; L536-L548 HydrophobicContact CB-CD2 4.27Å; L536-L548 HydrophobicContact CD1-CD1 4.35Å; Q537-L548 HydrophobicContact CG-CD2 3.99Å; L540-L548 HydrophobicContact CD1-CB 3.56Å; L540-L548 HydrophobicContact CD1-CD1 3.89Å; L540-L548 HydrophobicContact CD1-CD2 4.13Å; L540-L548 HydrophobicContact CD1-CG 4.05Å; L548-E550 HydrophobicContact CD1-CG 4.46Å; L548-E550 HydrophobicContact CD2-CG 4.1Å; L548-E550 HydrophobicContact CG-CG 4.03Å; L548-A562 HydrophobicContact CD1-CB 3.82Å; L548-V564 HydrophobicContact CD1-CG2 4.03Å
549	Q	88.3	Confident	84.5	Confident	100 Å²	100	58.6 Å²	58.6	47%	0.467	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	119	167.2	-64.8	-179.6	2.7	0	0	109.3	A562 V563	Q549-A562 CarbonylContact O-C 3.55Å; Q549-A562 WeakPolarHBondContact O-CA 3.32Å; Q549-V563 HydrophobicContact CB-CB 4.41Å; Q549-V563 PolarHBondContact N-O 3.44Å; Q549-V563 PolarHBondContact O-N 3.23Å
550	E	88.4	Confident	84.7	Confident	65 Å²	65	58.6 Å²	58.6	30%	0.304	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	148.3	-178.5	-60.9	-174.5	145.5	0	0	111.7	S533 L548 L552 D561	S533-E550 WeakPolarHBondContact CA-OE1 3.5Å; S533-E550 WeakPolarHBondContact CB-OE1 3.43Å; S533-E550 VanDerWaalsContact OG-CD 3.31Å; S533-E550 PolarHBondContact OG-OE1 3.26Å; S533-E550 PolarHBondContact OG-OE2 2.98Å; L548-E550 HydrophobicContact CD1-CG 4.46Å; L548-E550 HydrophobicContact CD2-CG 4.1Å; L548-E550 HydrophobicContact CG-CG 4.03Å; E550-L552 VanDerWaalsContact C-N 3.34Å; E550-L552 PolarHBondContact O-N 3.38Å; E550-D561 WeakPolarHBondContact CA-O 3.47Å
551	M	87.9	Confident	84.9	Confident	31 Å²	31	59 Å²	59	15%	0.153	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	54.1	45.8	175.7	-66.6	-65.8	156.1	0	0	113.8	P526 S527 V528 V553 V559 I560 D561	P526-M551 HydrophobicContact CB-SD 4.13Å; P526-M551 HydrophobicContact CG-SD 3.82Å; S527-M551 WeakPolarHBondContact O-CE 3.35Å; V528-M551 VanDerWaalsContact CA-CE 3.48Å; V528-M551 HydrophobicContact CB-CE 4.46Å; V528-M551 HydrophobicContact CB-CG 4.39Å; V528-M551 HydrophobicContact CG2-CG 3.57Å; M551-V553 PolarHBondContact O-N 3.45Å; M551-V559 HydrophobicContact SD-CG1 4.04Å; M551-I560 CarbonylContact C-O 3.53Å; M551-I560 VanDerWaalsContact CA-O 3.28Å; M551-I560 WeakPolarHBondContact CA-O 3.39Å; M551-I560 PolarHBondContact N-O 3.25Å; M551-D561 HydrophobicContact CE-CB 4.17Å; M551-D561 WeakPolarHBondContact CE-OD1 3.41Å; M551-D561 PolarHBondContact N-O 3.18Å
552	L	87.3	Confident	85.3	Confident	48 Å²	48	55.3 Å²	55.3	25%	0.251	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.4	177.9	-174.8	67.1	0	0	0	110.3	E550 V554 I560 V563	E550-L552 VanDerWaalsContact C-N 3.34Å; E550-L552 PolarHBondContact O-N 3.38Å; L552-V554 HydrophobicContact CD2-CG2 3.65Å; L552-V554 HydrophobicContact CG-CG2 3.81Å; L552-I560 PolarHBondContact N-O 3.49Å; L552-I560 PolarHBondContact O-N 2.9Å; L552-V563 HydrophobicContact CB-CG2 4.21Å; L552-V563 HydrophobicContact CD2-CG2 3.76Å
553	V	86.8	Confident	86.2	Confident	53 Å²	53	50.1 Å²	50.1	32%	0.321	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.9	168.7	-176.1	0	0	0	0	108.9	M551 Y558 V559	M551-V553 PolarHBondContact O-N 3.45Å; V553-Y558 CarbonylContact C-O 3.52Å; V553-Y558 WeakPolarHBondContact CA-O 3.29Å; V553-V559 HydrophobicContact CG2-CG2 4.44Å
554	V	86.6	Confident	86.8	Confident	12 Å²	12	47.9 Å²	47.9	7%	0.073	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133	179.7	177.4	0	0	0	0	109.3	L552 N556 F557 Y558 I560 L620 Y622	L552-V554 HydrophobicContact CD2-CG2 3.65Å; L552-V554 HydrophobicContact CG-CG2 3.81Å; V554-N556 PolarHBondContact O-N 3.02Å; V554-N556 VanDerWaalsContact O-N 3.12Å; V554-F557 PolarHBondContact O-N 2.87Å; V554-F557 VanDerWaalsContact O-N 3.12Å; V554-Y558 PolarHBondContact N-O 3.01Å; V554-Y558 PolarHBondContact O-N 3.42Å; V554-I560 HydrophobicContact CB-CD1 4.28Å; V554-I560 HydrophobicContact CG2-CD1 3.52Å; V554-I560 HydrophobicContact CG2-CG1 4.21Å; V554-L620 HydrophobicContact CG1-CD1 3.59Å; V554-Y622 HydrophobicContact CG1-CE2 4.45Å
555	E	87.2	Confident	87.8	Confident	71 Å²	71	44.3 Å²	44.3	33%	0.332	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	26	179.3	-62.9	-64.8	149.1	0	0	114.5	I499 R502 F557 L620	I499-E555 HydrophobicContact CD1-CB 3.4Å; I499-E555 VanDerWaalsContact CD1-CB 3.4Å; I499-E555 HydrophobicContact CD1-CG 3.84Å; R502-E555 IonicContact CZ-OE2 3.18Å; R502-E555 IonicContact NH1-OE2 3.46Å; R502-E555 PolarHBondContact NH1-OE2 3.36Å; R502-E555 IonicContact NH2-OE2 3.91Å; E555-F557 PolarHBondContact O-N 3.21Å; E555-L620 HydrophobicContact CG-CD1 3.93Å; E555-L620 HydrophobicContact CG-CD2 4.25Å
556	N	82.8	Confident	88.2	Confident	120 Å²	120	38.8 Å²	38.8	64%	0.642	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	21.5	-174.4	-61.6	-42.9	0	0	0	114.2	V554	V554-N556 PolarHBondContact O-N 3.02Å; V554-N556 VanDerWaalsContact O-N 3.12Å
557	F	86.3	Confident	88.1	Confident	48 Å²	48	41 Å²	41	21%	0.211	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	-51	-173.1	-174.5	-103.8	0	0	0	112.8	Q495 R496 I499 V554 E555	Q495-F557 HydrophobicContact CB-CD2 3.65Å; Q495-F557 HydrophobicContact CB-CE2 3.7Å; R496-F557 HydrophobicContact CB-CE2 4.4Å; R496-F557 HydrophobicContact CB-CZ 4.04Å; I499-F557 HydrophobicContact CB-CD1 4.5Å; I499-F557 HydrophobicContact CG1-CD1 4.42Å; I499-F557 HydrophobicContact CG2-CD1 3.96Å; I499-F557 HydrophobicContact CG2-CE1 3.98Å; I499-F557 HydrophobicContact CG2-CG 4.35Å; I499-F557 HydrophobicContact CG2-CZ 4.38Å; V554-F557 PolarHBondContact O-N 2.87Å; V554-F557 VanDerWaalsContact O-N 3.12Å; E555-F557 PolarHBondContact O-N 3.21Å
558	Y	89.4	Confident	87.5	Confident	11 Å²	11	40.6 Å²	40.6	4%	0.043	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.1	-179.1	-66.5	-59.8	0	0	0	110.6	I499 V553 V554 Q613 H616	I499-Y558 HydrophobicContact CG1-CE2 4.03Å; V553-Y558 CarbonylContact C-O 3.52Å; V553-Y558 WeakPolarHBondContact CA-O 3.29Å; V554-Y558 PolarHBondContact N-O 3.01Å; V554-Y558 PolarHBondContact O-N 3.42Å; Y558-Q613 HydrophobicContact CD1-CB 3.95Å; Y558-Q613 HydrophobicContact CD1-CG 3.59Å; Y558-Q613 HydrophobicContact CE1-CB 3.62Å; Y558-Q613 HydrophobicContact CE1-CG 3.8Å; Y558-Q613 HydrophobicContact CG-CG 4.27Å; Y558-H616 HydrophobicContact CD2-CB 4.46Å; Y558-H616 HydrophobicContact CE2-CB 3.47Å; Y558-H616 VanDerWaalsContact CE2-CB 3.47Å; Y558-H616 AromaticContact CE2-CG 3.85Å; Y558-H616 AromaticContact CE2-ND1 3.51Å; Y558-H616 AromaticContact CZ-CG 3.94Å; Y558-H616 AromaticContact CZ-ND1 3.57Å; Y558-H616 PolarHBondContact OH-CE1 3.44Å; Y558-H616 VanDerWaalsContact OH-CG 3.27Å; Y558-H616 PolarHBondContact OH-ND1 3.18Å
559	V	88.9	Confident	86.2	Confident	40 Å²	40	40.8 Å²	40.8	24%	0.242	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.4	165.4	178.8	0	0	0	0	106.9	P526 M551 V553 Q613	P526-V559 HydrophobicContact CB-CG1 4.37Å; P526-V559 HydrophobicContact CG-CB 4.2Å; P526-V559 HydrophobicContact CG-CG1 3.28Å; P526-V559 HydrophobicContact CG-CG2 3.93Å; M551-V559 HydrophobicContact SD-CG1 4.04Å; V553-V559 HydrophobicContact CG2-CG2 4.44Å; V559-Q613 PolarHBondContact O-NE2 3.3Å
560	I	90.6	Very high	84.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.7	173	-51	177.8	0	0	0	107.6	M551 L552 V554 A562 V563 A590 L617 Y622	M551-I560 CarbonylContact C-O 3.53Å; M551-I560 VanDerWaalsContact CA-O 3.28Å; M551-I560 WeakPolarHBondContact CA-O 3.39Å; M551-I560 PolarHBondContact N-O 3.25Å; L552-I560 PolarHBondContact N-O 3.49Å; L552-I560 PolarHBondContact O-N 2.9Å; V554-I560 HydrophobicContact CB-CD1 4.28Å; V554-I560 HydrophobicContact CG2-CD1 3.52Å; V554-I560 HydrophobicContact CG2-CG1 4.21Å; I560-A562 VanDerWaalsContact C-N 3.33Å; I560-A562 VanDerWaalsContact CG2-O 3.31Å; I560-A562 WeakPolarHBondContact CG2-O 3.32Å; I560-A562 PolarHBondContact O-N 3.19Å; I560-V563 HydrophobicContact CB-CG2 4.27Å; I560-V563 HydrophobicContact CD1-CG2 4.05Å; I560-V563 HydrophobicContact CG2-CG2 3.88Å; I560-A590 HydrophobicContact CD1-CB 4.14Å; I560-A590 HydrophobicContact CG2-CB 3.84Å; I560-L617 HydrophobicContact CD1-CD1 4.5Å; I560-L617 HydrophobicContact CD1-CD2 3.52Å; I560-L617 HydrophobicContact CG1-CD2 4.15Å; I560-Y622 HydrophobicContact CD1-CE1 4.48Å
561	D	90.4	Very high	82.6	Confident	27 Å²	27	46 Å²	46	14%	0.144	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	-42.9	-178.1	-59.8	-92	0	0	0	111.7	L532 E550 M551 Y593	L532-D561 HydrophobicContact CD2-CB 3.95Å; E550-D561 WeakPolarHBondContact CA-O 3.47Å; M551-D561 HydrophobicContact CE-CB 4.17Å; M551-D561 WeakPolarHBondContact CE-OD1 3.41Å; M551-D561 PolarHBondContact N-O 3.18Å; D561-Y593 PolarHBondContact OD2-N 2.98Å
562	A	91.8	Very high	80.4	Confident	2 Å²	2	49.4 Å²	49.4	2%	0.017	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	145.9	171.8	0	0	0	0	0	112.9	L536 L548 Q549 I560 V591	L536-A562 HydrophobicContact CD1-CB 3.38Å; L548-A562 HydrophobicContact CD1-CB 3.82Å; Q549-A562 CarbonylContact O-C 3.55Å; Q549-A562 WeakPolarHBondContact O-CA 3.32Å; I560-A562 VanDerWaalsContact C-N 3.33Å; I560-A562 VanDerWaalsContact CG2-O 3.31Å; I560-A562 WeakPolarHBondContact CG2-O 3.32Å; I560-A562 PolarHBondContact O-N 3.19Å; A562-V591 HydrophobicContact CB-CB 4.22Å; A562-V591 PolarHBondContact N-O 3.33Å; A562-V591 VanDerWaalsContact N-O 3.16Å; A562-V591 PolarHBondContact O-N 3.07Å
563	V	91.6	Very high	78.2	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.2	170.1	177	0	0	0	0	108.5	Q549 L552 I560 I589 Y622	Q549-V563 HydrophobicContact CB-CB 4.41Å; Q549-V563 PolarHBondContact N-O 3.44Å; Q549-V563 PolarHBondContact O-N 3.23Å; L552-V563 HydrophobicContact CB-CG2 4.21Å; L552-V563 HydrophobicContact CD2-CG2 3.76Å; I560-V563 HydrophobicContact CB-CG2 4.27Å; I560-V563 HydrophobicContact CD1-CG2 4.05Å; I560-V563 HydrophobicContact CG2-CG2 3.88Å; V563-I589 CarbonylContact C-O 3.44Å; V563-I589 VanDerWaalsContact CA-O 3.3Å; V563-I589 WeakPolarHBondContact CA-O 3.39Å; V563-Y622 HydrophobicContact CG1-CD1 4.35Å; V563-Y622 HydrophobicContact CG1-CE1 3.87Å; V563-Y622 HydrophobicContact CG2-CE1 4.04Å
564	V	90.9	Very high	75.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.9	171.9	-179.4	0	0	0	0	108.1	L540 A546 T547 L548 I589 V591 I648	L540-V564 HydrophobicContact CD1-CG1 4.49Å; L540-V564 HydrophobicContact CD1-CG2 4.18Å; L540-V564 HydrophobicContact CD2-CG1 3.83Å; A546-V564 HydrophobicContact CB-CG1 4.43Å; T547-V564 CarbonylContact O-C 3.51Å; T547-V564 WeakPolarHBondContact O-CA 3.37Å; L548-V564 HydrophobicContact CD1-CG2 4.03Å; V564-I589 HydrophobicContact CB-CB 4.3Å; V564-I589 PolarHBondContact N-O 3.44Å; V564-I589 PolarHBondContact O-N 3.29Å; V564-V591 HydrophobicContact CG2-CG2 4.35Å; V564-I648 HydrophobicContact CB-CG2 4.36Å; V564-I648 HydrophobicContact CG1-CG2 4.01Å; V564-I648 HydrophobicContact CG2-CD1 4.43Å
565	T	89.4	Confident	73.7	Confident	27 Å²	27	60.5 Å²	60.5	17%	0.166	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.6	175.3	-52.1	0	0	0	0	108.9	A546 T547 Q587 R588	A546-T565 CarbonylContact C-O 3.56Å; A546-T565 WeakPolarHBondContact CA-O 3.48Å; T547-T565 PolarHBondContact N-O 3.03Å; T547-T565 PolarHBondContact O-N 2.91Å; T547-T565 WeakPolarHBondContact OG1-CB 3.18Å; T565-Q587 WeakPolarHBondContact CA-O 3.31Å; T565-R588 HydrophobicContact CG2-CG 4.11Å
566	K	86.7	Confident	71.6	Confident	11 Å²	11	66.2 Å²	66.2	5%	0.048	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	161	178.3	71.1	167.4	-168.2	155.8	0	111.5	A546 S586 Q587 I589 F649 E651	A546-K566 HydrophobicContact CB-CB 4.39Å; K566-S586 CarbonylContact O-C 3.55Å; K566-S586 WeakPolarHBondContact O-CA 2.89Å; K566-Q587 HydrophobicContact CG-CB 4.17Å; K566-Q587 PolarHBondContact N-O 2.92Å; K566-Q587 PolarHBondContact O-N 3.15Å; K566-I589 HydrophobicContact CD-CD1 4.38Å; K566-F649 HydrophobicContact CB-CE1 4.36Å; K566-F649 HydrophobicContact CD-CD1 3.87Å; K566-F649 HydrophobicContact CD-CE1 3.63Å; K566-E651 IonicContact NZ-OE2 2.82Å
567	P	82.1	Confident	69.6	Low	66 Å²	66	67 Å²	67	43%	0.429	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	154.2	174.9	-15.4	29.6	0	0	0	111.6	N545	N545-P567 HydrophobicContact CB-CG 3.79Å
568	L	75.8	Confident	67.4	Low	69 Å²	69	68.6 Å²	68.6	36%	0.361	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-66.6	142.8	172.5	-87.3	146.8	0	0	0	111.5	N570 E584 S585	L568-N570 PolarHBondContact O-N 3.34Å; L568-E584 VanDerWaalsContact CD1-O 3.24Å; L568-E584 WeakPolarHBondContact CD1-O 3.42Å; L568-S585 PolarHBondContact N-O 3.35Å
569	P	60.4	Low	65.1	Low	53 Å²	53	74.4 Å²	74.4	34%	0.344	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	131.3	173.2	-16.2	29.9	0	0	0	110	E651	P569-E651 WeakPolarHBondContact CB-OE1 3.43Å; P569-E651 WeakPolarHBondContact CG-OE1 3.32Å
570	N	53.5	Low	62.8	Low	166 Å²	166	76 Å²	76	89%	0.888	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	19.5	178.3	-54.5	-36.7	0	0	0	118.6	L568	L568-N570 PolarHBondContact O-N 3.34Å
571	Q	48.5	Very low	60.5	Low	110 Å²	110	78.4 Å²	78.4	51%	0.514	47%	0.467	S	S	.	.			trans	-91.5	117.3	159.2	-92.7	179.6	-8.6	0	0	110.1
572	P	42.1	Very low	58.5	Low	102 Å²	102	82.2 Å²	82.2	66%	0.662	49%	0.493	S	S	*	.			trans	-60	145.2	165.5	26.2	-30.8	0	0	0	108.1	V574	P572-V574 WeakPolarHBondContact O-CG2 3.27Å; P572-V574 PolarHBondContact O-N 3.43Å
573	C	40.4	Very low	56.6	Low	134 Å²	134	84.9 Å²	84.9	91%	0.905	52%	0.516	S	S	*	.			trans	-53.3	98.3	174.8	-166.6	0	0	0	0	108.9	T575	C573-T575 PolarHBondContact O-N 2.93Å
574	V	39.1	Very low	54.9	Low	90 Å²	90	91 Å²	91	55%	0.545	54%	0.544	S	S	.	.			trans	-78.2	111.2	-179	179.4	0	0	0	0	107	P572 E576	P572-V574 WeakPolarHBondContact O-CG2 3.27Å; P572-V574 PolarHBondContact O-N 3.43Å; V574-E576 PolarHBondContact O-N 3.32Å
575	T	39.7	Very low	53.6	Low	122 Å²	122	92.9 Å²	92.9	75%	0.748	56%	0.557	S	S	*	*			trans	-50.9	128.7	164.4	5.4	0	0	0	0	109.7	C573 T577	C573-T575 PolarHBondContact O-N 2.93Å; T575-T577 PolarHBondContact O-N 2.95Å
576	E	43.1	Very low	53.1	Low	190 Å²	190	92.9 Å²	92.9	89%	0.888	56%	0.558	S	S	*	*	S	Bend	trans	-16.2	88.1	170.2	-59.8	178.6	169.2	0	0	114.8	V574	V574-E576 PolarHBondContact O-N 3.32Å
577	T	41.3	Very low	53.1	Low	137 Å²	137	95 Å²	95	84%	0.84	57%	0.568	S	S	*	*			trans	171.8	67.9	155.9	34.8	0	0	0	0	110.7	T575	T575-T577 PolarHBondContact O-N 2.95Å
578	S	39.8	Very low	53.5	Low	82 Å²	82	95 Å²	95	57%	0.573	56%	0.56	S	S	*	*			trans	-154.9	131.4	155.3	44.9	0	0	0	0	110.3	V580	S578-V580 PolarHBondContact O-N 3.2Å
579	S	41.5	Very low	54.3	Low	132 Å²	132	92 Å²	92	92%	0.923	54%	0.544	S	S	*	.			trans	-79.9	52.7	-175.7	52.1	0	0	0	0	112.1
580	V	39	Very low	55.9	Low	74 Å²	74	89.4 Å²	89.4	45%	0.448	53%	0.527	S	S	.	.			trans	-91.9	132	172.3	-177.9	0	0	0	0	108	S578 E584	S578-V580 PolarHBondContact O-N 3.2Å; V580-E584 HydrophobicContact CG1-CB 3.66Å
581	S	43.2	Very low	57.8	Low	50 Å²	50	81.5 Å²	81.5	35%	0.35	49%	0.485	S	S	.	.			trans	-64.2	142.6	179.3	66.8	0	0	0	0	110.2	A583 E584	S581-A583 PolarHBondContact O-N 3.18Å; S581-E584 PolarHBondContact N-OE2 2.94Å; S581-E584 PolarHBondContact O-N 2.7Å; S581-E584 WeakPolarHBondContact OG-CG 3.36Å; S581-E584 PolarHBondContact OG-OE2 3.35Å
582	P	48.2	Very low	59.9	Low	107 Å²	107	76.5 Å²	76.5	70%	0.695	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.8	-178.2	-22.3	28.3	0	0	0	114.6	S586	P582-S586 PolarHBondContact O-OG 3.45Å
583	A	52.7	Low	62.3	Low	59 Å²	59	74.7 Å²	74.7	49%	0.488	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-19.1	177.9	0	0	0	0	0	113.8	S581	S581-A583 PolarHBondContact O-N 3.18Å
584	E	55.2	Low	64.7	Low	130 Å²	130	68.3 Å²	68.3	61%	0.607	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-16.7	-179	-72.6	168.1	148.3	0	0	112.8	L568 V580 S581	L568-E584 VanDerWaalsContact CD1-O 3.24Å; L568-E584 WeakPolarHBondContact CD1-O 3.42Å; V580-E584 HydrophobicContact CG1-CB 3.66Å; S581-E584 PolarHBondContact N-OE2 2.94Å; S581-E584 PolarHBondContact O-N 2.7Å; S581-E584 WeakPolarHBondContact OG-CG 3.36Å; S581-E584 PolarHBondContact OG-OE2 3.35Å
585	S	63.5	Low	67.2	Low	39 Å²	39	66 Å²	66	27%	0.273	39%	0.386	S	S	.	.	S	Bend	trans	-102.6	0.9	178.8	57.5	0	0	0	0	114.2	L568	L568-S585 PolarHBondContact N-O 3.35Å
586	S	78.6	Confident	69.6	Low	28 Å²	28	63.1 Å²	63.1	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.1	-176	62.5	0	0	0	0	113.2	K566 P582	K566-S586 CarbonylContact O-C 3.55Å; K566-S586 WeakPolarHBondContact O-CA 2.89Å; P582-S586 PolarHBondContact O-OG 3.45Å
587	Q	86.6	Confident	71.8	Confident	55 Å²	55	56.9 Å²	56.9	26%	0.257	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122.4	169.8	-170.1	178.6	29.5	0	0	109.5	T565 K566 I589	T565-Q587 WeakPolarHBondContact CA-O 3.31Å; K566-Q587 HydrophobicContact CG-CB 4.17Å; K566-Q587 PolarHBondContact N-O 2.92Å; K566-Q587 PolarHBondContact O-N 3.15Å; Q587-I589 HydrophobicContact CG-CG1 4.32Å
588	R	91.4	Very high	74.4	Confident	66 Å²	66	51.6 Å²	51.6	25%	0.249	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.5	176	-65.5	178.7	-68.2	158.6	5.9	110.1	T565 L620 Y622 T623	T565-R588 HydrophobicContact CG2-CG 4.11Å; R588-L620 PolarHBondContact NH2-O 3.42Å; R588-Y622 HydrophobicContact CB-CD1 3.71Å; R588-Y622 HydrophobicContact CB-CE1 3.97Å; R588-Y622 HydrophobicContact CB-CG 4.49Å; R588-Y622 CarbonylContact O-C 3.48Å; R588-Y622 VanDerWaalsContact O-CA 3.28Å; R588-Y622 WeakPolarHBondContact O-CA 3.37Å; R588-T623 PolarHBondContact O-N 2.83Å
589	I	92.7	Very high	77	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.2	-179.5	-60.4	170.5	0	0	0	108	V563 V564 K566 Q587 V591 T623 V625 I648	V563-I589 CarbonylContact C-O 3.44Å; V563-I589 VanDerWaalsContact CA-O 3.3Å; V563-I589 WeakPolarHBondContact CA-O 3.39Å; V564-I589 HydrophobicContact CB-CB 4.3Å; V564-I589 PolarHBondContact N-O 3.44Å; V564-I589 PolarHBondContact O-N 3.29Å; K566-I589 HydrophobicContact CD-CD1 4.38Å; Q587-I589 HydrophobicContact CG-CG1 4.32Å; I589-V591 HydrophobicContact CG2-CG2 4.34Å; I589-T623 CarbonylContact C-O 3.5Å; I589-T623 WeakPolarHBondContact CA-O 3.34Å; I589-V625 HydrophobicContact CG2-CB 4.25Å; I589-V625 HydrophobicContact CG2-CG2 3.57Å; I589-I648 HydrophobicContact CD1-CG2 3.7Å; I589-I648 WeakPolarHBondContact CD1-O 3.28Å
590	A	94.3	Very high	79.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	106.2	177.1	0	0	0	0	0	109.4	I560 L617 Y622 T623 P624 V625	I560-A590 HydrophobicContact CD1-CB 4.14Å; I560-A590 HydrophobicContact CG2-CB 3.84Å; A590-L617 HydrophobicContact CB-CD1 4.14Å; A590-Y622 HydrophobicContact CB-CD1 4.05Å; A590-Y622 HydrophobicContact CB-CG 4.24Å; A590-T623 PolarHBondContact N-O 3.41Å; A590-P624 CarbonylContact O-C 3.59Å; A590-P624 WeakPolarHBondContact O-CA 3.42Å; A590-V625 PolarHBondContact O-N 3.38Å
591	V	93.7	Very high	82.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.4	175.6	-174.3	0	0	0	0	108.6	L532 L536 A562 V564 I589 V625 V627 I648	L532-V591 HydrophobicContact CD1-CG1 4.24Å; L532-V591 HydrophobicContact CD2-CG1 4.49Å; L536-V591 HydrophobicContact CD1-CG1 4.34Å; L536-V591 HydrophobicContact CD2-CG1 4.42Å; L536-V591 HydrophobicContact CD2-CG2 4.22Å; A562-V591 HydrophobicContact CB-CB 4.22Å; A562-V591 PolarHBondContact N-O 3.33Å; A562-V591 VanDerWaalsContact N-O 3.16Å; A562-V591 PolarHBondContact O-N 3.07Å; V564-V591 HydrophobicContact CG2-CG2 4.35Å; I589-V591 HydrophobicContact CG2-CG2 4.34Å; V591-V625 WeakPolarHBondContact CA-O 3.46Å; V591-V627 HydrophobicContact CG1-CG2 3.56Å; V591-I648 HydrophobicContact CG2-CD1 4.14Å
592	I	92.6	Very high	84.5	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	121.2	-173	-50.9	170.2	0	0	0	109.2	T594 Q613 L617 P624 V625 L626 V627	I592-T594 HydrophobicContact CG2-CG2 4.1Å; I592-T594 PolarHBondContact O-N 2.91Å; I592-Q613 HydrophobicContact CD1-CG 4.37Å; I592-L617 HydrophobicContact CD1-CD1 3.41Å; I592-L617 VanDerWaalsContact CD1-CD1 3.41Å; I592-L617 HydrophobicContact CG1-CD1 4.35Å; I592-P624 HydrophobicContact CD1-CB 4.26Å; I592-V625 PolarHBondContact N-O 3.26Å; I592-L626 HydrophobicContact CB-CD2 4.21Å; I592-L626 HydrophobicContact CD1-CD2 4.14Å; I592-V627 PolarHBondContact O-N 3.4Å
593	Y	91.7	Very high	86.6	Confident	64 Å²	64	39.9 Å²	39.9	25%	0.251	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.9	168.4	171.8	-116.2	0	0	0	109.9	D561 P595 E629 L632	D561-Y593 PolarHBondContact OD2-N 2.98Å; Y593-P595 HydrophobicContact CE1-CB 4.48Å; Y593-E629 HydrophobicContact CE2-CB 4.05Å; Y593-L632 HydrophobicContact CD2-CD1 3.25Å; Y593-L632 HydrophobicContact CE2-CD1 3.43Å; Y593-L632 VanDerWaalsContact CE2-CD1 3.43Å; Y593-L632 HydrophobicContact CG-CD1 4.36Å
594	T	91.8	Very high	88.4	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	105.6	-176.9	54	0	0	0	0	110.4	I592 Y599 L610 L626 V627 E629	I592-T594 HydrophobicContact CG2-CG2 4.1Å; I592-T594 PolarHBondContact O-N 2.91Å; T594-Y599 WeakPolarHBondContact CB-OH 3.47Å; T594-Y599 WeakPolarHBondContact OG1-CE2 3.5Å; T594-Y599 PolarHBondContact OG1-OH 2.9Å; T594-L610 HydrophobicContact CG2-CD1 3.74Å; T594-L610 HydrophobicContact CG2-CD2 3.75Å; T594-L610 HydrophobicContact CG2-CG 4.42Å; T594-L626 HydrophobicContact CG2-CB 4.42Å; T594-L626 HydrophobicContact CG2-CD2 4.07Å; T594-V627 PolarHBondContact N-O 3.37Å; T594-V627 PolarHBondContact OG1-O 2.86Å; T594-V627 VanDerWaalsContact OG1-O 3.09Å; T594-E629 PolarHBondContact O-N 3.04Å; T594-E629 VanDerWaalsContact O-N 3.09Å
595	P	90.8	Very high	90.2	Very high	41 Å²	41	38.6 Å²	38.6	27%	0.266	23%	0.228	S	C	.	.			trans	-65.2	156.4	173.5	26.7	-33.8	0	0	0	110.4	Y593 S597 S598	Y593-P595 HydrophobicContact CE1-CB 4.48Å; P595-S597 PolarHBondContact O-N 2.85Å; P595-S598 VanDerWaalsContact CD-OG 3.3Å; P595-S598 WeakPolarHBondContact CD-OG 3.32Å; P595-S598 WeakPolarHBondContact CG-OG 3.48Å; P595-S598 WeakPolarHBondContact O-CB 3.44Å; P595-S598 PolarHBondContact O-N 3.39Å; P595-S598 PolarHBondContact O-OG 3.46Å
596	N	89.4	Confident	91.7	Very high	61 Å²	61	38.4 Å²	38.4	33%	0.326	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-58.8	-22.1	-176.7	-74.1	-6.8	0	0	0	113.8	S598 Y599 E629 E630	N596-S598 PolarHBondContact O-N 3.32Å; N596-Y599 PolarHBondContact O-N 3.33Å; N596-E629 PolarHBondContact N-OE2 2.83Å; N596-E630 PolarHBondContact ND2-OE1 3.32Å
597	S	90.8	Very high	92.5	Very high	59 Å²	59	39.4 Å²	39.4	41%	0.413	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-72.2	-10.4	175	60.6	0	0	0	0	114.6	P595 Y599 R607	P595-S597 PolarHBondContact O-N 2.85Å; S597-Y599 VanDerWaalsContact C-N 3.3Å; S597-R607 WeakPolarHBondContact O-CD 3.27Å; S597-R607 PolarHBondContact O-NH1 3.41Å
598	S	94.1	Very high	92.9	Very high	26 Å²	26	37 Å²	37	18%	0.182	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-79.5	-14.8	176.7	-49	0	0	0	0	112.9	P595 N596 R607	P595-S598 VanDerWaalsContact CD-OG 3.3Å; P595-S598 WeakPolarHBondContact CD-OG 3.32Å; P595-S598 WeakPolarHBondContact CG-OG 3.48Å; P595-S598 WeakPolarHBondContact O-CB 3.44Å; P595-S598 PolarHBondContact O-N 3.39Å; P595-S598 PolarHBondContact O-OG 3.46Å; N596-S598 PolarHBondContact O-N 3.32Å; S598-R607 VanDerWaalsContact O-CB 3.32Å; S598-R607 WeakPolarHBondContact O-CB 3.37Å; S598-R607 PolarHBondContact O-N 3.44Å
599	Y	95.1	Very high	92.9	Very high	25 Å²	25	36.3 Å²	36.3	10%	0.098	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-110.3	158.3	178.2	-58.1	-86.7	0	0	0	110.5	T594 N596 S597 F601 S604 Q605 P606 R607 L610 T628	T594-Y599 WeakPolarHBondContact CB-OH 3.47Å; T594-Y599 WeakPolarHBondContact OG1-CE2 3.5Å; T594-Y599 PolarHBondContact OG1-OH 2.9Å; N596-Y599 PolarHBondContact O-N 3.33Å; S597-Y599 VanDerWaalsContact C-N 3.3Å; Y599-F601 PolarHBondContact O-N 3.31Å; Y599-S604 WeakPolarHBondContact CD1-O 3.23Å; Y599-Q605 CarbonylContact C-O 3.58Å; Y599-Q605 VanDerWaalsContact CA-O 3.28Å; Y599-Q605 WeakPolarHBondContact CA-O 3.34Å; Y599-P606 HydrophobicContact CD1-CB 4.39Å; Y599-P606 HydrophobicContact CE1-CB 4.38Å; Y599-R607 WeakPolarHBondContact O-CD 3.34Å; Y599-L610 HydrophobicContact CE1-CD2 3.92Å; Y599-L610 HydrophobicContact CE2-CD2 4.28Å; Y599-T628 HydrophobicContact CE2-CG2 3.91Å
600	C	95.7	Very high	93.1	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.007	23%	0.225	C	C	.	.			trans	-68.5	127.6	167.4	-69.7	0	0	0	0	108.7	L384 C386 L420 G602 T603 Q605	L384-C600 CarbonylContact O-C 3.53Å; L384-C600 VanDerWaalsContact O-CA 3.28Å; L384-C600 WeakPolarHBondContact O-CA 3.25Å; C386-C600 HydrophobicContact CB-CB 3.98Å; L420-C600 PolarHBondContact O-SG 2.84Å; L420-C600 VanDerWaalsContact O-SG 3.39Å; C600-G602 PolarHBondContact O-N 3.22Å; C600-T603 WeakPolarHBondContact CB-OG1 3.37Å; C600-T603 PolarHBondContact O-N 2.97Å; C600-T603 VanDerWaalsContact O-O 3.08Å; C600-T603 PolarHBondContact O-OG1 3.29Å; C600-Q605 HydrophobicContact CB-CB 4.44Å; C600-Q605 PolarHBondContact N-O 3.18Å
601	F	95.1	Very high	93.1	Very high	50 Å²	50	38.1 Å²	38.1	22%	0.219	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	132.5	-176	-179.5	-98.4	0	0	0	111.5	R349 T351 L354 L384 F385 Y599 T603	R349-F601 HydrophobicContact CB-CD1 3.9Å; R349-F601 HydrophobicContact CB-CD2 4.21Å; R349-F601 HydrophobicContact CB-CE1 3.51Å; R349-F601 HydrophobicContact CB-CE2 3.84Å; R349-F601 HydrophobicContact CB-CG 4.23Å; R349-F601 HydrophobicContact CB-CZ 3.47Å; R349-F601 VanDerWaalsContact CB-CZ 3.47Å; T351-F601 WeakPolarHBondContact OG1-CE1 3.36Å; L354-F601 HydrophobicContact CD1-CD1 4.35Å; L384-F601 PolarHBondContact O-N 2.76Å; F385-F601 HydrophobicContact CD2-CD1 4.41Å; Y599-F601 PolarHBondContact O-N 3.31Å; F601-T603 VanDerWaalsContact C-N 3.29Å
602	G	90.9	Very high	93.2	Very high	55 Å²	55	38.2 Å²	38.2	57%	0.567	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	79	6.1	-177.3	0	0	0	0	0	114.6	C600	C600-G602 PolarHBondContact O-N 3.22Å
603	T	91.1	Very high	93.3	Very high	68 Å²	68	39.6 Å²	39.6	42%	0.417	24%	0.242	S	C	.	.	S	Bend	trans	-140.6	165	-177.7	76.5	0	0	0	0	111.8	C600 F601 Q605	C600-T603 WeakPolarHBondContact CB-OG1 3.37Å; C600-T603 PolarHBondContact O-N 2.97Å; C600-T603 VanDerWaalsContact O-O 3.08Å; C600-T603 PolarHBondContact O-OG1 3.29Å; F601-T603 VanDerWaalsContact C-N 3.29Å; T603-Q605 VanDerWaalsContact C-N 3.32Å; T603-Q605 PolarHBondContact OG1-N 2.85Å
604	S	90.6	Very high	93.5	Very high	112 Å²	112	37.9 Å²	37.9	78%	0.783	24%	0.237	S	C	*	.			trans	-90.5	10.6	169	-49.8	0	0	0	0	113.2	Y599 P606	Y599-S604 WeakPolarHBondContact CD1-O 3.23Å; S604-P606 WeakPolarHBondContact O-CD 3.47Å
605	Q	92.9	Very high	93.6	Very high	51 Å²	51	40.4 Å²	40.4	24%	0.238	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-74.7	119.6	-178.3	-176.7	177.3	6.1	0	0	110.3	N421 Y599 C600 T603	N421-Q605 PolarHBondContact O-NE2 2.92Å; Y599-Q605 CarbonylContact C-O 3.58Å; Y599-Q605 VanDerWaalsContact CA-O 3.28Å; Y599-Q605 WeakPolarHBondContact CA-O 3.34Å; C600-Q605 HydrophobicContact CB-CB 4.44Å; C600-Q605 PolarHBondContact N-O 3.18Å; T603-Q605 VanDerWaalsContact C-N 3.32Å; T603-Q605 PolarHBondContact OG1-N 2.85Å
606	P	95.3	Very high	93.9	Very high	34 Å²	34	38.4 Å²	38.4	22%	0.221	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-69.8	139.1	177.1	28.4	-33.8	0	0	0	110.8	N421 Y599 S604 L610 T611	N421-P606 WeakPolarHBondContact CB-O 3.46Å; N421-P606 PolarHBondContact ND2-O 3.2Å; N421-P606 VanDerWaalsContact ND2-O 3.13Å; Y599-P606 HydrophobicContact CD1-CB 4.39Å; Y599-P606 HydrophobicContact CE1-CB 4.38Å; S604-P606 WeakPolarHBondContact O-CD 3.47Å; P606-L610 HydrophobicContact CB-CB 4.24Å; P606-L610 HydrophobicContact CB-CD2 3.84Å; P606-L610 HydrophobicContact CB-CG 4.02Å; P606-T611 PolarHBondContact O-OG1 3.49Å
607	R	96.2	Very high	94.2	Very high	49 Å²	49	35.5 Å²	35.5	19%	0.185	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-75.7	163.9	173.1	-70.9	179.1	65.2	-150.6	5.2	111	L384 S419 S597 S598 Y599 A609 L610 T611	L384-R607 VanDerWaalsContact CD2-NH1 3.35Å; S419-R607 VanDerWaalsContact O-CB 3.3Å; S419-R607 WeakPolarHBondContact O-CB 3.41Å; S419-R607 PolarHBondContact O-NE 3.36Å; S419-R607 PolarHBondContact OG-NH2 2.69Å; S597-R607 WeakPolarHBondContact O-CD 3.27Å; S597-R607 PolarHBondContact O-NH1 3.41Å; S598-R607 VanDerWaalsContact O-CB 3.32Å; S598-R607 WeakPolarHBondContact O-CB 3.37Å; S598-R607 PolarHBondContact O-N 3.44Å; Y599-R607 WeakPolarHBondContact O-CD 3.34Å; R607-A609 VanDerWaalsContact C-N 3.27Å; R607-A609 PolarHBondContact O-N 2.93Å; R607-L610 PolarHBondContact O-N 3.33Å; R607-T611 PolarHBondContact O-N 3.49Å; R607-T611 PolarHBondContact O-OG1 3.43Å
608	G	94.3	Very high	94.4	Very high	5 Å²	5	39 Å²	39	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-55.4	-33.5	-168.2	0	0	0	0	0	115.9	S418 S419 L612	S418-G608 WeakPolarHBondContact O-CA 3.41Å; S419-G608 PolarHBondContact O-N 2.76Å; G608-L612 VanDerWaalsContact O-CB 3.24Å; G608-L612 WeakPolarHBondContact O-CB 3.43Å; G608-L612 PolarHBondContact O-N 2.92Å
609	A	92.8	Very high	94.5	Very high	52 Å²	52	41.9 Å²	41.9	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-67.5	-43.9	177.4	0	0	0	0	0	112.7	R607 Q613	R607-A609 VanDerWaalsContact C-N 3.27Å; R607-A609 PolarHBondContact O-N 2.93Å; A609-Q613 PolarHBondContact O-N 2.92Å; A609-Q613 VanDerWaalsContact O-N 3.17Å
610	L	95.3	Very high	94.4	Very high	9 Å²	9	42.4 Å²	42.4	5%	0.047	24%	0.242	C	C	.	.	H	α-helix	trans	-71.4	-41.8	178.4	177.4	58.6	0	0	0	110.5	T594 Y599 P606 R607 L612 Q613 I614 L626	T594-L610 HydrophobicContact CG2-CD1 3.74Å; T594-L610 HydrophobicContact CG2-CD2 3.75Å; T594-L610 HydrophobicContact CG2-CG 4.42Å; Y599-L610 HydrophobicContact CE1-CD2 3.92Å; Y599-L610 HydrophobicContact CE2-CD2 4.28Å; P606-L610 HydrophobicContact CB-CB 4.24Å; P606-L610 HydrophobicContact CB-CD2 3.84Å; P606-L610 HydrophobicContact CB-CG 4.02Å; R607-L610 PolarHBondContact O-N 3.33Å; L610-L612 VanDerWaalsContact C-N 3.28Å; L610-L612 PolarHBondContact O-N 3.15Å; L610-Q613 PolarHBondContact O-N 3.13Å; L610-I614 HydrophobicContact CD1-CD1 4.08Å; L610-I614 HydrophobicContact CD1-CG1 4.22Å; L610-I614 HydrophobicContact CG-CD1 3.86Å; L610-I614 HydrophobicContact CG-CG1 4.47Å; L610-I614 VanDerWaalsContact O-CG1 3.29Å; L610-I614 WeakPolarHBondContact O-CG1 3.14Å; L610-I614 PolarHBondContact O-N 3.39Å; L610-L626 HydrophobicContact CD1-CD2 4.18Å
611	T	95.6	Very high	94.2	Very high	34 Å²	34	44.4 Å²	44.4	21%	0.209	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-42.7	174.6	-55.3	0	0	0	0	111.9	N421 P606 R607 I614 R615	N421-T611 PolarHBondContact ND2-OG1 2.89Å; P606-T611 PolarHBondContact O-OG1 3.49Å; R607-T611 PolarHBondContact O-N 3.49Å; R607-T611 PolarHBondContact O-OG1 3.43Å; T611-I614 PolarHBondContact O-N 3.19Å; T611-R615 WeakPolarHBondContact O-CB 3.45Å; T611-R615 PolarHBondContact O-N 2.87Å
612	L	95.4	Very high	94.2	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-62.3	-46.1	176.9	-173	68.5	0	0	0	111.8	R496 G608 L610 R615 H616	R496-L612 HydrophobicContact CG-CD2 3.78Å; G608-L612 VanDerWaalsContact O-CB 3.24Å; G608-L612 WeakPolarHBondContact O-CB 3.43Å; G608-L612 PolarHBondContact O-N 2.92Å; L610-L612 VanDerWaalsContact C-N 3.28Å; L610-L612 PolarHBondContact O-N 3.15Å; L612-R615 PolarHBondContact O-N 3Å; L612-H616 WeakPolarHBondContact CD1-NE2 3.29Å; L612-H616 WeakPolarHBondContact O-CB 3.22Å; L612-H616 PolarHBondContact O-CD2 2.73Å; L612-H616 PolarHBondContact O-N 3.39Å
613	Q	95.3	Very high	94.3	Very high	32 Å²	32	43.5 Å²	43.5	15%	0.15	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-47.1	176.8	-178.6	172.8	9.7	0	0	111.5	Y558 V559 I592 A609 L610 R615 H616 L617	Y558-Q613 HydrophobicContact CD1-CB 3.95Å; Y558-Q613 HydrophobicContact CD1-CG 3.59Å; Y558-Q613 HydrophobicContact CE1-CB 3.62Å; Y558-Q613 HydrophobicContact CE1-CG 3.8Å; Y558-Q613 HydrophobicContact CG-CG 4.27Å; V559-Q613 PolarHBondContact O-NE2 3.3Å; I592-Q613 HydrophobicContact CD1-CG 4.37Å; A609-Q613 PolarHBondContact O-N 2.92Å; A609-Q613 VanDerWaalsContact O-N 3.17Å; L610-Q613 PolarHBondContact O-N 3.13Å; Q613-R615 VanDerWaalsContact C-N 3.34Å; Q613-R615 PolarHBondContact O-N 3.1Å; Q613-H616 PolarHBondContact O-N 2.94Å; Q613-L617 HydrophobicContact CG-CD1 3.81Å; Q613-L617 HydrophobicContact CG-CG 4.31Å; Q613-L617 WeakPolarHBondContact O-CB 3.33Å; Q613-L617 VanDerWaalsContact O-CG 3.24Å; Q613-L617 WeakPolarHBondContact O-CG 3.44Å; Q613-L617 PolarHBondContact O-N 2.72Å
614	I	95.3	Very high	94.5	Very high	28 Å²	28	41.4 Å²	41.4	14%	0.144	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-46.5	177.4	-67.4	163.4	0	0	0	110.8	L610 T611 K618 P624 L626	L610-I614 HydrophobicContact CD1-CD1 4.08Å; L610-I614 HydrophobicContact CD1-CG1 4.22Å; L610-I614 HydrophobicContact CG-CD1 3.86Å; L610-I614 HydrophobicContact CG-CG1 4.47Å; L610-I614 VanDerWaalsContact O-CG1 3.29Å; L610-I614 WeakPolarHBondContact O-CG1 3.14Å; L610-I614 PolarHBondContact O-N 3.39Å; T611-I614 PolarHBondContact O-N 3.19Å; I614-K618 HydrophobicContact CG2-CD 4.38Å; I614-K618 WeakPolarHBondContact O-CG 3.12Å; I614-K618 PolarHBondContact O-N 3.45Å; I614-K618 VanDerWaalsContact O-N 3.14Å; I614-P624 HydrophobicContact CG2-CG 4.22Å; I614-L626 HydrophobicContact CD1-CD1 3.71Å; I614-L626 HydrophobicContact CD1-CD2 4.06Å; I614-L626 HydrophobicContact CD1-CG 4.42Å; I614-L626 HydrophobicContact CG1-CD2 4.11Å
615	R	95.1	Very high	94.7	Very high	54 Å²	54	36.7 Å²	36.7	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-50.6	178	-177.9	178.2	80.1	-144.1	10.1	111.3	C459 N462 D504 T611 L612 Q613 K618 I619	C459-R615 PolarHBondContact O-NH2 2.8Å; N462-R615 PolarHBondContact OD1-NH2 3.42Å; D504-R615 IonicContact OD1-CZ 3.81Å; D504-R615 VanDerWaalsContact OD1-CZ 3.31Å; D504-R615 IonicContact OD1-NE 3.04Å; D504-R615 PolarHBondContact OD1-NE 2.94Å; D504-R615 IonicContact OD1-NH2 2.72Å; D504-R615 PolarHBondContact OD1-NH2 3.42Å; D504-R615 VanDerWaalsContact OD1-NH2 3.12Å; D504-R615 IonicContact OD2-CZ 3.66Å; D504-R615 IonicContact OD2-NE 2.68Å; D504-R615 IonicContact OD2-NH2 3.65Å; D504-R615 PolarHBondContact OD2-NH2 2.91Å; T611-R615 WeakPolarHBondContact O-CB 3.45Å; T611-R615 PolarHBondContact O-N 2.87Å; L612-R615 PolarHBondContact O-N 3Å; Q613-R615 VanDerWaalsContact C-N 3.34Å; Q613-R615 PolarHBondContact O-N 3.1Å; R615-K618 WeakPolarHBondContact O-CB 3.21Å; R615-K618 PolarHBondContact O-N 3.18Å; R615-I619 HydrophobicContact CG-CD1 4.2Å; R615-I619 WeakPolarHBondContact O-CG1 3.22Å; R615-I619 PolarHBondContact O-N 2.96Å; R615-I619 VanDerWaalsContact O-N 3.11Å
616	H	96.3	Very high	94.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.8	-38.2	-175.8	-73.2	-159.7	0	0	0	112.3	L503 D504 Y558 L612 Q613 K618 I619 L620	L503-H616 HydrophobicContact CD1-CB 3.66Å; D504-H616 IonicContact OD1-CD2 3.29Å; D504-H616 IonicContact OD1-NE2 3.74Å; D504-H616 PolarHBondContact OD1-NE2 3.23Å; D504-H616 IonicContact OD2-CE1 2.69Å; D504-H616 IonicContact OD2-NE2 3.51Å; D504-H616 PolarHBondContact OD2-NE2 2.87Å; D504-H616 VanDerWaalsContact OD2-NE2 3.15Å; Y558-H616 HydrophobicContact CD2-CB 4.46Å; Y558-H616 HydrophobicContact CE2-CB 3.47Å; Y558-H616 VanDerWaalsContact CE2-CB 3.47Å; Y558-H616 AromaticContact CE2-CG 3.85Å; Y558-H616 AromaticContact CE2-ND1 3.51Å; Y558-H616 AromaticContact CZ-CG 3.94Å; Y558-H616 AromaticContact CZ-ND1 3.57Å; Y558-H616 PolarHBondContact OH-CE1 3.44Å; Y558-H616 VanDerWaalsContact OH-CG 3.27Å; Y558-H616 PolarHBondContact OH-ND1 3.18Å; L612-H616 WeakPolarHBondContact CD1-NE2 3.29Å; L612-H616 WeakPolarHBondContact O-CB 3.22Å; L612-H616 PolarHBondContact O-CD2 2.73Å; L612-H616 PolarHBondContact O-N 3.39Å; Q613-H616 PolarHBondContact O-N 2.94Å; H616-K618 VanDerWaalsContact C-N 3.32Å; H616-K618 PolarHBondContact O-N 3.48Å; H616-I619 WeakPolarHBondContact O-CB 3.45Å; H616-I619 PolarHBondContact O-N 2.66Å; H616-L620 WeakPolarHBondContact O-CG 3.27Å; H616-L620 PolarHBondContact O-N 3.37Å
617	L	95.3	Very high	94.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-38.6	175.6	-71.5	175.9	0	0	0	111.9	I560 A590 I592 Q613 L620 G621 Y622 P624	I560-L617 HydrophobicContact CD1-CD1 4.5Å; I560-L617 HydrophobicContact CD1-CD2 3.52Å; I560-L617 HydrophobicContact CG1-CD2 4.15Å; A590-L617 HydrophobicContact CB-CD1 4.14Å; I592-L617 HydrophobicContact CD1-CD1 3.41Å; I592-L617 VanDerWaalsContact CD1-CD1 3.41Å; I592-L617 HydrophobicContact CG1-CD1 4.35Å; Q613-L617 HydrophobicContact CG-CD1 3.81Å; Q613-L617 HydrophobicContact CG-CG 4.31Å; Q613-L617 WeakPolarHBondContact O-CB 3.33Å; Q613-L617 VanDerWaalsContact O-CG 3.24Å; Q613-L617 WeakPolarHBondContact O-CG 3.44Å; Q613-L617 PolarHBondContact O-N 2.72Å; L617-L620 CarbonylContact O-C 3.4Å; L617-L620 PolarHBondContact O-N 3.45Å; L617-G621 PolarHBondContact O-N 3.44Å; L617-Y622 HydrophobicContact CD2-CD2 4.12Å; L617-Y622 HydrophobicContact CD2-CG 4.48Å; L617-Y622 WeakPolarHBondContact O-CB 3.3Å; L617-Y622 PolarHBondContact O-N 2.86Å; L617-P624 HydrophobicContact CB-CG 4.06Å
618	K	95.4	Very high	94.2	Very high	133 Å²	133	34.7 Å²	34.7	58%	0.578	20%	0.196	S	C	*	.	H	α-helix	trans	-61.9	-43.4	172.6	-72.4	177.3	177.7	-172.9	0	112.1	I614 R615 H616 L620 G621 Y622 P624	I614-K618 HydrophobicContact CG2-CD 4.38Å; I614-K618 WeakPolarHBondContact O-CG 3.12Å; I614-K618 PolarHBondContact O-N 3.45Å; I614-K618 VanDerWaalsContact O-N 3.14Å; R615-K618 WeakPolarHBondContact O-CB 3.21Å; R615-K618 PolarHBondContact O-N 3.18Å; H616-K618 VanDerWaalsContact C-N 3.32Å; H616-K618 PolarHBondContact O-N 3.48Å; K618-L620 PolarHBondContact O-N 3.21Å; K618-G621 PolarHBondContact O-N 3.36Å; K618-Y622 WeakPolarHBondContact CA-O 3.28Å; K618-P624 HydrophobicContact CG-CG 3.99Å
619	I	95.1	Very high	93.8	Very high	86 Å²	86	36.7 Å²	36.7	44%	0.441	20%	0.204	S	C	.	.	H	α-helix	trans	-59.5	-38.5	175.3	-67.1	167.9	0	0	0	111	L503 R615 H616 G621	L503-I619 HydrophobicContact CB-CG2 4.41Å; R615-I619 HydrophobicContact CG-CD1 4.2Å; R615-I619 WeakPolarHBondContact O-CG1 3.22Å; R615-I619 PolarHBondContact O-N 2.96Å; R615-I619 VanDerWaalsContact O-N 3.11Å; H616-I619 WeakPolarHBondContact O-CB 3.45Å; H616-I619 PolarHBondContact O-N 2.66Å; I619-G621 PolarHBondContact O-N 2.97Å
620	L	94.1	Very high	93.4	Very high	35 Å²	35	40.1 Å²	40.1	18%	0.183	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	1.1	178	-69.5	168.5	0	0	0	114	L503 V554 E555 R588 H616 L617 K618 Y622	L503-L620 HydrophobicContact CD1-CD1 3.95Å; L503-L620 HydrophobicContact CD1-CD2 4.42Å; L503-L620 HydrophobicContact CD1-CG 4.1Å; L503-L620 HydrophobicContact CD2-CD2 3.74Å; L503-L620 HydrophobicContact CD2-CG 4.23Å; V554-L620 HydrophobicContact CG1-CD1 3.59Å; E555-L620 HydrophobicContact CG-CD1 3.93Å; E555-L620 HydrophobicContact CG-CD2 4.25Å; R588-L620 PolarHBondContact NH2-O 3.42Å; H616-L620 WeakPolarHBondContact O-CG 3.27Å; H616-L620 PolarHBondContact O-N 3.37Å; L617-L620 CarbonylContact O-C 3.4Å; L617-L620 PolarHBondContact O-N 3.45Å; K618-L620 PolarHBondContact O-N 3.21Å; L620-Y622 HydrophobicContact CB-CD2 3.75Å; L620-Y622 HydrophobicContact CB-CE2 3.92Å
621	G	92.2	Very high	92.8	Very high	43 Å²	43	40.4 Å²	40.4	44%	0.443	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	23.6	178.7	0	0	0	0	0	114.5	L617 K618 I619	L617-G621 PolarHBondContact O-N 3.44Å; K618-G621 PolarHBondContact O-N 3.36Å; I619-G621 PolarHBondContact O-N 2.97Å
622	Y	93.8	Very high	92.2	Very high	24 Å²	24	39.1 Å²	39.1	9%	0.094	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	145.5	169.8	-64.1	-92.1	0	0	0	111.1	V554 I560 V563 R588 A590 L617 K618 L620 P624	V554-Y622 HydrophobicContact CG1-CE2 4.45Å; I560-Y622 HydrophobicContact CD1-CE1 4.48Å; V563-Y622 HydrophobicContact CG1-CD1 4.35Å; V563-Y622 HydrophobicContact CG1-CE1 3.87Å; V563-Y622 HydrophobicContact CG2-CE1 4.04Å; R588-Y622 HydrophobicContact CB-CD1 3.71Å; R588-Y622 HydrophobicContact CB-CE1 3.97Å; R588-Y622 HydrophobicContact CB-CG 4.49Å; R588-Y622 CarbonylContact O-C 3.48Å; R588-Y622 VanDerWaalsContact O-CA 3.28Å; R588-Y622 WeakPolarHBondContact O-CA 3.37Å; A590-Y622 HydrophobicContact CB-CD1 4.05Å; A590-Y622 HydrophobicContact CB-CG 4.24Å; L617-Y622 HydrophobicContact CD2-CD2 4.12Å; L617-Y622 HydrophobicContact CD2-CG 4.48Å; L617-Y622 WeakPolarHBondContact O-CB 3.3Å; L617-Y622 PolarHBondContact O-N 2.86Å; K618-Y622 WeakPolarHBondContact CA-O 3.28Å; L620-Y622 HydrophobicContact CB-CD2 3.75Å; L620-Y622 HydrophobicContact CB-CE2 3.92Å; Y622-P624 WeakPolarHBondContact O-CD 3.42Å
623	T	94.3	Very high	91.6	Very high	62 Å²	62	45 Å²	45	38%	0.38	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.9	165.8	-57	0	0	0	0	109.2	R588 I589 A590	R588-T623 PolarHBondContact O-N 2.83Å; I589-T623 CarbonylContact C-O 3.5Å; I589-T623 WeakPolarHBondContact CA-O 3.34Å; A590-T623 PolarHBondContact N-O 3.41Å
624	P	94.4	Very high	91	Very high	25 Å²	25	48 Å²	48	16%	0.162	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	128.8	-177.9	-16.3	33.4	0	0	0	111.6	A590 I592 I614 L617 K618 Y622	A590-P624 CarbonylContact O-C 3.59Å; A590-P624 WeakPolarHBondContact O-CA 3.42Å; I592-P624 HydrophobicContact CD1-CB 4.26Å; I614-P624 HydrophobicContact CG2-CG 4.22Å; L617-P624 HydrophobicContact CB-CG 4.06Å; K618-P624 HydrophobicContact CG-CG 3.99Å; Y622-P624 WeakPolarHBondContact O-CD 3.42Å
625	V	94.2	Very high	90.6	Very high	13 Å²	13	48.3 Å²	48.3	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	118.2	171.1	171.7	0	0	0	0	108	I589 A590 V591 I592 L647	I589-V625 HydrophobicContact CG2-CB 4.25Å; I589-V625 HydrophobicContact CG2-CG2 3.57Å; A590-V625 PolarHBondContact O-N 3.38Å; V591-V625 WeakPolarHBondContact CA-O 3.46Å; I592-V625 PolarHBondContact N-O 3.26Å; V625-L647 HydrophobicContact CG1-CB 3.93Å; V625-L647 HydrophobicContact CG1-CD1 4.17Å
626	L	93.5	Very high	90.2	Very high	54 Å²	54	48.2 Å²	48.2	28%	0.283	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.1	-176.8	-53.6	-179.4	0	0	0	110.1	I592 T594 L610 I614	I592-L626 HydrophobicContact CB-CD2 4.21Å; I592-L626 HydrophobicContact CD1-CD2 4.14Å; T594-L626 HydrophobicContact CG2-CB 4.42Å; T594-L626 HydrophobicContact CG2-CD2 4.07Å; L610-L626 HydrophobicContact CD1-CD2 4.18Å; I614-L626 HydrophobicContact CD1-CD1 3.71Å; I614-L626 HydrophobicContact CD1-CD2 4.06Å; I614-L626 HydrophobicContact CD1-CG 4.42Å; I614-L626 HydrophobicContact CG1-CD2 4.11Å
627	V	91.1	Very high	89.5	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	108.4	176.2	-176.2	0	0	0	0	107.7	L532 V591 I592 T594 L631 L632 L644	L532-V627 HydrophobicContact CD1-CG1 4.23Å; L532-V627 HydrophobicContact CD1-CG2 4.26Å; V591-V627 HydrophobicContact CG1-CG2 3.56Å; I592-V627 PolarHBondContact O-N 3.4Å; T594-V627 PolarHBondContact N-O 3.37Å; T594-V627 PolarHBondContact OG1-O 2.86Å; T594-V627 VanDerWaalsContact OG1-O 3.09Å; V627-L631 HydrophobicContact CG1-CD2 4.15Å; V627-L632 HydrophobicContact CG1-CD1 3.86Å; V627-L632 HydrophobicContact CG1-CD2 3.98Å; V627-L632 HydrophobicContact CG1-CG 3.62Å; V627-L644 HydrophobicContact CG2-CD2 3.73Å
628	T	89.9	Confident	88.9	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	153.9	-178.4	64	0	0	0	0	111.7	Y599 E630 L631 L632	Y599-T628 HydrophobicContact CE2-CG2 3.91Å; T628-E630 VanDerWaalsContact C-N 3.26Å; T628-E630 PolarHBondContact O-N 2.93Å; T628-L631 PolarHBondContact O-N 2.78Å; T628-L631 VanDerWaalsContact OG1-CB 3.31Å; T628-L631 WeakPolarHBondContact OG1-CB 3.42Å; T628-L631 PolarHBondContact OG1-N 3.1Å; T628-L632 PolarHBondContact O-N 2.96Å
629	E	86.3	Confident	88.5	Confident	48 Å²	48	58.4 Å²	58.4	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-38.4	173	-178.6	176.6	-173	0	0	112.6	Y593 T594 N596 L632 Q633	Y593-E629 HydrophobicContact CE2-CB 4.05Å; T594-E629 PolarHBondContact O-N 3.04Å; T594-E629 VanDerWaalsContact O-N 3.09Å; N596-E629 PolarHBondContact N-OE2 2.83Å; E629-L632 PolarHBondContact O-N 3.27Å; E629-Q633 HydrophobicContact CG-CG 4.36Å; E629-Q633 VanDerWaalsContact CG-NE2 3.26Å; E629-Q633 WeakPolarHBondContact O-CB 3.32Å; E629-Q633 WeakPolarHBondContact O-CG 3.49Å; E629-Q633 PolarHBondContact O-N 3.02Å; E629-Q633 PolarHBondContact OE1-NE2 2.91Å
630	E	83.4	Confident	88.1	Confident	123 Å²	123	54.3 Å²	54.3	58%	0.575	30%	0.295	S	S	*	.	H	α-helix	trans	-60.4	-48.4	174.7	-70.7	173.6	-176	0	0	111.7	N596 T628 L632 Q633 S634	N596-E630 PolarHBondContact ND2-OE1 3.32Å; T628-E630 VanDerWaalsContact C-N 3.26Å; T628-E630 PolarHBondContact O-N 2.93Å; E630-L632 PolarHBondContact O-N 3.27Å; E630-Q633 PolarHBondContact O-N 3.05Å; E630-Q633 VanDerWaalsContact O-N 3.12Å; E630-S634 WeakPolarHBondContact O-CB 3.31Å; E630-S634 PolarHBondContact O-N 3.45Å; E630-S634 PolarHBondContact O-OG 2.73Å
631	L	83.4	Confident	87.7	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-39.2	177.2	-170.5	155.5	0	0	0	111.2	V627 T628 L635 K643	V627-L631 HydrophobicContact CG1-CD2 4.15Å; T628-L631 PolarHBondContact O-N 2.78Å; T628-L631 VanDerWaalsContact OG1-CB 3.31Å; T628-L631 WeakPolarHBondContact OG1-CB 3.42Å; T628-L631 PolarHBondContact OG1-N 3.1Å; L631-L635 HydrophobicContact CD2-CD1 4.02Å; L631-L635 HydrophobicContact CG-CD1 3.92Å; L631-K643 HydrophobicContact CD1-CD 3.66Å; L631-K643 HydrophobicContact CD1-CG 4.41Å; L631-K643 HydrophobicContact CD2-CD 4.33Å; L631-K643 HydrophobicContact CG-CD 3.97Å
632	L	82.8	Confident	87.4	Confident	8 Å²	8	56.5 Å²	56.5	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-71.6	-29.3	177	-80.7	170.7	0	0	0	114	R531 L532 Y593 V627 T628 E629 E630 M640	R531-L632 PolarHBondContact NE-O 2.67Å; R531-L632 PolarHBondContact NH1-O 3.39Å; L532-L632 HydrophobicContact CB-CD2 4.37Å; L532-L632 HydrophobicContact CD1-CD2 4.49Å; Y593-L632 HydrophobicContact CD2-CD1 3.25Å; Y593-L632 HydrophobicContact CE2-CD1 3.43Å; Y593-L632 VanDerWaalsContact CE2-CD1 3.43Å; Y593-L632 HydrophobicContact CG-CD1 4.36Å; V627-L632 HydrophobicContact CG1-CD1 3.86Å; V627-L632 HydrophobicContact CG1-CD2 3.98Å; V627-L632 HydrophobicContact CG1-CG 3.62Å; T628-L632 PolarHBondContact O-N 2.96Å; E629-L632 PolarHBondContact O-N 3.27Å; E630-L632 PolarHBondContact O-N 3.27Å; L632-M640 HydrophobicContact CB-CE 4.3Å; L632-M640 HydrophobicContact CD2-CE 3.42Å; L632-M640 VanDerWaalsContact CD2-CE 3.42Å; L632-M640 HydrophobicContact CD2-SD 3.49Å; L632-M640 WeakPolarHBondContact CD2-SD 3.31Å; L632-M640 HydrophobicContact CG-CE 4.34Å; L632-M640 WeakPolarHBondContact O-CE 3.13Å
633	Q	83.8	Confident	87.1	Confident	126 Å²	126	60.2 Å²	60.2	59%	0.589	31%	0.31	S	S	*	.	H	α-helix	trans	-92.2	-35.6	-175.8	-74	176.8	7.9	0	0	112.7	E629 E630	E629-Q633 HydrophobicContact CG-CG 4.36Å; E629-Q633 VanDerWaalsContact CG-NE2 3.26Å; E629-Q633 WeakPolarHBondContact O-CB 3.32Å; E629-Q633 WeakPolarHBondContact O-CG 3.49Å; E629-Q633 PolarHBondContact O-N 3.02Å; E629-Q633 PolarHBondContact OE1-NE2 2.91Å; E630-Q633 PolarHBondContact O-N 3.05Å; E630-Q633 VanDerWaalsContact O-N 3.12Å
634	S	82.5	Confident	86.8	Confident	95 Å²	95	57.3 Å²	57.3	66%	0.664	29%	0.292	S	S	*	.	H	α-helix	trans	-83.9	-28.5	-170.9	70.6	0	0	0	0	114.6	E630	E630-S634 WeakPolarHBondContact O-CB 3.31Å; E630-S634 PolarHBondContact O-N 3.45Å; E630-S634 PolarHBondContact O-OG 2.73Å
635	L	85.9	Confident	86.5	Confident	34 Å²	34	58.2 Å²	58.2	18%	0.178	29%	0.292	C	S	.	.	S	Bend	trans	-88.1	150.3	-173.9	-62.4	178.9	0	0	0	111.9	R531 L631 E639 M640 K643	R531-L635 PolarHBondContact NH2-O 3.39Å; L631-L635 HydrophobicContact CD2-CD1 4.02Å; L631-L635 HydrophobicContact CG-CD1 3.92Å; L635-E639 HydrophobicContact CB-CB 4.24Å; L635-E639 HydrophobicContact CD2-CB 4.32Å; L635-M640 HydrophobicContact CB-CB 4.31Å; L635-K643 HydrophobicContact CD1-CB 4.48Å; L635-K643 HydrophobicContact CD1-CD 3.65Å
636	S	86.2	Confident	86.1	Confident	51 Å²	51	59.3 Å²	59.3	36%	0.357	31%	0.306	S	S	.	.			trans	-65.6	166	163.4	66.2	0	0	0	0	110.8	E638 E639 M640	S636-E638 VanDerWaalsContact C-N 3.29Å; S636-E638 PolarHBondContact O-N 2.95Å; S636-E639 WeakPolarHBondContact CB-OE2 3.26Å; S636-E639 PolarHBondContact N-OE2 3.29Å; S636-E639 WeakPolarHBondContact OG-CB 3.29Å; S636-E639 WeakPolarHBondContact OG-CG 3.39Å; S636-E639 PolarHBondContact OG-N 2.89Å; S636-E639 PolarHBondContact OG-OE2 3.43Å; S636-M640 VanDerWaalsContact O-CB 3.28Å; S636-M640 WeakPolarHBondContact O-CB 3.39Å; S636-M640 PolarHBondContact O-N 3.27Å
637	E	82.3	Confident	85.8	Confident	81 Å²	81	60.4 Å²	60.4	38%	0.379	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-34.6	180	-65	-165.4	166	0	0	113	R538 T641	R538-E637 IonicContact CZ-OE2 2.94Å; R538-E637 VanDerWaalsContact CZ-OE2 3.23Å; R538-E637 IonicContact NH1-OE2 3.7Å; R538-E637 PolarHBondContact NH1-OE2 3.2Å; R538-E637 IonicContact NH2-OE2 2.73Å; R538-E637 PolarHBondContact NH2-OE2 3.33Å; E637-T641 WeakPolarHBondContact O-CB 3.29Å; E637-T641 PolarHBondContact O-N 3.24Å; E637-T641 VanDerWaalsContact O-N 3.09Å; E637-T641 PolarHBondContact O-OG1 3.42Å
638	E	83.3	Confident	85.5	Confident	160 Å²	160	60.5 Å²	60.5	75%	0.748	31%	0.312	S	S	*	.	H	α-helix	trans	-71	-50.7	178.9	-68	171.2	-174.2	0	0	111	S636 M640 T641 E642	S636-E638 VanDerWaalsContact C-N 3.29Å; S636-E638 PolarHBondContact O-N 2.95Å; E638-M640 VanDerWaalsContact C-N 3.26Å; E638-M640 PolarHBondContact O-N 3.03Å; E638-T641 WeakPolarHBondContact O-CB 3.45Å; E638-T641 PolarHBondContact O-N 3.06Å; E638-E642 PolarHBondContact O-N 3.39Å
639	E	86.6	Confident	85.3	Confident	107 Å²	107	59.1 Å²	59.1	50%	0.5	30%	0.303	S	S	.	.	H	α-helix	trans	-59.9	-36.8	176.4	-67.7	164.8	142.6	0	0	112.3	L635 S636 K643	L635-E639 HydrophobicContact CB-CB 4.24Å; L635-E639 HydrophobicContact CD2-CB 4.32Å; S636-E639 WeakPolarHBondContact CB-OE2 3.26Å; S636-E639 PolarHBondContact N-OE2 3.29Å; S636-E639 WeakPolarHBondContact OG-CB 3.29Å; S636-E639 WeakPolarHBondContact OG-CG 3.39Å; S636-E639 PolarHBondContact OG-N 2.89Å; S636-E639 PolarHBondContact OG-OE2 3.43Å; E639-K643 VanDerWaalsContact O-CB 3.26Å; E639-K643 WeakPolarHBondContact O-CB 3.41Å; E639-K643 PolarHBondContact O-N 2.9Å
640	M	85.8	Confident	85	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.3	-43.1	174.5	-179.2	-174.1	-61.2	0	0	111.4	R531 S535 L632 L635 S636 E638 K643 L644	R531-M640 HydrophobicContact CG-CE 4.23Å; R531-M640 HydrophobicContact CG-SD 4.46Å; S535-M640 PolarHBondContact OG-SD 2.87Å; L632-M640 HydrophobicContact CB-CE 4.3Å; L632-M640 HydrophobicContact CD2-CE 3.42Å; L632-M640 VanDerWaalsContact CD2-CE 3.42Å; L632-M640 HydrophobicContact CD2-SD 3.49Å; L632-M640 WeakPolarHBondContact CD2-SD 3.31Å; L632-M640 HydrophobicContact CG-CE 4.34Å; L632-M640 WeakPolarHBondContact O-CE 3.13Å; L635-M640 HydrophobicContact CB-CB 4.31Å; S636-M640 VanDerWaalsContact O-CB 3.28Å; S636-M640 WeakPolarHBondContact O-CB 3.39Å; S636-M640 PolarHBondContact O-N 3.27Å; E638-M640 VanDerWaalsContact C-N 3.26Å; E638-M640 PolarHBondContact O-N 3.03Å; M640-K643 PolarHBondContact O-N 3.4Å; M640-L644 HydrophobicContact CG-CD1 4.06Å; M640-L644 HydrophobicContact CG-CG 4.42Å; M640-L644 WeakPolarHBondContact O-CB 3.44Å; M640-L644 WeakPolarHBondContact O-CG 3.44Å; M640-L644 PolarHBondContact O-N 3.41Å
641	T	85.4	Confident	84.4	Confident	11 Å²	11	58.7 Å²	58.7	7%	0.067	31%	0.307	C	S	.	.	H	α-helix	trans	-62.3	-47.8	179.1	-56.3	0	0	0	0	109.8	R538 V539 E637 E638 K643 L644 R645	R538-T641 HydrophobicContact CB-CG2 3.89Å; V539-T641 HydrophobicContact CG2-CG2 3.61Å; V539-T641 VanDerWaalsContact CG2-O 3.26Å; V539-T641 WeakPolarHBondContact CG2-O 3.36Å; E637-T641 WeakPolarHBondContact O-CB 3.29Å; E637-T641 PolarHBondContact O-N 3.24Å; E637-T641 VanDerWaalsContact O-N 3.09Å; E637-T641 PolarHBondContact O-OG1 3.42Å; E638-T641 WeakPolarHBondContact O-CB 3.45Å; E638-T641 PolarHBondContact O-N 3.06Å; T641-K643 PolarHBondContact O-N 2.92Å; T641-L644 PolarHBondContact O-N 3.04Å; T641-R645 WeakPolarHBondContact O-CB 3.36Å; T641-R645 PolarHBondContact O-N 3.36Å
642	E	86.1	Confident	83.4	Confident	113 Å²	113	61 Å²	61	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-40.4	177.2	-71.6	-54.6	112.2	0	0	112.8	E638 R645 G646	E638-E642 PolarHBondContact O-N 3.39Å; E642-R645 WeakPolarHBondContact O-CB 3.18Å; E642-R645 PolarHBondContact O-N 3.47Å; E642-R645 IonicContact OE1-CZ 3.23Å; E642-R645 IonicContact OE1-NE 2.72Å; E642-R645 PolarHBondContact OE1-NE 3.18Å; E642-R645 IonicContact OE1-NH2 2.8Å; E642-G646 PolarHBondContact O-N 2.97Å
643	K	87.6	Confident	82.1	Confident	102 Å²	102	63.8 Å²	63.8	44%	0.443	34%	0.344	S	S	.	.	H	α-helix	trans	-66.2	-41.6	176.4	-166.3	168.6	-173.6	178.5	0	112.2	L631 L635 E639 M640 T641 R645 G646 L647	L631-K643 HydrophobicContact CD1-CD 3.66Å; L631-K643 HydrophobicContact CD1-CG 4.41Å; L631-K643 HydrophobicContact CD2-CD 4.33Å; L631-K643 HydrophobicContact CG-CD 3.97Å; L635-K643 HydrophobicContact CD1-CB 4.48Å; L635-K643 HydrophobicContact CD1-CD 3.65Å; E639-K643 VanDerWaalsContact O-CB 3.26Å; E639-K643 WeakPolarHBondContact O-CB 3.41Å; E639-K643 PolarHBondContact O-N 2.9Å; M640-K643 PolarHBondContact O-N 3.4Å; T641-K643 PolarHBondContact O-N 2.92Å; K643-R645 VanDerWaalsContact C-N 3.34Å; K643-G646 PolarHBondContact O-N 3.12Å; K643-L647 HydrophobicContact CG-CD1 4.5Å; K643-L647 VanDerWaalsContact O-CG 3.26Å; K643-L647 WeakPolarHBondContact O-CG 3.47Å; K643-L647 PolarHBondContact O-N 3.22Å; K643-L647 VanDerWaalsContact O-N 3.07Å
644	L	87.9	Confident	80.3	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.6	-38.9	174.2	-74.4	174.8	0	0	0	111.3	L532 L536 V539 V627 M640 T641 L647 I648	L532-L644 HydrophobicContact CD1-CD1 4.22Å; L536-L644 HydrophobicContact CD2-CD1 4.26Å; L536-L644 HydrophobicContact CG-CD1 4.46Å; V539-L644 HydrophobicContact CG2-CB 3.88Å; V627-L644 HydrophobicContact CG2-CD2 3.73Å; M640-L644 HydrophobicContact CG-CD1 4.06Å; M640-L644 HydrophobicContact CG-CG 4.42Å; M640-L644 WeakPolarHBondContact O-CB 3.44Å; M640-L644 WeakPolarHBondContact O-CG 3.44Å; M640-L644 PolarHBondContact O-N 3.41Å; T641-L644 PolarHBondContact O-N 3.04Å; L644-L647 PolarHBondContact O-N 2.89Å; L644-I648 HydrophobicContact CB-CD1 4.46Å; L644-I648 WeakPolarHBondContact O-CB 3.5Å; L644-I648 VanDerWaalsContact O-CG1 3.26Å; L644-I648 WeakPolarHBondContact O-CG1 3.29Å; L644-I648 PolarHBondContact O-N 2.8Å
645	R	88.6	Confident	78.3	Confident	44 Å²	44	65.6 Å²	65.6	17%	0.166	35%	0.352	C	S	.	.	H	α-helix	trans	-56.9	-51.2	173.5	-168.2	-172.4	-61.2	-90.4	2.5	110.4	V539 D542 T641 E642 K643 L647 I648 F649	V539-R645 HydrophobicContact CG1-CB 4.21Å; V539-R645 HydrophobicContact CG1-CG 4.45Å; V539-R645 HydrophobicContact CG2-CB 4.37Å; D542-R645 IonicContact OD2-CZ 3.86Å; D542-R645 IonicContact OD2-NH1 3.64Å; D542-R645 PolarHBondContact OD2-NH1 3.06Å; D542-R645 VanDerWaalsContact OD2-NH1 3.15Å; D542-R645 IonicContact OD2-NH2 3.42Å; D542-R645 PolarHBondContact OD2-NH2 3.14Å; T641-R645 WeakPolarHBondContact O-CB 3.36Å; T641-R645 PolarHBondContact O-N 3.36Å; E642-R645 WeakPolarHBondContact O-CB 3.18Å; E642-R645 PolarHBondContact O-N 3.47Å; E642-R645 IonicContact OE1-CZ 3.23Å; E642-R645 IonicContact OE1-NE 2.72Å; E642-R645 PolarHBondContact OE1-NE 3.18Å; E642-R645 IonicContact OE1-NH2 2.8Å; K643-R645 VanDerWaalsContact C-N 3.34Å; R645-L647 VanDerWaalsContact C-N 3.28Å; R645-L647 PolarHBondContact O-N 2.68Å; R645-I648 PolarHBondContact O-N 3.46Å; R645-F649 CarbonylContact O-C 3.6Å; R645-F649 WeakPolarHBondContact O-CA 3.42Å; R645-F649 PolarHBondContact O-N 2.97Å
646	G	85.8	Confident	76	Confident	36 Å²	36	69.5 Å²	69.5	37%	0.371	38%	0.377	S	S	.	.	H	α-helix	trans	-63.2	-28.1	176.7	0	0	0	0	0	114.8	E642 K643	E642-G646 PolarHBondContact O-N 2.97Å; K643-G646 PolarHBondContact O-N 3.12Å
647	L	86.5	Confident	73.3	Confident	78 Å²	78	75.3 Å²	75.3	41%	0.408	40%	0.398	S	S	.	.	H	α-helix	trans	-79.7	-32	176.9	-71.8	171.6	0	0	0	113.5	V625 K643 L644 R645	V625-L647 HydrophobicContact CG1-CB 3.93Å; V625-L647 HydrophobicContact CG1-CD1 4.17Å; K643-L647 HydrophobicContact CG-CD1 4.5Å; K643-L647 VanDerWaalsContact O-CG 3.26Å; K643-L647 WeakPolarHBondContact O-CG 3.47Å; K643-L647 PolarHBondContact O-N 3.22Å; K643-L647 VanDerWaalsContact O-N 3.07Å; L644-L647 PolarHBondContact O-N 2.89Å; R645-L647 VanDerWaalsContact C-N 3.28Å; R645-L647 PolarHBondContact O-N 2.68Å
648	I	86.1	Confident	70.9	Confident	2 Å²	2	77 Å²	77	1%	0.01	42%	0.416	C	S	.	.	H	α-helix	trans	-95.7	-35.4	-175.5	-61.5	169.5	0	0	0	110.9	L536 V564 I589 V591 L644 R645 P650	L536-I648 HydrophobicContact CD2-CD1 3.61Å; V564-I648 HydrophobicContact CB-CG2 4.36Å; V564-I648 HydrophobicContact CG1-CG2 4.01Å; V564-I648 HydrophobicContact CG2-CD1 4.43Å; I589-I648 HydrophobicContact CD1-CG2 3.7Å; I589-I648 WeakPolarHBondContact CD1-O 3.28Å; V591-I648 HydrophobicContact CG2-CD1 4.14Å; L644-I648 HydrophobicContact CB-CD1 4.46Å; L644-I648 WeakPolarHBondContact O-CB 3.5Å; L644-I648 VanDerWaalsContact O-CG1 3.26Å; L644-I648 WeakPolarHBondContact O-CG1 3.29Å; L644-I648 PolarHBondContact O-N 2.8Å; R645-I648 PolarHBondContact O-N 3.46Å; I648-P650 WeakPolarHBondContact O-CD 3.37Å
649	F	85.2	Confident	68.5	Low	8 Å²	8	78.7 Å²	78.7	4%	0.035	42%	0.424	C	S	.	.			trans	-125.8	70.2	-178.7	-56.2	-86.6	0	0	0	110.3	V539 L540 Q543 A546 K566 R645 E651 D652	V539-F649 HydrophobicContact CG1-CD2 4.08Å; V539-F649 HydrophobicContact CG1-CE2 3.83Å; L540-F649 HydrophobicContact CD2-CE2 3.98Å; L540-F649 HydrophobicContact CD2-CZ 3.83Å; Q543-F649 HydrophobicContact CB-CZ 4.26Å; Q543-F649 HydrophobicContact CG-CE1 4.17Å; Q543-F649 HydrophobicContact CG-CE2 4.08Å; Q543-F649 HydrophobicContact CG-CZ 3.82Å; A546-F649 HydrophobicContact CB-CE1 4.45Å; A546-F649 HydrophobicContact CB-CZ 3.99Å; K566-F649 HydrophobicContact CB-CE1 4.36Å; K566-F649 HydrophobicContact CD-CD1 3.87Å; K566-F649 HydrophobicContact CD-CE1 3.63Å; R645-F649 CarbonylContact O-C 3.6Å; R645-F649 WeakPolarHBondContact O-CA 3.42Å; R645-F649 PolarHBondContact O-N 2.97Å; F649-E651 PolarHBondContact O-N 3.35Å; F649-D652 HydrophobicContact CB-CB 4.43Å; F649-D652 WeakPolarHBondContact CB-OD2 3.48Å; F649-D652 PolarHBondContact O-N 3.21Å
650	P	79.1	Confident	65.9	Low	76 Å²	76	80.1 Å²	80.1	49%	0.494	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-19.6	179.5	27.1	-35.2	0	0	0	113.3	I648 A653 S654	I648-P650 WeakPolarHBondContact O-CD 3.37Å; P650-A653 PolarHBondContact O-N 3.17Å; P650-S654 PolarHBondContact O-OG 3.35Å
651	E	72.1	Confident	63.3	Low	85 Å²	85	83 Å²	83	40%	0.397	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-42.4	-179.9	-70.3	163.5	174.9	0	0	111.6	K566 P569 F649 A653 S654	K566-E651 IonicContact NZ-OE2 2.82Å; P569-E651 WeakPolarHBondContact CB-OE1 3.43Å; P569-E651 WeakPolarHBondContact CG-OE1 3.32Å; F649-E651 PolarHBondContact O-N 3.35Å; E651-A653 PolarHBondContact O-N 2.87Å; E651-A653 VanDerWaalsContact O-N 3.14Å; E651-S654 WeakPolarHBondContact O-CB 3.49Å; E651-S654 PolarHBondContact O-N 3.01Å; E651-S654 PolarHBondContact O-OG 3.18Å
652	D	62.2	Low	60.7	Low	65 Å²	65	91.8 Å²	91.8	35%	0.348	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.2	178.6	-59.1	-0.6	0	0	0	112.7	Q543 F649 S654	Q543-D652 PolarHBondContact NE2-OD2 2.97Å; F649-D652 HydrophobicContact CB-CB 4.43Å; F649-D652 WeakPolarHBondContact CB-OD2 3.48Å; F649-D652 PolarHBondContact O-N 3.21Å; D652-S654 VanDerWaalsContact C-N 3.32Å
653	A	55.4	Low	58.2	Low	66 Å²	66	92.8 Å²	92.8	55%	0.545	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.3	177	0	0	0	0	0	113.3	P650 E651 T656	P650-A653 PolarHBondContact O-N 3.17Å; E651-A653 PolarHBondContact O-N 2.87Å; E651-A653 VanDerWaalsContact O-N 3.14Å; A653-T656 PolarHBondContact O-OG1 2.95Å
654	S	45.5	Very low	55.5	Low	85 Å²	85	96.7 Å²	96.7	59%	0.594	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-23.6	-175.8	-16.5	0	0	0	0	113	P650 E651 D652 T656	P650-S654 PolarHBondContact O-OG 3.35Å; E651-S654 WeakPolarHBondContact O-CB 3.49Å; E651-S654 PolarHBondContact O-N 3.01Å; E651-S654 PolarHBondContact O-OG 3.18Å; D652-S654 VanDerWaalsContact C-N 3.32Å; S654-T656 PolarHBondContact O-N 3.35Å
655	E	41.7	Very low	52.8	Low	174 Å²	174	106 Å²	106	81%	0.813	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-2.4	-175.7	-68.1	-169.6	159.5	0	0	113.9
656	T	36.9	Very low	51	Low	116 Å²	116	109.1 Å²	109.1	71%	0.712	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	7	-178.3	21.3	0	0	0	0	115.3	A653 S654	A653-T656 PolarHBondContact O-OG1 2.95Å; S654-T656 PolarHBondContact O-N 3.35Å
657	Q	28.8	Very low	49.2	Very low	173 Å²	173	112.9 Å²	112.9	81%	0.808	64%	0.644	S	S	*	*	S	Bend	trans	-92.3	118.9	168.7	-79.3	-169.3	-26	0	0	111.6	Q659	Q657-Q659 PolarHBondContact O-N 3.23Å
658	P	33.3	Very low	47.1	Very low	116 Å²	116	114.8 Å²	114.8	75%	0.753	66%	0.657	S	S	*	*			trans	-69.5	124.7	178.1	26.1	-30.6	0	0	0	110.7	V660	P658-V660 PolarHBondContact O-N 2.81Å; P658-V660 VanDerWaalsContact O-N 3.12Å
659	Q	31.2	Very low	44.8	Very low	195 Å²	195	121.5 Å²	121.5	91%	0.911	70%	0.695	S	S	*	*			trans	-59	112.2	166.2	-72.2	-174.9	-9.1	0	0	109	Q657 G661	Q657-Q659 PolarHBondContact O-N 3.23Å; Q659-G661 PolarHBondContact O-N 2.7Å; Q659-G661 VanDerWaalsContact O-N 3.12Å
660	V	33.8	Very low	42.3	Very low	137 Å²	137	128.6 Å²	128.6	83%	0.83	74%	0.736	S	S	*	*			trans	-69.5	105.8	166.5	179.4	0	0	0	0	106.7	P658 H662	P658-V660 PolarHBondContact O-N 2.81Å; P658-V660 VanDerWaalsContact O-N 3.12Å; V660-H662 PolarHBondContact O-N 3.42Å
661	G	31	Very low	39.9	Very low	62 Å²	62	132.1 Å²	132.1	64%	0.639	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-60.5	122.6	176.4	0	0	0	0	0	111.1	Q659 V663	Q659-G661 PolarHBondContact O-N 2.7Å; Q659-G661 VanDerWaalsContact O-N 3.12Å; G661-V663 PolarHBondContact O-N 3.47Å
662	H	31.1	Very low	37.6	Very low	195 Å²	195	135.4 Å²	135.4	90%	0.903	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.4	116.4	156.1	-94.1	-71.3	0	0	0	108.2	V660	V660-H662 PolarHBondContact O-N 3.42Å
663	V	33.1	Very low	35.7	Very low	133 Å²	133	140.8 Å²	140.8	81%	0.806	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-103.9	118.1	161.9	177.6	0	0	0	0	106.6	G661	G661-V663 PolarHBondContact O-N 3.47Å
664	E	31.3	Very low	34	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-65.9	137.3	169	-71.3	176.9	147.6	0	0	110.5
665	S	31	Very low	33	Very low	195 Å²	195	152.7 Å²	152.7	100%	1.364	85%	0.854	S	S	*	*			trans	-148.8	0	146.6	-69.1	0	0	0	0	108.4

Retrieved 665 of 665 residues in 233.3 ms (Link to these results)

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