A0A077ZA71_TRITR Loading...

Transmembrane GTPase Marf

AlphaFold DB , UniProt , Accession A0A077ZA71, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 785 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.8	Very low	37.3	Very low	244 Å²	244	145 Å²	145	100%	1.202	83%	0.833	S	S	*	*				0	93.2	0	-81.2	-173.6	177.2	0	0	105.2
2	D	33.8	Very low	37	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	84%	0.836	S	S	*	*			trans	-89.1	167.7	-163.8	-71	-52.8	0	0	0	113.5
3	V	35.4	Very low	36.7	Very low	120 Å²	120	148.2 Å²	148.2	73%	0.727	82%	0.824	S	S	*	*			trans	98.7	95.8	146.6	-161.1	0	0	0	0	117.8	L5	V3-L5 HydrophobicContact CG1-CD1 4.3Å
4	S	32.1	Very low	37	Very low	109 Å²	109	146.8 Å²	146.8	76%	0.762	82%	0.824	S	S	*	*			trans	-61.7	139.7	144	48.6	0	0	0	0	112.6
5	L	35.5	Very low	36.3	Very low	162 Å²	162	149.8 Å²	149.8	85%	0.848	82%	0.82	S	S	*	*			trans	-168.1	119.1	152.3	-98.4	164.3	0	0	0	110.2	V3	V3-L5 HydrophobicContact CG1-CD1 4.3Å
6	T	39	Very low	36.2	Very low	127 Å²	127	147.8 Å²	147.8	78%	0.779	82%	0.82	S	S	*	*			trans	-105.8	154.8	153.4	50.5	0	0	0	0	106.8
7	P	44	Very low	35.8	Very low	106 Å²	106	149.6 Å²	149.6	69%	0.688	82%	0.82	S	S	*	*				-162.8	172.3	80.4	40.9	-18.2	0	0	0	119.5
8	N	33.3	Very low	35.7	Very low	160 Å²	160	147.6 Å²	147.6	86%	0.856	82%	0.815	S	S	*	*			trans	82.7	128.4	145.4	-71.2	-2.4	0	0	0	123.5
9	G	38.2	Very low	35.6	Very low	78 Å²	78	150.6 Å²	150.6	80%	0.804	82%	0.819	S	S	*	*			trans	-168.1	111.5	159.2	0	0	0	0	0	110.1
10	E	34.9	Very low	35.2	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	82%	0.816	S	S	*	*			trans	-73.4	158.6	-174.6	-63.6	163.1	145.4	0	0	113.7
11	N	41.3	Very low	35.1	Very low	155 Å²	155	147.1 Å²	147.1	83%	0.829	81%	0.814	S	S	*	*			trans	-165.8	105.4	142.8	-95.3	-19.4	0	0	0	111.6
12	E	34.4	Very low	34.5	Very low	187 Å²	187	140.9 Å²	140.9	87%	0.874	80%	0.795	S	S	*	*			trans	37.6	123	137.1	-58.3	-172.9	156.3	0	0	122.5
13	E	32.1	Very low	34.4	Very low	145 Å²	145	138.6 Å²	138.6	68%	0.678	79%	0.791	S	S	*	*			trans	-75.2	174.5	162.1	-62.8	-179.6	142.1	0	0	112.6	Y15	E13-Y15 VanDerWaalsContact OE2-CD2 3.26Å; E13-Y15 WeakPolarHBondContact OE2-CD2 3.35Å; E13-Y15 WeakPolarHBondContact OE2-CE2 3.22Å
14	P	40.7	Very low	34.1	Very low	128 Å²	128	139.8 Å²	139.8	83%	0.831	79%	0.793	S	S	*	*				-146.2	148.7	95.9	33.3	-14.5	0	0	0	117.1
15	Y	27.3	Very low	33.7	Very low	192 Å²	192	146.1 Å²	146.1	75%	0.753	80%	0.8	S	S	*	*			trans	-43.7	137.9	166.3	-84.7	-106.4	0	0	0	116.2	E13	E13-Y15 VanDerWaalsContact OE2-CD2 3.26Å; E13-Y15 WeakPolarHBondContact OE2-CD2 3.35Å; E13-Y15 WeakPolarHBondContact OE2-CE2 3.22Å
16	S	34.1	Very low	33.4	Very low	117 Å²	117	146 Å²	146	82%	0.818	80%	0.799	S	S	*	*			trans	-151.7	118.7	146.5	55.1	0	0	0	0	112.4
17	H	29.7	Very low	32.8	Very low	180 Å²	180	145.4 Å²	145.4	83%	0.833	80%	0.799	S	S	*	*			trans	-110.4	162	152.3	-91.7	-47.4	0	0	0	106.1
18	P	34.7	Very low	31.9	Very low	112 Å²	112	145.9 Å²	145.9	73%	0.727	81%	0.812	S	S	*	*			cis	-150.4	174.3	34.5	38.1	-15.8	0	0	0	116.7
19	K	32.3	Very low	31.5	Very low	206 Å²	206	142.1 Å²	142.1	90%	0.896	80%	0.803	S	S	*	*				-179	111.4	129	-98.2	171.7	-171	-177.1	0	110.6
20	S	28	Very low	31	Very low	108 Å²	108	146.6 Å²	146.6	76%	0.755	81%	0.809	S	S	*	*			trans	-95.1	162.3	153.7	53.5	0	0	0	0	109
21	P	33.8	Very low	30.6	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	81%	0.806	S	S	*	*				-135.2	135.8	108	31.6	-17.2	0	0	0	113.9
22	S	29.5	Very low	29.9	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	81%	0.808	S	S	*	*			trans	-13	129.8	150.3	51.1	0	0	0	0	118.5
23	S	32.2	Very low	29.7	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	81%	0.808	S	S	*	*				-155.5	121.1	117.2	-167.1	0	0	0	0	111
24	N	30	Very low	29.5	Very low	145 Å²	145	142.5 Å²	142.5	78%	0.775	81%	0.808	S	S	*	*			trans	61.3	91.1	153.7	-63.3	-10.5	0	0	0	120.6
25	R	23.7	Very low	29	Very low	242 Å²	242	144.1 Å²	144.1	91%	0.913	81%	0.81	S	S	*	*			trans	-68.2	120.6	143.4	-73.4	178.7	-178.1	179.1	0.3	109.5
26	L	27.6	Very low	29.5	Very low	158 Å²	158	141 Å²	141	83%	0.827	80%	0.8	S	S	*	*			trans	-152.2	120.7	147.3	-102.5	135	0	0	0	108.4
27	C	27	Very low	29.3	Very low	116 Å²	116	140.5 Å²	140.5	78%	0.784	80%	0.797	S	S	*	*			trans	71.9	66.5	162.7	-55.2	0	0	0	0	118.5	A29	C27-A29 PolarHBondContact O-N 3.4Å
28	A	24.9	Very low	29.8	Very low	115 Å²	115	139.2 Å²	139.2	95%	0.95	80%	0.797	S	S	*	*			trans	-90	84.5	151.9	0	0	0	0	0	109.3
29	A	25.8	Very low	30.4	Very low	81 Å²	81	137.8 Å²	137.8	67%	0.669	78%	0.779	S	S	*	*			trans	-143.6	78.8	169.1	0	0	0	0	0	107.6	C27	C27-A29 PolarHBondContact O-N 3.4Å
30	N	26.1	Very low	31.8	Very low	173 Å²	173	132.5 Å²	132.5	93%	0.925	77%	0.768	S	S	*	*			trans	171	83.7	158.1	-89.4	-15.7	0	0	0	109.8
31	A	27.6	Very low	34.5	Very low	95 Å²	95	127.6 Å²	127.6	79%	0.785	73%	0.733	S	S	*	*			trans	-164.2	64	160.6	0	0	0	0	0	109.8
32	K	27.3	Very low	37.2	Very low	203 Å²	203	123.5 Å²	123.5	88%	0.883	71%	0.707	S	S	*	*			trans	-115.6	63.3	157.7	-79.7	-169.4	177.7	-176.5	0	108
33	H	29.1	Very low	40.3	Very low	186 Å²	186	118.1 Å²	118.1	86%	0.861	67%	0.67	S	S	*	*			trans	-157.3	77.4	168.1	-90.2	-58.2	0	0	0	107.8
34	S	27.7	Very low	43.2	Very low	99 Å²	99	116.1 Å²	116.1	69%	0.692	65%	0.648	S	S	*	*			trans	-154.8	66	171.3	63.9	0	0	0	0	110.8
35	D	31.1	Very low	46.2	Very low	162 Å²	162	110.2 Å²	110.2	87%	0.866	62%	0.615	S	S	*	*			trans	-126.1	35.2	159.8	-86.8	-23.2	0	0	0	109.9
36	F	36.6	Very low	49.5	Very low	125 Å²	125	98.7 Å²	98.7	55%	0.548	57%	0.572	S	S	.	*			trans	-118.4	40	178.4	-90.5	-79.8	0	0	0	112.1
37	S	30.9	Very low	52.7	Low	108 Å²	108	93.4 Å²	93.4	76%	0.755	55%	0.546	S	S	*	.			trans	-96.7	7.4	-173.3	60.6	0	0	0	0	116.8
38	D	40.2	Very low	55.9	Low	153 Å²	153	91.6 Å²	91.6	82%	0.818	53%	0.526	S	S	*	.	S	Bend	trans	-114.9	9.3	-178.1	-90.8	-9.2	0	0	0	116.2
39	F	47.4	Very low	59.2	Low	82 Å²	82	86.1 Å²	86.1	36%	0.36	48%	0.481	S	S	.	.			trans	-118.3	123.6	178	-62.1	-84.2	0	0	0	111.7	S41 R45 E48	F39-S41 VanDerWaalsContact C-N 3.26Å; F39-S41 PolarHBondContact O-N 3.1Å; F39-R45 HydrophobicContact CD1-CG 4.4Å; F39-R45 VanDerWaalsContact CD2-NH1 3.26Å; F39-R45 HydrophobicContact CE1-CG 4.42Å; F39-R45 VanDerWaalsContact CZ-NH1 3.27Å; F39-E48 WeakPolarHBondContact CE1-OE2 3.33Å
40	S	61.7	Low	62.5	Low	95 Å²	95	82.7 Å²	82.7	66%	0.664	45%	0.451	S	S	*	.	S	Bend	trans	-73.8	-12.6	-175.3	95.1	0	0	0	0	114.1	Q44	S40-Q44 VanDerWaalsContact OG-CD 3.28Å; S40-Q44 PolarHBondContact OG-NE2 2.75Å; S40-Q44 PolarHBondContact OG-OE1 3.2Å
41	S	83.7	Confident	65.7	Low	4 Å²	4	77 Å²	77	3%	0.028	43%	0.428	C	S	.	.			trans	-161.9	154.2	159	69.6	0	0	0	0	112.8	F39 L43 Q44	F39-S41 VanDerWaalsContact C-N 3.26Å; F39-S41 PolarHBondContact O-N 3.1Å; S41-L43 PolarHBondContact O-N 2.87Å; S41-Q44 PolarHBondContact O-N 3.2Å; S41-Q44 WeakPolarHBondContact OG-CB 3.47Å; S41-Q44 VanDerWaalsContact OG-CG 3.31Å; S41-Q44 WeakPolarHBondContact OG-CG 3.1Å; S41-Q44 PolarHBondContact OG-N 3.16Å; S41-Q44 VanDerWaalsContact OG-N 3.15Å
42	P	91	Very high	69	Low	34 Å²	34	76.7 Å²	76.7	22%	0.221	41%	0.409	C	S	.	.	H	α-helix	trans	-57.4	-33.7	172.6	-25.3	34.7	0	0	0	113.9	R45 E379 L380 S383	P42-R45 WeakPolarHBondContact O-CB 3.29Å; P42-R45 PolarHBondContact O-N 3.23Å; P42-E379 HydrophobicContact CB-CB 4.31Å; P42-E379 HydrophobicContact CG-CB 4.33Å; P42-L380 HydrophobicContact CB-CD2 3.97Å; P42-L380 HydrophobicContact CB-CG 4.41Å; P42-L380 HydrophobicContact CG-CD2 3.55Å; P42-L380 HydrophobicContact CG-CG 3.93Å; P42-S383 WeakPolarHBondContact O-CB 3.43Å; P42-S383 PolarHBondContact O-OG 3.02Å
43	L	94.2	Very high	72.2	Confident	0 Å²	0	67 Å²	67	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-70	-38.8	-179.9	-57.4	179.8	0	0	0	112.3	S41 R45 F46 V47 M131 L223 N226 V228 E379 I382	S41-L43 PolarHBondContact O-N 2.87Å; L43-R45 PolarHBondContact O-N 3.41Å; L43-F46 WeakPolarHBondContact O-CB 3.43Å; L43-F46 PolarHBondContact O-N 2.76Å; L43-F46 VanDerWaalsContact O-N 3.07Å; L43-V47 PolarHBondContact O-N 2.98Å; L43-M131 HydrophobicContact CB-CE 4.24Å; L43-M131 HydrophobicContact CD2-CE 3.96Å; L43-M131 HydrophobicContact CD2-SD 3.89Å; L43-L223 HydrophobicContact CD1-CD2 3.57Å; L43-N226 HydrophobicContact CB-CB 3.55Å; L43-N226 HydrophobicContact CD1-CB 4.16Å; L43-V228 HydrophobicContact CD1-CG2 4.01Å; L43-V228 HydrophobicContact CD2-CG2 3.93Å; L43-E379 HydrophobicContact CD1-CG 3.85Å; L43-E379 HydrophobicContact CD2-CB 4.06Å; L43-E379 HydrophobicContact CD2-CG 4.05Å; L43-E379 HydrophobicContact CG-CB 4.09Å; L43-E379 HydrophobicContact CG-CG 3.83Å; L43-I382 HydrophobicContact CD2-CG2 3.68Å
44	Q	93.1	Very high	75.4	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.29	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-32.6	174.7	-80.4	172.7	-8.1	0	0	112	S40 S41 F46 V47 E48 N226	S40-Q44 VanDerWaalsContact OG-CD 3.28Å; S40-Q44 PolarHBondContact OG-NE2 2.75Å; S40-Q44 PolarHBondContact OG-OE1 3.2Å; S41-Q44 PolarHBondContact O-N 3.2Å; S41-Q44 WeakPolarHBondContact OG-CB 3.47Å; S41-Q44 VanDerWaalsContact OG-CG 3.31Å; S41-Q44 WeakPolarHBondContact OG-CG 3.1Å; S41-Q44 PolarHBondContact OG-N 3.16Å; S41-Q44 VanDerWaalsContact OG-N 3.15Å; Q44-F46 VanDerWaalsContact C-N 3.26Å; Q44-F46 PolarHBondContact O-N 3.03Å; Q44-V47 PolarHBondContact O-N 3.01Å; Q44-V47 VanDerWaalsContact O-N 3.08Å; Q44-E48 WeakPolarHBondContact O-CB 3.35Å; Q44-E48 WeakPolarHBondContact O-CG 3.42Å; Q44-E48 PolarHBondContact O-N 3.43Å; Q44-N226 WeakPolarHBondContact CG-OD1 3.46Å
45	R	92.8	Very high	78.6	Confident	21 Å²	21	57 Å²	57	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-59.9	-37.3	175.7	-163.8	-172.5	-176.4	100.3	-2.2	112.2	F39 P42 L43 A49 I387 N779 Y780 Y784	F39-R45 HydrophobicContact CD1-CG 4.4Å; F39-R45 VanDerWaalsContact CD2-NH1 3.26Å; F39-R45 HydrophobicContact CE1-CG 4.42Å; F39-R45 VanDerWaalsContact CZ-NH1 3.27Å; P42-R45 WeakPolarHBondContact O-CB 3.29Å; P42-R45 PolarHBondContact O-N 3.23Å; L43-R45 PolarHBondContact O-N 3.41Å; R45-A49 VanDerWaalsContact O-CB 3.25Å; R45-A49 WeakPolarHBondContact O-CB 3.4Å; R45-A49 PolarHBondContact O-N 3.07Å; R45-I387 HydrophobicContact CG-CD1 4.29Å; R45-N779 PolarHBondContact NH2-O 3.07Å; R45-Y780 HydrophobicContact CG-CD1 4.26Å; R45-Y780 HydrophobicContact CG-CE1 4.29Å; R45-Y784 WeakPolarHBondContact CD-OH 3.35Å; R45-Y784 PolarHBondContact NE-OH 3.48Å
46	F	94.2	Very high	81.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-45.6	173	173.6	-90.6	0	0	0	111.1	L43 Q44 E48 A49 K50 M131 A386 I387 K390 F391	L43-F46 WeakPolarHBondContact O-CB 3.43Å; L43-F46 PolarHBondContact O-N 2.76Å; L43-F46 VanDerWaalsContact O-N 3.07Å; Q44-F46 VanDerWaalsContact C-N 3.26Å; Q44-F46 PolarHBondContact O-N 3.03Å; F46-E48 VanDerWaalsContact C-N 3.35Å; F46-E48 PolarHBondContact O-N 2.9Å; F46-A49 PolarHBondContact O-N 2.87Å; F46-K50 HydrophobicContact CE1-CD 4.21Å; F46-K50 WeakPolarHBondContact O-CB 3.45Å; F46-K50 PolarHBondContact O-N 3.42Å; F46-M131 HydrophobicContact CB-CE 3.83Å; F46-M131 HydrophobicContact CB-SD 3.79Å; F46-M131 HydrophobicContact CD1-CE 3.6Å; F46-M131 HydrophobicContact CD1-CG 4.01Å; F46-M131 HydrophobicContact CD1-SD 4.12Å; F46-M131 HydrophobicContact CD2-CG 4.06Å; F46-M131 HydrophobicContact CD2-SD 4.35Å; F46-M131 HydrophobicContact CE1-CE 4.41Å; F46-M131 HydrophobicContact CE1-CG 4.22Å; F46-M131 HydrophobicContact CE2-CG 4.28Å; F46-M131 HydrophobicContact CG-CE 3.85Å; F46-M131 HydrophobicContact CG-CG 3.93Å; F46-M131 HydrophobicContact CG-SD 3.82Å; F46-M131 HydrophobicContact CZ-CG 4.35Å; F46-A386 HydrophobicContact CD2-CB 3.67Å; F46-A386 HydrophobicContact CE2-CB 3.58Å; F46-A386 HydrophobicContact CZ-CB 4.48Å; F46-I387 HydrophobicContact CB-CD1 4.48Å; F46-I387 HydrophobicContact CB-CG1 4.26Å; F46-I387 HydrophobicContact CD2-CG1 3.9Å; F46-K390 HydrophobicContact CE2-CD 4.07Å; F46-K390 HydrophobicContact CZ-CD 4.17Å; F46-F391 AromaticContact CD2-CE2 3.88Å; F46-F391 HydrophobicContact CD2-CE2 3.88Å; F46-F391 HydrophobicContact CD2-CZ 4.14Å; F46-F391 AromaticContact CE2-CE2 3.67Å; F46-F391 HydrophobicContact CE2-CE2 3.67Å; F46-F391 AromaticContact CE2-CZ 3.51Å; F46-F391 HydrophobicContact CE2-CZ 3.51Å; F46-F391 HydrophobicContact CZ-CE2 4.38Å; F46-F391 AromaticContact CZ-CZ 3.8Å; F46-F391 HydrophobicContact CZ-CZ 3.8Å
47	V	93.8	Very high	84.6	Confident	47 Å²	47	43.3 Å²	43.3	29%	0.285	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-43.4	179.4	179.2	0	0	0	0	111.3	L43 Q44 K50 A51 N226	L43-V47 PolarHBondContact O-N 2.98Å; Q44-V47 PolarHBondContact O-N 3.01Å; Q44-V47 VanDerWaalsContact O-N 3.08Å; V47-K50 PolarHBondContact O-N 2.9Å; V47-A51 WeakPolarHBondContact O-CB 3.41Å; V47-A51 PolarHBondContact O-N 3.49Å; V47-N226 HydrophobicContact CG2-CB 4.14Å
48	E	94	Very high	87.7	Confident	78 Å²	78	43.1 Å²	43.1	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-45	175.2	-72.6	172.2	-165.4	0	0	111.8	F39 Q44 F46 A51 K52	F39-E48 WeakPolarHBondContact CE1-OE2 3.33Å; Q44-E48 WeakPolarHBondContact O-CB 3.35Å; Q44-E48 WeakPolarHBondContact O-CG 3.42Å; Q44-E48 PolarHBondContact O-N 3.43Å; F46-E48 VanDerWaalsContact C-N 3.35Å; F46-E48 PolarHBondContact O-N 2.9Å; E48-A51 PolarHBondContact O-N 3.35Å; E48-K52 WeakPolarHBondContact O-CB 3.44Å; E48-K52 PolarHBondContact O-N 3.05Å
49	A	94.6	Very high	90.3	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-49.4	175.5	0	0	0	0	0	110.7	R45 F46 A51 K52 I53 I387 F391 F776 Y780	R45-A49 VanDerWaalsContact O-CB 3.25Å; R45-A49 WeakPolarHBondContact O-CB 3.4Å; R45-A49 PolarHBondContact O-N 3.07Å; F46-A49 PolarHBondContact O-N 2.87Å; A49-A51 PolarHBondContact O-N 3.42Å; A49-K52 PolarHBondContact O-N 2.92Å; A49-K52 VanDerWaalsContact O-N 3.16Å; A49-I53 WeakPolarHBondContact O-CG2 3.23Å; A49-I53 PolarHBondContact O-N 3.34Å; A49-I387 HydrophobicContact CB-CD1 4.48Å; A49-I387 HydrophobicContact CB-CG1 4.36Å; A49-F391 HydrophobicContact CB-CD2 4.16Å; A49-F391 HydrophobicContact CB-CE2 3.86Å; A49-F776 HydrophobicContact CB-CE2 4.05Å; A49-F776 HydrophobicContact CB-CZ 3.98Å; A49-F776 VanDerWaalsContact O-CE2 3.24Å; A49-F776 WeakPolarHBondContact O-CE2 3.41Å; A49-Y780 HydrophobicContact CB-CD1 3.53Å; A49-Y780 HydrophobicContact CB-CE1 3.86Å; A49-Y780 HydrophobicContact CB-CG 3.93Å
50	K	94.9	Very high	92.5	Very high	10 Å²	10	35.1 Å²	35.1	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-55.3	-49.4	176.2	-173.3	-176.1	176.5	-179.1	0	111.5	F46 V47 K52 I53 Q54 L126 S127 D129 E227 F391	F46-K50 HydrophobicContact CE1-CD 4.21Å; F46-K50 WeakPolarHBondContact O-CB 3.45Å; F46-K50 PolarHBondContact O-N 3.42Å; V47-K50 PolarHBondContact O-N 2.9Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.28Å; K50-I53 WeakPolarHBondContact O-CG2 3.44Å; K50-Q54 WeakPolarHBondContact O-CB 3.3Å; K50-Q54 WeakPolarHBondContact O-CG 3.44Å; K50-Q54 PolarHBondContact O-N 3.36Å; K50-L126 WeakPolarHBondContact CE-O 3.31Å; K50-S127 PolarHBondContact NZ-O 2.9Å; K50-S127 VanDerWaalsContact NZ-O 3.12Å; K50-D129 WeakPolarHBondContact CE-O 3.48Å; K50-D129 PolarHBondContact NZ-O 3.39Å; K50-E227 WeakPolarHBondContact CD-OE2 3.49Å; K50-E227 WeakPolarHBondContact CE-OE2 3.34Å; K50-E227 IonicContact NZ-OE1 3.23Å; K50-E227 PolarHBondContact NZ-OE1 3.1Å; K50-E227 IonicContact NZ-OE2 2.73Å; K50-E227 PolarHBondContact NZ-OE2 2.9Å; K50-F391 HydrophobicContact CB-CE1 4.44Å; K50-F391 HydrophobicContact CB-CE2 4.41Å; K50-F391 HydrophobicContact CB-CZ 3.7Å; K50-F391 HydrophobicContact CG-CE1 4.48Å; K50-F391 HydrophobicContact CG-CZ 4.14Å
51	A	94.7	Very high	94.1	Very high	54 Å²	54	32.6 Å²	32.6	45%	0.446	16%	0.16	S	C	.	.	H	α-helix	trans	-61.9	-41	178.9	0	0	0	0	0	111.9	V47 E48 A49 D55	V47-A51 WeakPolarHBondContact O-CB 3.41Å; V47-A51 PolarHBondContact O-N 3.49Å; E48-A51 PolarHBondContact O-N 3.35Å; A49-A51 PolarHBondContact O-N 3.42Å; A51-D55 PolarHBondContact O-N 3.4Å
52	K	95.7	Very high	94.5	Very high	87 Å²	87	39 Å²	39	38%	0.378	18%	0.183	S	C	.	.	H	α-helix	trans	-67.8	-47.1	-179.2	-171.4	65	177.9	179.4	0	112.2	E48 A49 K50 Q54 D55 I56 F776 Y780	E48-K52 WeakPolarHBondContact O-CB 3.44Å; E48-K52 PolarHBondContact O-N 3.05Å; A49-K52 PolarHBondContact O-N 2.92Å; A49-K52 VanDerWaalsContact O-N 3.16Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 3.28Å; K52-Q54 VanDerWaalsContact C-N 3.34Å; K52-Q54 PolarHBondContact O-N 2.91Å; K52-D55 PolarHBondContact O-N 2.91Å; K52-I56 HydrophobicContact CG-CD1 4.47Å; K52-I56 WeakPolarHBondContact O-CG1 3.28Å; K52-I56 PolarHBondContact O-N 2.95Å; K52-I56 VanDerWaalsContact O-N 3.12Å; K52-F776 HydrophobicContact CB-CD2 4.28Å; K52-F776 HydrophobicContact CB-CE2 4.3Å; K52-F776 HydrophobicContact CG-CD2 4.12Å; K52-Y780 HydrophobicContact CG-CE2 4.45Å
53	I	95.8	Very high	94.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-37.5	179.4	-168	60.6	0	0	0	111.4	A49 K50 D55 I56 Y57 L126 F391 V395 L773 F776	A49-I53 WeakPolarHBondContact O-CG2 3.23Å; A49-I53 PolarHBondContact O-N 3.34Å; K50-I53 WeakPolarHBondContact O-CG2 3.44Å; I53-D55 PolarHBondContact O-N 2.88Å; I53-I56 HydrophobicContact CD1-CD1 4.39Å; I53-I56 PolarHBondContact O-N 3.32Å; I53-Y57 HydrophobicContact CD1-CD2 4.08Å; I53-Y57 HydrophobicContact CD1-CE2 4.02Å; I53-Y57 HydrophobicContact CG1-CD2 4.04Å; I53-Y57 HydrophobicContact CG1-CE2 4.16Å; I53-Y57 WeakPolarHBondContact O-CD2 3.37Å; I53-Y57 PolarHBondContact O-N 2.94Å; I53-L126 HydrophobicContact CG1-CD1 4.15Å; I53-L126 HydrophobicContact CG2-CD1 4.15Å; I53-L126 HydrophobicContact CG2-CD2 3.91Å; I53-F391 HydrophobicContact CG2-CD1 4Å; I53-F391 HydrophobicContact CG2-CE1 4.15Å; I53-F391 HydrophobicContact CG2-CG 4.4Å; I53-V395 HydrophobicContact CD1-CG2 3.93Å; I53-L773 HydrophobicContact CD1-CD2 3.62Å; I53-F776 HydrophobicContact CB-CD2 4.24Å; I53-F776 HydrophobicContact CB-CE2 3.77Å; I53-F776 HydrophobicContact CB-CZ 3.96Å; I53-F776 HydrophobicContact CD1-CG 4.44Å; I53-F776 HydrophobicContact CG2-CE2 4.45Å; I53-F776 HydrophobicContact CG2-CZ 4.41Å
54	Q	95.3	Very high	94.4	Very high	22 Å²	22	37.8 Å²	37.8	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-42.8	172.9	-76	178.7	7.8	0	0	112.6	K50 K52 I56 Y57 R58 L126 S127	K50-Q54 WeakPolarHBondContact O-CB 3.3Å; K50-Q54 WeakPolarHBondContact O-CG 3.44Å; K50-Q54 PolarHBondContact O-N 3.36Å; K52-Q54 VanDerWaalsContact C-N 3.34Å; K52-Q54 PolarHBondContact O-N 2.91Å; Q54-I56 VanDerWaalsContact C-N 3.32Å; Q54-I56 PolarHBondContact O-N 3.4Å; Q54-Y57 PolarHBondContact O-N 2.93Å; Q54-R58 WeakPolarHBondContact O-CG 3.35Å; Q54-R58 PolarHBondContact O-N 2.86Å; Q54-L126 HydrophobicContact CG-CB 3.85Å; Q54-L126 PolarHBondContact NE2-O 3.36Å; Q54-S127 VanDerWaalsContact NE2-CA 3.34Å
55	D	95.8	Very high	94.1	Very high	53 Å²	53	37.6 Å²	37.6	28%	0.283	18%	0.177	S	C	.	.	H	α-helix	trans	-60.5	-43.4	175.9	177.9	61.6	0	0	0	111.5	A51 K52 I53 Y57 R58 R59	A51-D55 PolarHBondContact O-N 3.4Å; K52-D55 PolarHBondContact O-N 2.91Å; I53-D55 PolarHBondContact O-N 2.88Å; D55-Y57 PolarHBondContact O-N 3.3Å; D55-R58 PolarHBondContact O-N 3.39Å; D55-R59 VanDerWaalsContact O-CG 3.28Å; D55-R59 WeakPolarHBondContact O-CG 3.42Å; D55-R59 PolarHBondContact O-N 2.96Å; D55-R59 WeakPolarHBondContact OD2-CD 3.32Å; D55-R59 IonicContact OD2-NH1 3.39Å
56	I	96.5	Very high	93.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-49.1	176.3	-63.9	166.6	0	0	0	110.1	K52 I53 Q54 R58 R59 I60 L769 D772 L773 F776	K52-I56 HydrophobicContact CG-CD1 4.47Å; K52-I56 WeakPolarHBondContact O-CG1 3.28Å; K52-I56 PolarHBondContact O-N 2.95Å; K52-I56 VanDerWaalsContact O-N 3.12Å; I53-I56 HydrophobicContact CD1-CD1 4.39Å; I53-I56 PolarHBondContact O-N 3.32Å; Q54-I56 VanDerWaalsContact C-N 3.32Å; Q54-I56 PolarHBondContact O-N 3.4Å; I56-R58 PolarHBondContact O-N 3.33Å; I56-R59 WeakPolarHBondContact O-CB 3.36Å; I56-R59 PolarHBondContact O-N 3.24Å; I56-R59 VanDerWaalsContact O-N 3.08Å; I56-I60 HydrophobicContact CG2-CD1 4Å; I56-I60 HydrophobicContact CG2-CG1 4.45Å; I56-I60 WeakPolarHBondContact O-CG1 3.1Å; I56-I60 PolarHBondContact O-N 3.46Å; I56-L769 HydrophobicContact CG2-CD2 4.45Å; I56-D772 HydrophobicContact CD1-CB 3.97Å; I56-D772 HydrophobicContact CG1-CB 4.07Å; I56-L773 HydrophobicContact CD1-CD2 4.32Å; I56-L773 HydrophobicContact CG2-CD2 3.68Å; I56-L773 HydrophobicContact CG2-CG 3.85Å; I56-F776 HydrophobicContact CD1-CB 4.32Å
57	Y	96.2	Very high	93.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.6	-41	178.5	-93.6	-89	0	0	0	113.4	I53 Q54 D55 R59 I60 E61 V119 I122 L126 H394 G398	I53-Y57 HydrophobicContact CD1-CD2 4.08Å; I53-Y57 HydrophobicContact CD1-CE2 4.02Å; I53-Y57 HydrophobicContact CG1-CD2 4.04Å; I53-Y57 HydrophobicContact CG1-CE2 4.16Å; I53-Y57 WeakPolarHBondContact O-CD2 3.37Å; I53-Y57 PolarHBondContact O-N 2.94Å; Q54-Y57 PolarHBondContact O-N 2.93Å; D55-Y57 PolarHBondContact O-N 3.3Å; Y57-R59 PolarHBondContact O-N 2.87Å; Y57-I60 PolarHBondContact O-N 3.49Å; Y57-E61 PolarHBondContact O-N 2.99Å; Y57-V119 HydrophobicContact CD1-CG1 3.97Å; Y57-I122 HydrophobicContact CD1-CB 4.15Å; Y57-I122 HydrophobicContact CD1-CG2 3.85Å; Y57-I122 HydrophobicContact CD2-CG2 4.41Å; Y57-I122 HydrophobicContact CE1-CB 3.77Å; Y57-I122 HydrophobicContact CE1-CD1 3.83Å; Y57-I122 HydrophobicContact CE1-CG1 4.41Å; Y57-I122 HydrophobicContact CE1-CG2 3.41Å; Y57-I122 VanDerWaalsContact CE1-CG2 3.41Å; Y57-I122 HydrophobicContact CE2-CG2 4Å; Y57-I122 HydrophobicContact CG-CG2 4.33Å; Y57-I122 VanDerWaalsContact CZ-CG2 3.48Å; Y57-L126 HydrophobicContact CD2-CD1 3.73Å; Y57-L126 HydrophobicContact CE2-CD1 4.18Å; Y57-L126 HydrophobicContact CG-CD1 4.12Å; Y57-H394 HydrophobicContact CE2-CB 4.2Å; Y57-H394 PolarHBondContact OH-O 2.88Å; Y57-G398 WeakPolarHBondContact OH-CA 3.49Å; Y57-G398 PolarHBondContact OH-N 3.11Å; Y57-G398 VanDerWaalsContact OH-N 3.16Å
58	R	95.4	Very high	93	Very high	104 Å²	104	41.7 Å²	41.7	39%	0.392	19%	0.194	S	C	.	.	H	α-helix	trans	-63.1	-30.5	172.8	-71.7	180	-164	122.1	8.7	112.6	Q54 D55 I56 R62	Q54-R58 WeakPolarHBondContact O-CG 3.35Å; Q54-R58 PolarHBondContact O-N 2.86Å; D55-R58 PolarHBondContact O-N 3.39Å; I56-R58 PolarHBondContact O-N 3.33Å; R58-R62 WeakPolarHBondContact O-CB 3.44Å; R58-R62 WeakPolarHBondContact O-CG 3.49Å; R58-R62 PolarHBondContact O-N 3.32Å; R58-R62 PolarHBondContact O-NE 2.92Å; R58-R62 VanDerWaalsContact O-NE 3.12Å
59	R	95	Very high	92.3	Very high	67 Å²	67	44.3 Å²	44.3	25%	0.253	21%	0.21	S	C	.	.	H	α-helix	trans	-77.4	-36.2	175.6	-70.4	166.9	59	-155.8	-9.8	111.6	D55 I56 Y57 C63 L769 D772	D55-R59 VanDerWaalsContact O-CG 3.28Å; D55-R59 WeakPolarHBondContact O-CG 3.42Å; D55-R59 PolarHBondContact O-N 2.96Å; D55-R59 WeakPolarHBondContact OD2-CD 3.32Å; D55-R59 IonicContact OD2-NH1 3.39Å; I56-R59 WeakPolarHBondContact O-CB 3.36Å; I56-R59 PolarHBondContact O-N 3.24Å; I56-R59 VanDerWaalsContact O-N 3.08Å; Y57-R59 PolarHBondContact O-N 2.87Å; R59-C63 WeakPolarHBondContact O-CB 3.36Å; R59-C63 PolarHBondContact O-N 2.95Å; R59-L769 HydrophobicContact CB-CD2 3.49Å; R59-L769 VanDerWaalsContact CB-CD2 3.49Å; R59-D772 IonicContact CZ-OD2 3.95Å; R59-D772 IonicContact NH1-OD2 2.74Å; R59-D772 PolarHBondContact NH1-OD2 2.85Å; R59-D772 IonicContact NH2-OD2 3.55Å; R59-D772 PolarHBondContact NH2-OD2 3.36Å
60	I	95.1	Very high	91.3	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-50	171.1	-67.4	168.5	0	0	0	109.9	I56 Y57 R62 C63 I64 V119 I401 L769 L773	I56-I60 HydrophobicContact CG2-CD1 4Å; I56-I60 HydrophobicContact CG2-CG1 4.45Å; I56-I60 WeakPolarHBondContact O-CG1 3.1Å; I56-I60 PolarHBondContact O-N 3.46Å; Y57-I60 PolarHBondContact O-N 3.49Å; I60-R62 PolarHBondContact O-N 2.86Å; I60-C63 WeakPolarHBondContact O-CA 3.38Å; I60-C63 VanDerWaalsContact O-CB 3.31Å; I60-C63 WeakPolarHBondContact O-CB 3.33Å; I60-C63 PolarHBondContact O-N 3.31Å; I60-I64 HydrophobicContact CG2-CD1 4.04Å; I60-I64 WeakPolarHBondContact O-CG1 3.43Å; I60-I64 PolarHBondContact O-N 3.3Å; I60-V119 HydrophobicContact CB-CG1 4.47Å; I60-V119 HydrophobicContact CG2-CG1 4.15Å; I60-V119 HydrophobicContact CG2-CG2 4.05Å; I60-I401 HydrophobicContact CG2-CG2 4.41Å; I60-L769 HydrophobicContact CG1-CB 4.32Å; I60-L769 HydrophobicContact CG1-CD1 3.94Å; I60-L769 HydrophobicContact CG1-CD2 4.41Å; I60-L769 HydrophobicContact CG1-CG 4.45Å; I60-L773 HydrophobicContact CD1-CD1 4.35Å
61	E	93.6	Very high	90.2	Very high	41 Å²	41	46.6 Å²	46.6	19%	0.192	22%	0.222	C	C	.	.	H	α-helix	trans	-56.6	-49.2	177.8	-170.5	172	-157.3	0	0	111.9	Y57 C63 I64 D65 V119 S120	Y57-E61 PolarHBondContact O-N 2.99Å; E61-C63 PolarHBondContact O-N 2.87Å; E61-I64 WeakPolarHBondContact O-CB 3.41Å; E61-I64 PolarHBondContact O-N 3.42Å; E61-D65 PolarHBondContact O-N 3.46Å; E61-V119 HydrophobicContact CB-CG1 3.82Å; E61-V119 HydrophobicContact CG-CG1 4.47Å; E61-S120 PolarHBondContact OE1-OG 3.15Å
62	R	92.2	Very high	89	Confident	138 Å²	138	44.9 Å²	44.9	52%	0.521	21%	0.209	S	C	.	.	H	α-helix	trans	-61.4	-32	174.5	-77.6	-177.9	-74.8	160.9	-9.6	113.3	R58 I60 K66	R58-R62 WeakPolarHBondContact O-CB 3.44Å; R58-R62 WeakPolarHBondContact O-CG 3.49Å; R58-R62 PolarHBondContact O-N 3.32Å; R58-R62 PolarHBondContact O-NE 2.92Å; R58-R62 VanDerWaalsContact O-NE 3.12Å; I60-R62 PolarHBondContact O-N 2.86Å; R62-K66 WeakPolarHBondContact O-CB 3.06Å; R62-K66 VanDerWaalsContact O-CG 3.31Å; R62-K66 WeakPolarHBondContact O-CG 3.49Å; R62-K66 PolarHBondContact O-N 3.32Å; R62-K66 VanDerWaalsContact O-N 3.09Å
63	C	91.1	Very high	87.5	Confident	9 Å²	9	42.8 Å²	42.8	6%	0.061	21%	0.213	C	C	.	.	H	α-helix	trans	-69.1	-44.8	176.5	-167.4	0	0	0	0	110.7	R59 I60 E61 K66 I67 L769	R59-C63 WeakPolarHBondContact O-CB 3.36Å; R59-C63 PolarHBondContact O-N 2.95Å; I60-C63 WeakPolarHBondContact O-CA 3.38Å; I60-C63 VanDerWaalsContact O-CB 3.31Å; I60-C63 WeakPolarHBondContact O-CB 3.33Å; I60-C63 PolarHBondContact O-N 3.31Å; E61-C63 PolarHBondContact O-N 2.87Å; C63-K66 PolarHBondContact O-N 2.93Å; C63-I67 WeakPolarHBondContact O-CD1 3.49Å; C63-I67 VanDerWaalsContact O-CG1 3.23Å; C63-I67 WeakPolarHBondContact O-CG1 3.46Å; C63-I67 PolarHBondContact O-N 2.83Å; C63-L769 HydrophobicContact CB-CD1 4.16Å
64	I	91.7	Very high	85.9	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-57.1	-50.2	174.2	-68.6	168.8	0	0	0	110.1	I60 E61 K66 I67 V68 V112 K116 V119 I405	I60-I64 HydrophobicContact CG2-CD1 4.04Å; I60-I64 WeakPolarHBondContact O-CG1 3.43Å; I60-I64 PolarHBondContact O-N 3.3Å; E61-I64 WeakPolarHBondContact O-CB 3.41Å; E61-I64 PolarHBondContact O-N 3.42Å; I64-K66 VanDerWaalsContact C-N 3.33Å; I64-K66 PolarHBondContact O-N 3.48Å; I64-I67 WeakPolarHBondContact O-CB 3.38Å; I64-I67 PolarHBondContact O-N 3.45Å; I64-I67 VanDerWaalsContact O-N 3.12Å; I64-V68 HydrophobicContact CG2-CG2 4.42Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 2.94Å; I64-V112 HydrophobicContact CG2-CG1 4.1Å; I64-K116 HydrophobicContact CG2-CB 4.21Å; I64-V119 HydrophobicContact CD1-CG2 3.93Å; I64-I405 HydrophobicContact CD1-CD1 4.01Å; I64-I405 HydrophobicContact CG1-CD1 3.77Å
65	D	88.2	Confident	84.1	Confident	58 Å²	58	44.7 Å²	44.7	31%	0.31	22%	0.222	S	C	.	.	H	α-helix	trans	-59	-42.5	178.7	-76.4	-27.5	0	0	0	112.7	E61 I67 V68 L69 K116	E61-D65 PolarHBondContact O-N 3.46Å; D65-I67 VanDerWaalsContact C-N 3.35Å; D65-V68 PolarHBondContact O-N 3.47Å; D65-L69 WeakPolarHBondContact O-CB 3.24Å; D65-L69 PolarHBondContact O-N 3.15Å; D65-K116 WeakPolarHBondContact OD1-CE 3.31Å; D65-K116 IonicContact OD1-NZ 2.9Å; D65-K116 PolarHBondContact OD1-NZ 2.92Å
66	K	85.7	Confident	81.9	Confident	123 Å²	123	45.3 Å²	45.3	54%	0.535	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-40.6	176.3	-78.5	179.1	178.9	-174	0	112.1	R62 C63 I64 I70 M762	R62-K66 WeakPolarHBondContact O-CB 3.06Å; R62-K66 VanDerWaalsContact O-CG 3.31Å; R62-K66 WeakPolarHBondContact O-CG 3.49Å; R62-K66 PolarHBondContact O-N 3.32Å; R62-K66 VanDerWaalsContact O-N 3.09Å; C63-K66 PolarHBondContact O-N 2.93Å; I64-K66 VanDerWaalsContact C-N 3.33Å; I64-K66 PolarHBondContact O-N 3.48Å; K66-I70 HydrophobicContact CB-CD1 4.38Å; K66-I70 VanDerWaalsContact O-CB 3.32Å; K66-I70 WeakPolarHBondContact O-CB 3.34Å; K66-I70 VanDerWaalsContact O-CG1 3.3Å; K66-I70 WeakPolarHBondContact O-CG1 3.49Å; K66-I70 PolarHBondContact O-N 3.36Å; K66-M762 VanDerWaalsContact O-CE 3.3Å; K66-M762 WeakPolarHBondContact O-CE 3.39Å
67	I	86	Confident	79.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-53.7	176.6	-68.4	162	0	0	0	109	C63 I64 D65 L69 L71 V112 I405 L409 M762 L766	C63-I67 WeakPolarHBondContact O-CD1 3.49Å; C63-I67 VanDerWaalsContact O-CG1 3.23Å; C63-I67 WeakPolarHBondContact O-CG1 3.46Å; C63-I67 PolarHBondContact O-N 2.83Å; I64-I67 WeakPolarHBondContact O-CB 3.38Å; I64-I67 PolarHBondContact O-N 3.45Å; I64-I67 VanDerWaalsContact O-N 3.12Å; D65-I67 VanDerWaalsContact C-N 3.35Å; I67-L69 PolarHBondContact O-N 3.37Å; I67-L71 HydrophobicContact CG2-CD1 3.69Å; I67-L71 WeakPolarHBondContact O-CB 3.43Å; I67-L71 WeakPolarHBondContact O-CG 3.25Å; I67-L71 PolarHBondContact O-N 3.23Å; I67-V112 HydrophobicContact CB-CG1 4.36Å; I67-V112 HydrophobicContact CG2-CG1 3.99Å; I67-I405 HydrophobicContact CD1-CG2 3.79Å; I67-L409 HydrophobicContact CD1-CD1 4.07Å; I67-L409 HydrophobicContact CG2-CD2 4.23Å; I67-M762 HydrophobicContact CB-CE 4.44Å; I67-M762 HydrophobicContact CB-SD 4.18Å; I67-M762 HydrophobicContact CG1-CB 4.22Å; I67-M762 HydrophobicContact CG1-CE 4.13Å; I67-M762 HydrophobicContact CG1-CG 4.02Å; I67-M762 HydrophobicContact CG1-SD 3.52Å; I67-M762 VanDerWaalsContact CG1-SD 3.52Å; I67-M762 HydrophobicContact CG2-SD 4.5Å; I67-L766 HydrophobicContact CD1-CD1 4.29Å
68	V	85.5	Confident	77.3	Confident	31 Å²	31	49.3 Å²	49.3	19%	0.188	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-44.7	-178	175.7	0	0	0	0	111.6	I64 D65 G72 V112 E113	I64-V68 HydrophobicContact CG2-CG2 4.42Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 2.94Å; D65-V68 PolarHBondContact O-N 3.47Å; V68-G72 VanDerWaalsContact O-CA 3.22Å; V68-G72 WeakPolarHBondContact O-CA 3.33Å; V68-G72 PolarHBondContact O-N 3.23Å; V68-V112 HydrophobicContact CG2-CG1 4.33Å; V68-E113 HydrophobicContact CG2-CB 4.12Å
69	L	79.5	Confident	74.5	Confident	133 Å²	133	49.7 Å²	49.7	70%	0.696	26%	0.262	S	S	*	.	H	α-helix	trans	-71.8	-47.6	-176.6	-171.5	146.1	0	0	0	112.7	D65 I67 G73	D65-L69 WeakPolarHBondContact O-CB 3.24Å; D65-L69 PolarHBondContact O-N 3.15Å; I67-L69 PolarHBondContact O-N 3.37Å; L69-G73 PolarHBondContact O-N 2.91Å
70	I	74.2	Confident	71.7	Confident	58 Å²	58	55.2 Å²	55.2	30%	0.297	28%	0.284	S	S	.	.	H	α-helix	trans	-75.7	-45.5	-175.3	-59.4	166.5	0	0	0	110.3	K66 K74 V758 M762	K66-I70 HydrophobicContact CB-CD1 4.38Å; K66-I70 VanDerWaalsContact O-CB 3.32Å; K66-I70 WeakPolarHBondContact O-CB 3.34Å; K66-I70 VanDerWaalsContact O-CG1 3.3Å; K66-I70 WeakPolarHBondContact O-CG1 3.49Å; K66-I70 PolarHBondContact O-N 3.36Å; I70-K74 HydrophobicContact CG2-CD 4.23Å; I70-K74 HydrophobicContact CG2-CG 4.49Å; I70-K74 WeakPolarHBondContact O-CB 3.44Å; I70-K74 WeakPolarHBondContact O-CG 3.49Å; I70-K74 PolarHBondContact O-N 3.41Å; I70-V758 HydrophobicContact CB-CG1 4.35Å; I70-V758 HydrophobicContact CG2-CB 4.42Å; I70-V758 HydrophobicContact CG2-CG1 3.66Å; I70-V758 HydrophobicContact CG2-CG2 4.03Å; I70-M762 HydrophobicContact CB-CE 3.94Å; I70-M762 HydrophobicContact CD1-CE 3.8Å; I70-M762 HydrophobicContact CG1-CE 4.37Å; I70-M762 HydrophobicContact CG2-CE 4.49Å
71	L	72	Confident	69	Low	0 Å²	0	61 Å²	61	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.5	-45	176.6	-66.2	177.5	0	0	0	109.9	I67 G73 K74 L75 L109 L409 L412 V755 I759 M762	I67-L71 HydrophobicContact CG2-CD1 3.69Å; I67-L71 WeakPolarHBondContact O-CB 3.43Å; I67-L71 WeakPolarHBondContact O-CG 3.25Å; I67-L71 PolarHBondContact O-N 3.23Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-G73 PolarHBondContact O-N 2.83Å; L71-K74 PolarHBondContact O-N 2.93Å; L71-L75 HydrophobicContact CB-CD1 3.93Å; L71-L75 WeakPolarHBondContact O-CB 3.37Å; L71-L75 VanDerWaalsContact O-CD1 3.25Å; L71-L75 WeakPolarHBondContact O-CD1 3.39Å; L71-L75 WeakPolarHBondContact O-CG 3.44Å; L71-L75 PolarHBondContact O-N 3.47Å; L71-L109 HydrophobicContact CB-CD2 3.81Å; L71-L409 HydrophobicContact CD1-CD2 3.92Å; L71-L412 HydrophobicContact CD1-CD2 3.93Å; L71-V755 HydrophobicContact CD2-CG1 3.97Å; L71-I759 HydrophobicContact CD2-CG1 4.19Å; L71-M762 HydrophobicContact CG-SD 4.45Å
72	G	69.5	Low	66.4	Low	18 Å²	18	62.8 Å²	62.8	19%	0.186	32%	0.321	C	S	.	.	H	α-helix	trans	-56.2	-46.1	175.7	0	0	0	0	0	112.9	V68 C76	V68-G72 VanDerWaalsContact O-CA 3.22Å; V68-G72 WeakPolarHBondContact O-CA 3.33Å; V68-G72 PolarHBondContact O-N 3.23Å; G72-C76 VanDerWaalsContact O-CB 3.3Å; G72-C76 WeakPolarHBondContact O-CB 3.49Å; G72-C76 PolarHBondContact O-N 2.94Å
73	G	63	Low	63.8	Low	44 Å²	44	64.4 Å²	64.4	45%	0.454	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-46.9	177	0	0	0	0	0	113.2	L69 L71 C76 S77	L69-G73 PolarHBondContact O-N 2.91Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-G73 PolarHBondContact O-N 2.83Å; G73-C76 PolarHBondContact O-N 3.37Å; G73-S77 PolarHBondContact O-N 3.22Å; G73-S77 PolarHBondContact O-OG 2.95Å
74	K	62.9	Low	61.1	Low	45 Å²	45	69.3 Å²	69.3	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-70.3	-33.1	-179.7	-70.8	-168.5	176.2	-136.9	0	112.9	I70 L71 S77 T78 E754 V755 V758	I70-K74 HydrophobicContact CG2-CD 4.23Å; I70-K74 HydrophobicContact CG2-CG 4.49Å; I70-K74 WeakPolarHBondContact O-CB 3.44Å; I70-K74 WeakPolarHBondContact O-CG 3.49Å; I70-K74 PolarHBondContact O-N 3.41Å; L71-K74 PolarHBondContact O-N 2.93Å; K74-S77 VanDerWaalsContact C-OG 3.31Å; K74-S77 WeakPolarHBondContact CA-OG 3.33Å; K74-S77 PolarHBondContact O-OG 2.9Å; K74-T78 PolarHBondContact O-OG1 3.5Å; K74-E754 HydrophobicContact CD-CB 4.41Å; K74-E754 IonicContact NZ-OE2 2.65Å; K74-E754 PolarHBondContact NZ-OE2 3.23Å; K74-V755 HydrophobicContact CB-CG2 4.04Å; K74-V758 HydrophobicContact CD-CG2 4.37Å
75	L	56.7	Low	58.4	Low	17 Å²	17	75.8 Å²	75.8	9%	0.089	39%	0.393	C	S	.	.	H	α-helix	trans	-76.2	-33.8	177.4	-65.7	165.3	0	0	0	111.5	L71 T78 E105 L109 V755	L71-L75 HydrophobicContact CB-CD1 3.93Å; L71-L75 WeakPolarHBondContact O-CB 3.37Å; L71-L75 VanDerWaalsContact O-CD1 3.25Å; L71-L75 WeakPolarHBondContact O-CD1 3.39Å; L71-L75 WeakPolarHBondContact O-CG 3.44Å; L71-L75 PolarHBondContact O-N 3.47Å; L75-T78 VanDerWaalsContact C-OG1 3.28Å; L75-T78 WeakPolarHBondContact CA-OG1 3.22Å; L75-T78 WeakPolarHBondContact O-CB 3.21Å; L75-T78 PolarHBondContact O-N 2.87Å; L75-T78 PolarHBondContact O-OG1 2.5Å; L75-E105 HydrophobicContact CD1-CB 4.13Å; L75-E105 HydrophobicContact CD1-CG 4.4Å; L75-E105 HydrophobicContact CD2-CB 4.11Å; L75-E105 HydrophobicContact CD2-CG 3.69Å; L75-E105 WeakPolarHBondContact CD2-OE2 3.41Å; L75-L109 HydrophobicContact CD1-CD1 4.01Å; L75-L109 HydrophobicContact CD1-CG 4.38Å; L75-V755 HydrophobicContact CD2-CG2 4.43Å
76	C	49.3	Very low	56.3	Low	65 Å²	65	79.2 Å²	79.2	44%	0.439	42%	0.418	S	S	.	.	H	α-helix	trans	-71.9	-32.2	170.6	-96.7	0	0	0	0	113.5	G72 G73 T78 Q79 Y80	G72-C76 VanDerWaalsContact O-CB 3.3Å; G72-C76 WeakPolarHBondContact O-CB 3.49Å; G72-C76 PolarHBondContact O-N 2.94Å; G73-C76 PolarHBondContact O-N 3.37Å; C76-T78 PolarHBondContact O-N 3.38Å; C76-Q79 WeakPolarHBondContact O-CA 3.24Å; C76-Q79 VanDerWaalsContact O-CB 3.29Å; C76-Q79 WeakPolarHBondContact O-CB 3.4Å; C76-Q79 PolarHBondContact O-N 2.84Å; C76-Y80 PolarHBondContact O-N 3.12Å; C76-Y80 VanDerWaalsContact O-N 3.15Å
77	S	48.1	Very low	54.2	Low	52 Å²	52	77.5 Å²	77.5	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-63.7	-24.2	173.4	49.4	0	0	0	0	112.9	G73 K74 Q79	G73-S77 PolarHBondContact O-N 3.22Å; G73-S77 PolarHBondContact O-OG 2.95Å; K74-S77 VanDerWaalsContact C-OG 3.31Å; K74-S77 WeakPolarHBondContact CA-OG 3.33Å; K74-S77 PolarHBondContact O-OG 2.9Å; S77-Q79 PolarHBondContact O-N 3.32Å
78	T	47.7	Very low	52.1	Low	32 Å²	32	81 Å²	81	20%	0.196	44%	0.438	C	S	.	.	H	α-helix	trans	-64.4	-24.6	168.4	-7.3	0	0	0	0	112.6	K74 L75 C76 L82 T751	K74-T78 PolarHBondContact O-OG1 3.5Å; L75-T78 VanDerWaalsContact C-OG1 3.28Å; L75-T78 WeakPolarHBondContact CA-OG1 3.22Å; L75-T78 WeakPolarHBondContact O-CB 3.21Å; L75-T78 PolarHBondContact O-N 2.87Å; L75-T78 PolarHBondContact O-OG1 2.5Å; C76-T78 PolarHBondContact O-N 3.38Å; T78-L82 VanDerWaalsContact O-CD1 3.26Å; T78-L82 WeakPolarHBondContact O-CD1 3.29Å; T78-T751 HydrophobicContact CG2-CG2 4.09Å
79	Q	38.5	Very low	50.2	Low	112 Å²	112	85.5 Å²	85.5	52%	0.523	47%	0.465	S	S	.	.	H	α-helix	trans	-95	-39.2	-172.9	-145.1	172.7	15.2	0	0	112.9	C76 S77	C76-Q79 WeakPolarHBondContact O-CA 3.24Å; C76-Q79 VanDerWaalsContact O-CB 3.29Å; C76-Q79 WeakPolarHBondContact O-CB 3.4Å; C76-Q79 PolarHBondContact O-N 2.84Å; S77-Q79 PolarHBondContact O-N 3.32Å
80	Y	35.6	Very low	48.4	Very low	184 Å²	184	87.4 Å²	87.4	72%	0.722	46%	0.463	S	S	*	.	H	α-helix	trans	-77.9	-21.6	-174.4	-107.7	-88.1	0	0	0	114.9	C76 L82	C76-Y80 PolarHBondContact O-N 3.12Å; C76-Y80 VanDerWaalsContact O-N 3.15Å; Y80-L82 VanDerWaalsContact C-N 3.26Å; Y80-L82 PolarHBondContact O-N 3.43Å
81	Q	39.1	Very low	46.8	Very low	120 Å²	120	86 Å²	86	56%	0.561	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.8	176.7	-78.5	-175.3	-18.7	0	0	114
82	L	38.3	Very low	45.1	Very low	79 Å²	79	89.5 Å²	89.5	41%	0.414	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-8.1	176.4	-95.6	119	0	0	0	114.4	T78 Y80 L95	T78-L82 VanDerWaalsContact O-CD1 3.26Å; T78-L82 WeakPolarHBondContact O-CD1 3.29Å; Y80-L82 VanDerWaalsContact C-N 3.26Å; Y80-L82 PolarHBondContact O-N 3.43Å; L82-L95 HydrophobicContact CD2-CD1 4.25Å
83	F	37.8	Very low	43.5	Very low	172 Å²	172	92.4 Å²	92.4	75%	0.754	50%	0.502	S	S	*	.	S	Bend	trans	-129.3	13.6	-162.8	-74.2	-75.9	0	0	0	116.8
84	T	34.9	Very low	42.2	Very low	112 Å²	112	96.8 Å²	96.8	69%	0.687	51%	0.511	S	S	*	.	S	Bend	trans	-111	11.6	-170.4	49.3	0	0	0	0	117.8
85	E	34.3	Very low	40.9	Very low	136 Å²	136	97.2 Å²	97.2	64%	0.636	52%	0.515	S	S	*	.			trans	-130.7	131.5	168.4	-73	-158.7	169.1	0	0	114.2	S87	E85-S87 PolarHBondContact O-N 3.4Å; E85-S87 VanDerWaalsContact O-N 3.12Å; E85-S87 PolarHBondContact OE2-OG 2.97Å
86	P	43.4	Very low	39.8	Very low	130 Å²	130	104 Å²	104	84%	0.844	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.9	-179.7	-0.7	8.3	0	0	0	115.2
87	S	41	Very low	39	Very low	88 Å²	88	104.5 Å²	104.5	62%	0.615	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-15.6	-178.3	38.1	0	0	0	0	114.2	E85	E85-S87 PolarHBondContact O-N 3.4Å; E85-S87 VanDerWaalsContact O-N 3.12Å; E85-S87 PolarHBondContact OE2-OG 2.97Å
88	H	42.8	Very low	38.4	Very low	73 Å²	73	103.7 Å²	103.7	34%	0.338	55%	0.547	S	S	.	.			trans	-100.7	18.1	-166	-81.1	-85.9	0	0	0	116.8	R90 L91	H88-R90 PolarHBondContact O-N 2.99Å; H88-L91 HydrophobicContact CB-CB 4.46Å; H88-L91 WeakPolarHBondContact O-CB 3.45Å; H88-L91 PolarHBondContact O-N 3.25Å
89	V	44.8	Very low	38	Very low	125 Å²	125	105.6 Å²	105.6	76%	0.758	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-25	-175.5	178.4	0	0	0	0	113.8
90	R	41.7	Very low	37.8	Very low	174 Å²	174	104.7 Å²	104.7	66%	0.657	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-21	174.4	-75.5	-170.3	-174.8	149.9	8.6	114.7	H88 A92 S93 E733	H88-R90 PolarHBondContact O-N 2.99Å; R90-A92 VanDerWaalsContact C-N 3.34Å; R90-S93 PolarHBondContact O-OG 3.42Å; R90-E733 IonicContact NH1-OE1 2.66Å
91	L	40.7	Very low	38.1	Very low	29 Å²	29	97 Å²	97	15%	0.152	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-75.8	-24.8	-177.3	-136.5	82	0	0	0	112.4	H88 S93 H94 L95 E741 E744	H88-L91 HydrophobicContact CB-CB 4.46Å; H88-L91 WeakPolarHBondContact O-CB 3.45Å; H88-L91 PolarHBondContact O-N 3.25Å; L91-S93 VanDerWaalsContact C-N 3.29Å; L91-S93 PolarHBondContact O-N 3.38Å; L91-H94 PolarHBondContact O-N 3.2Å; L91-L95 HydrophobicContact CD2-CD1 3.8Å; L91-L95 HydrophobicContact CG-CD1 4.1Å; L91-E741 HydrophobicContact CD1-CG 4.43Å; L91-E744 WeakPolarHBondContact CD2-OE2 3.31Å
92	A	36.1	Very low	38.5	Very low	72 Å²	72	93.9 Å²	93.9	60%	0.595	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-63.6	-28	-173.1	0	0	0	0	0	114.1	R90	R90-A92 VanDerWaalsContact C-N 3.34Å
93	S	36.7	Very low	39	Very low	79 Å²	79	94.1 Å²	94.1	55%	0.552	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-81.1	-16.3	-177.9	51.8	0	0	0	0	114.6	R90 L91	R90-S93 PolarHBondContact O-OG 3.42Å; L91-S93 VanDerWaalsContact C-N 3.29Å; L91-S93 PolarHBondContact O-N 3.38Å
94	H	35.7	Very low	39.7	Very low	137 Å²	137	88.8 Å²	88.8	63%	0.634	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-14	179.6	-70.7	-44.6	0	0	0	113.7	L91	L91-H94 PolarHBondContact O-N 3.2Å
95	L	35.9	Very low	41.1	Very low	53 Å²	53	84.4 Å²	84.4	28%	0.277	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-94	2.8	-178.1	-82.9	157.7	0	0	0	115	L82 L91 S97 A98	L82-L95 HydrophobicContact CD2-CD1 4.25Å; L91-L95 HydrophobicContact CD2-CD1 3.8Å; L91-L95 HydrophobicContact CG-CD1 4.1Å; L95-S97 PolarHBondContact O-N 3.4Å; L95-A98 HydrophobicContact CD2-CB 4.32Å; L95-A98 VanDerWaalsContact O-CB 3.31Å; L95-A98 WeakPolarHBondContact O-CB 3.46Å; L95-A98 PolarHBondContact O-N 3.36Å
96	E	32.8	Very low	42.7	Very low	159 Å²	159	81.7 Å²	81.7	74%	0.743	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-56.2	-19.1	174.4	-81.7	-174.9	156.5	0	0	113.4	A98 S99	E96-A98 VanDerWaalsContact C-N 3.32Å; E96-A98 PolarHBondContact O-N 3.49Å; E96-S99 WeakPolarHBondContact O-CB 3.48Å; E96-S99 PolarHBondContact O-OG 3.41Å
97	S	32.8	Very low	44.2	Very low	77 Å²	77	78.9 Å²	78.9	54%	0.538	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-80.4	-1.4	173.3	64.4	0	0	0	0	115.4	L95 S99	L95-S97 PolarHBondContact O-N 3.4Å; S97-S99 VanDerWaalsContact C-N 3.34Å
98	A	35.6	Very low	46.1	Very low	35 Å²	35	75.4 Å²	75.4	29%	0.289	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-84	-8.7	171.2	0	0	0	0	0	113.3	L95 E96 T100	L95-A98 HydrophobicContact CD2-CB 4.32Å; L95-A98 VanDerWaalsContact O-CB 3.31Å; L95-A98 WeakPolarHBondContact O-CB 3.46Å; L95-A98 PolarHBondContact O-N 3.36Å; E96-A98 VanDerWaalsContact C-N 3.32Å; E96-A98 PolarHBondContact O-N 3.49Å; A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.45Å
99	S	39.4	Very low	48	Very low	71 Å²	71	73.3 Å²	73.3	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-25.6	-176	55.2	0	0	0	0	114.9	E96 S97 C101 S102	E96-S99 WeakPolarHBondContact O-CB 3.48Å; E96-S99 PolarHBondContact O-OG 3.41Å; S97-S99 VanDerWaalsContact C-N 3.34Å; S99-C101 PolarHBondContact O-N 3.41Å; S99-S102 PolarHBondContact O-N 3.1Å; S99-S102 PolarHBondContact O-OG 3.04Å
100	T	35.1	Very low	49.9	Very low	93 Å²	93	70.1 Å²	70.1	57%	0.571	42%	0.422	S	S	*	.	H	α-helix	trans	-69.4	-29	-173.3	11.4	0	0	0	0	114.5	A98	A98-T100 VanDerWaalsContact C-N 3.29Å; A98-T100 PolarHBondContact O-N 3.45Å
101	C	40.4	Very low	52.1	Low	24 Å²	24	65.1 Å²	65.1	16%	0.162	41%	0.406	C	S	.	.	H	α-helix	trans	-73.1	-42.1	179	-134	0	0	0	0	111.2	S99 S103 V104 E105	S99-C101 PolarHBondContact O-N 3.41Å; C101-S103 VanDerWaalsContact C-N 3.27Å; C101-S103 PolarHBondContact O-N 3.39Å; C101-V104 PolarHBondContact O-N 3.4Å; C101-E105 WeakPolarHBondContact O-CB 3.31Å; C101-E105 VanDerWaalsContact O-CD 3.27Å; C101-E105 WeakPolarHBondContact O-CG 3.26Å; C101-E105 PolarHBondContact O-N 3.04Å; C101-E105 VanDerWaalsContact O-N 3.08Å; C101-E105 PolarHBondContact SG-OE1 3.47Å
102	S	49.3	Very low	54.4	Low	54 Å²	54	63.8 Å²	63.8	38%	0.378	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-33.8	-176.9	71.7	0	0	0	0	114	S99 S106	S99-S102 PolarHBondContact O-N 3.1Å; S99-S102 PolarHBondContact O-OG 3.04Å; S102-S106 PolarHBondContact O-N 3.23Å; S102-S106 PolarHBondContact O-OG 3.49Å
103	S	48.2	Very low	56.9	Low	83 Å²	83	65.1 Å²	65.1	58%	0.58	39%	0.393	S	S	*	.	H	α-helix	trans	-74.7	-37.3	-179.6	174.9	0	0	0	0	112.8	C101	C101-S103 VanDerWaalsContact C-N 3.27Å; C101-S103 PolarHBondContact O-N 3.39Å
104	V	52.7	Low	59.5	Low	60 Å²	60	65 Å²	65	36%	0.364	39%	0.392	S	S	.	.	H	α-helix	trans	-77	-35.1	-179	179.8	0	0	0	0	110.2	C101 S107 V108	C101-V104 PolarHBondContact O-N 3.4Å; V104-S107 PolarHBondContact O-N 3.12Å; V104-S107 PolarHBondContact O-OG 2.95Å; V104-V108 WeakPolarHBondContact O-CG2 3.12Å; V104-V108 PolarHBondContact O-N 2.96Å
105	E	64.2	Low	62.2	Low	21 Å²	21	61.1 Å²	61.1	10%	0.098	37%	0.372	C	S	.	.	H	α-helix	trans	-68.9	-40.9	179.8	-72.1	164.7	175.3	0	0	112.4	L75 C101 S107 V108 L109	L75-E105 HydrophobicContact CD1-CB 4.13Å; L75-E105 HydrophobicContact CD1-CG 4.4Å; L75-E105 HydrophobicContact CD2-CB 4.11Å; L75-E105 HydrophobicContact CD2-CG 3.69Å; L75-E105 WeakPolarHBondContact CD2-OE2 3.41Å; C101-E105 WeakPolarHBondContact O-CB 3.31Å; C101-E105 VanDerWaalsContact O-CD 3.27Å; C101-E105 WeakPolarHBondContact O-CG 3.26Å; C101-E105 PolarHBondContact O-N 3.04Å; C101-E105 VanDerWaalsContact O-N 3.08Å; C101-E105 PolarHBondContact SG-OE1 3.47Å; E105-S107 PolarHBondContact O-N 3.34Å; E105-V108 PolarHBondContact O-N 3.45Å; E105-L109 PolarHBondContact O-N 3.34Å
106	S	66.9	Low	64.8	Low	78 Å²	78	62 Å²	62	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-67.5	-34.7	177.5	-59.7	0	0	0	0	112.4	S102 A110	S102-S106 PolarHBondContact O-N 3.23Å; S102-S106 PolarHBondContact O-OG 3.49Å; S106-A110 WeakPolarHBondContact O-CB 3.46Å; S106-A110 PolarHBondContact O-N 2.99Å; S106-A110 VanDerWaalsContact O-N 3.11Å
107	S	75.9	Confident	67.5	Low	71 Å²	71	58 Å²	58	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-71.2	-36.3	178.3	89.2	0	0	0	0	112.1	V104 E105 A110 H111	V104-S107 PolarHBondContact O-N 3.12Å; V104-S107 PolarHBondContact O-OG 2.95Å; E105-S107 PolarHBondContact O-N 3.34Å; S107-A110 PolarHBondContact O-N 3.34Å; S107-H111 VanDerWaalsContact O-CB 3.3Å; S107-H111 WeakPolarHBondContact O-CB 2.96Å; S107-H111 PolarHBondContact O-N 2.99Å
108	V	80.8	Confident	70.2	Confident	16 Å²	16	55.7 Å²	55.7	10%	0.097	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-46.1	175.5	166.3	0	0	0	0	111.1	V104 E105 H111 V112 T408 L412	V104-V108 WeakPolarHBondContact O-CG2 3.12Å; V104-V108 PolarHBondContact O-N 2.96Å; E105-V108 PolarHBondContact O-N 3.45Å; V108-H111 PolarHBondContact O-N 2.82Å; V108-V112 WeakPolarHBondContact O-CG2 3.49Å; V108-V112 PolarHBondContact O-N 3.25Å; V108-T408 HydrophobicContact CB-CG2 4.26Å; V108-T408 HydrophobicContact CG1-CG2 3.65Å; V108-T408 HydrophobicContact CG2-CG2 4.08Å; V108-L412 HydrophobicContact CG1-CD2 4.2Å
109	L	81.7	Confident	73	Confident	28 Å²	28	54 Å²	54	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-45.5	179	-68.7	174.8	0	0	0	111.7	L71 L75 E105 H111 V112 E113	L71-L109 HydrophobicContact CB-CD2 3.81Å; L75-L109 HydrophobicContact CD1-CD1 4.01Å; L75-L109 HydrophobicContact CD1-CG 4.38Å; E105-L109 PolarHBondContact O-N 3.34Å; L109-H111 VanDerWaalsContact C-N 3.3Å; L109-H111 PolarHBondContact O-N 2.86Å; L109-V112 PolarHBondContact O-N 3.19Å; L109-E113 VanDerWaalsContact O-CB 3.26Å; L109-E113 WeakPolarHBondContact O-CB 3.38Å; L109-E113 PolarHBondContact O-N 2.92Å
110	A	84.7	Confident	75.4	Confident	58 Å²	58	52.7 Å²	52.7	48%	0.479	33%	0.332	S	S	.	.	H	α-helix	trans	-61.5	-39.2	177.3	0	0	0	0	0	112.1	S106 S107 E113 S114	S106-A110 WeakPolarHBondContact O-CB 3.46Å; S106-A110 PolarHBondContact O-N 2.99Å; S106-A110 VanDerWaalsContact O-N 3.11Å; S107-A110 PolarHBondContact O-N 3.34Å; A110-E113 PolarHBondContact O-N 3.5Å; A110-S114 PolarHBondContact O-N 3.4Å
111	H	88.3	Confident	78.1	Confident	70 Å²	70	54 Å²	54	32%	0.324	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-48.2	177.1	-172.2	66.2	0	0	0	111.8	S107 V108 L109 E113 S114 Y115 D404	S107-H111 VanDerWaalsContact O-CB 3.3Å; S107-H111 WeakPolarHBondContact O-CB 2.96Å; S107-H111 PolarHBondContact O-N 2.99Å; V108-H111 PolarHBondContact O-N 2.82Å; L109-H111 VanDerWaalsContact C-N 3.3Å; L109-H111 PolarHBondContact O-N 2.86Å; H111-E113 PolarHBondContact O-N 3.43Å; H111-S114 WeakPolarHBondContact O-CB 3.48Å; H111-S114 PolarHBondContact O-N 3.19Å; H111-S114 PolarHBondContact O-OG 2.93Å; H111-Y115 AromaticContact NE2-CE2 3.77Å; H111-D404 IonicContact CD2-OD2 3.84Å; H111-D404 IonicContact CE1-OD2 3.79Å; H111-D404 IonicContact NE2-OD1 3.51Å; H111-D404 IonicContact NE2-OD2 2.97Å; H111-D404 PolarHBondContact NE2-OD2 3.37Å
112	V	89.5	Confident	80.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65	-40.4	177.4	175	0	0	0	0	111.6	I64 I67 V68 V108 L109 S114 Y115 I405 T408	I64-V112 HydrophobicContact CG2-CG1 4.1Å; I67-V112 HydrophobicContact CB-CG1 4.36Å; I67-V112 HydrophobicContact CG2-CG1 3.99Å; V68-V112 HydrophobicContact CG2-CG1 4.33Å; V108-V112 WeakPolarHBondContact O-CG2 3.49Å; V108-V112 PolarHBondContact O-N 3.25Å; L109-V112 PolarHBondContact O-N 3.19Å; V112-S114 VanDerWaalsContact C-N 3.27Å; V112-S114 PolarHBondContact O-N 3.26Å; V112-Y115 PolarHBondContact O-N 2.99Å; V112-I405 HydrophobicContact CG1-CD1 4.47Å; V112-I405 HydrophobicContact CG1-CG2 4.33Å; V112-I405 HydrophobicContact CG2-CG2 4.16Å; V112-T408 HydrophobicContact CG2-CG2 4.32Å
113	E	88.5	Confident	82.5	Confident	101 Å²	101	52.2 Å²	52.2	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-65.4	-30.3	178	-172.6	167.7	-152.7	0	0	112.4	V68 L109 A110 H111 Y115 K116	V68-E113 HydrophobicContact CG2-CB 4.12Å; L109-E113 VanDerWaalsContact O-CB 3.26Å; L109-E113 WeakPolarHBondContact O-CB 3.38Å; L109-E113 PolarHBondContact O-N 2.92Å; A110-E113 PolarHBondContact O-N 3.5Å; H111-E113 PolarHBondContact O-N 3.43Å; E113-Y115 PolarHBondContact O-N 3.34Å; E113-Y115 VanDerWaalsContact O-N 3.14Å; E113-K116 WeakPolarHBondContact O-CB 3.28Å; E113-K116 PolarHBondContact O-N 2.88Å
114	S	91.5	Very high	84.4	Confident	76 Å²	76	49.5 Å²	49.5	53%	0.531	30%	0.301	S	S	.	.	H	α-helix	trans	-57.9	-30.3	177.6	81.8	0	0	0	0	113.3	A110 H111 V112 K116	A110-S114 PolarHBondContact O-N 3.4Å; H111-S114 WeakPolarHBondContact O-CB 3.48Å; H111-S114 PolarHBondContact O-N 3.19Å; H111-S114 PolarHBondContact O-OG 2.93Å; V112-S114 VanDerWaalsContact C-N 3.27Å; V112-S114 PolarHBondContact O-N 3.26Å; S114-K116 VanDerWaalsContact C-N 3.31Å; S114-K116 PolarHBondContact O-N 3.08Å
115	Y	92.5	Very high	86.2	Confident	55 Å²	55	50.6 Å²	50.6	22%	0.216	30%	0.303	C	S	.	.	H	α-helix	trans	-74.1	-20.1	177.6	-72.4	-68	0	0	0	113.7	H111 V112 E113 A117 G118 V119 I401 D404 I405	H111-Y115 AromaticContact NE2-CE2 3.77Å; V112-Y115 PolarHBondContact O-N 2.99Å; E113-Y115 PolarHBondContact O-N 3.34Å; E113-Y115 VanDerWaalsContact O-N 3.14Å; Y115-A117 PolarHBondContact O-N 3.35Å; Y115-G118 PolarHBondContact O-N 3.2Å; Y115-V119 WeakPolarHBondContact O-CG2 3.28Å; Y115-V119 PolarHBondContact O-N 3.3Å; Y115-I401 HydrophobicContact CD1-CB 4.45Å; Y115-I401 HydrophobicContact CD1-CD1 4.31Å; Y115-I401 HydrophobicContact CD1-CG1 3.76Å; Y115-I401 HydrophobicContact CD1-CG2 4.11Å; Y115-I401 HydrophobicContact CE1-CG1 4Å; Y115-I401 HydrophobicContact CG-CG2 4.08Å; Y115-D404 VanDerWaalsContact CE2-OD2 3.26Å; Y115-D404 WeakPolarHBondContact CE2-OD2 3.37Å; Y115-D404 PolarHBondContact OH-OD2 2.95Å; Y115-I405 HydrophobicContact CD2-CD1 4.32Å; Y115-I405 HydrophobicContact CD2-CG1 4.1Å; Y115-I405 HydrophobicContact CE2-CG1 4.43Å
116	K	90.1	Very high	87.4	Confident	73 Å²	73	49.6 Å²	49.6	32%	0.317	30%	0.299	S	S	.	.	H	α-helix	trans	-56.7	-52.1	-174.5	-175.9	171.1	175.8	166.4	0	111.6	I64 D65 E113 S114 G118 V119 S120	I64-K116 HydrophobicContact CG2-CB 4.21Å; D65-K116 WeakPolarHBondContact OD1-CE 3.31Å; D65-K116 IonicContact OD1-NZ 2.9Å; D65-K116 PolarHBondContact OD1-NZ 2.92Å; E113-K116 WeakPolarHBondContact O-CB 3.28Å; E113-K116 PolarHBondContact O-N 2.88Å; S114-K116 VanDerWaalsContact C-N 3.31Å; S114-K116 PolarHBondContact O-N 3.08Å; K116-G118 VanDerWaalsContact C-N 3.3Å; K116-G118 PolarHBondContact O-N 2.93Å; K116-V119 PolarHBondContact O-N 2.78Å; K116-S120 PolarHBondContact O-N 3.33Å; K116-S120 PolarHBondContact O-OG 2.6Å
117	A	88.6	Confident	88.4	Confident	74 Å²	74	48.8 Å²	48.8	61%	0.612	29%	0.293	S	S	*	.	H	α-helix	trans	-59.5	-41.2	179.8	0	0	0	0	0	112.3	Y115 Q121	Y115-A117 PolarHBondContact O-N 3.35Å; A117-Q121 WeakPolarHBondContact O-CB 3.35Å; A117-Q121 PolarHBondContact O-N 3.25Å
118	G	90.4	Very high	88.8	Confident	28 Å²	28	54.9 Å²	54.9	29%	0.289	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-42.5	177.7	0	0	0	0	0	113	Y115 K116 Q121 I122	Y115-G118 PolarHBondContact O-N 3.2Å; K116-G118 VanDerWaalsContact C-N 3.3Å; K116-G118 PolarHBondContact O-N 2.93Å; G118-Q121 PolarHBondContact O-N 3.46Å; G118-I122 VanDerWaalsContact O-CG1 3.31Å; G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.9Å
119	V	93.5	Very high	89.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-45.2	177	172.1	0	0	0	0	110.9	Y57 I60 E61 I64 Y115 K116 Q121 I122 N123 I401	Y57-V119 HydrophobicContact CD1-CG1 3.97Å; I60-V119 HydrophobicContact CB-CG1 4.47Å; I60-V119 HydrophobicContact CG2-CG1 4.15Å; I60-V119 HydrophobicContact CG2-CG2 4.05Å; E61-V119 HydrophobicContact CB-CG1 3.82Å; E61-V119 HydrophobicContact CG-CG1 4.47Å; I64-V119 HydrophobicContact CD1-CG2 3.93Å; Y115-V119 WeakPolarHBondContact O-CG2 3.28Å; Y115-V119 PolarHBondContact O-N 3.3Å; K116-V119 PolarHBondContact O-N 2.78Å; V119-Q121 VanDerWaalsContact C-N 3.32Å; V119-Q121 PolarHBondContact O-N 2.86Å; V119-I122 PolarHBondContact O-N 3.44Å; V119-N123 WeakPolarHBondContact O-CB 3.31Å; V119-N123 PolarHBondContact O-N 3.42Å; V119-I401 HydrophobicContact CG2-CD1 3.89Å; V119-I401 HydrophobicContact CG2-CG2 4.36Å
120	S	91.3	Very high	89.7	Confident	43 Å²	43	56.5 Å²	56.5	30%	0.301	31%	0.312	S	S	.	.	H	α-helix	trans	-63	-38.8	176.6	-50.3	0	0	0	0	111.6	E61 K116 N123 G124	E61-S120 PolarHBondContact OE1-OG 3.15Å; K116-S120 PolarHBondContact O-N 3.33Å; K116-S120 PolarHBondContact O-OG 2.6Å; S120-N123 PolarHBondContact O-N 3.28Å; S120-G124 PolarHBondContact O-N 2.73Å
121	Q	91.3	Very high	90.2	Very high	122 Å²	122	53.8 Å²	53.8	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-63.7	-45.8	175.8	-174.3	-178.2	14.9	0	0	111.7	A117 G118 V119 N123 G124 M125	A117-Q121 WeakPolarHBondContact O-CB 3.35Å; A117-Q121 PolarHBondContact O-N 3.25Å; G118-Q121 PolarHBondContact O-N 3.46Å; V119-Q121 VanDerWaalsContact C-N 3.32Å; V119-Q121 PolarHBondContact O-N 2.86Å; Q121-N123 VanDerWaalsContact C-N 3.35Å; Q121-G124 CarbonylContact O-C 3.55Å; Q121-G124 WeakPolarHBondContact O-CA 3.44Å; Q121-G124 PolarHBondContact O-N 2.73Å; Q121-G124 VanDerWaalsContact O-N 3.16Å; Q121-M125 HydrophobicContact CG-CE 3.87Å; Q121-M125 HydrophobicContact CG-SD 4.46Å; Q121-M125 WeakPolarHBondContact O-CG 3.38Å; Q121-M125 PolarHBondContact O-N 3.42Å
122	I	91.8	Very high	90.6	Very high	15 Å²	15	50.8 Å²	50.8	8%	0.077	28%	0.276	C	S	.	.	H	α-helix	trans	-62.5	-44	177.1	-67.6	165.1	0	0	0	110.4	Y57 G118 V119 G124 M125 L126 H394 K397	Y57-I122 HydrophobicContact CD1-CB 4.15Å; Y57-I122 HydrophobicContact CD1-CG2 3.85Å; Y57-I122 HydrophobicContact CD2-CG2 4.41Å; Y57-I122 HydrophobicContact CE1-CB 3.77Å; Y57-I122 HydrophobicContact CE1-CD1 3.83Å; Y57-I122 HydrophobicContact CE1-CG1 4.41Å; Y57-I122 HydrophobicContact CE1-CG2 3.41Å; Y57-I122 VanDerWaalsContact CE1-CG2 3.41Å; Y57-I122 HydrophobicContact CE2-CG2 4Å; Y57-I122 HydrophobicContact CG-CG2 4.33Å; Y57-I122 VanDerWaalsContact CZ-CG2 3.48Å; G118-I122 VanDerWaalsContact O-CG1 3.31Å; G118-I122 WeakPolarHBondContact O-CG1 3.48Å; G118-I122 PolarHBondContact O-N 2.9Å; V119-I122 PolarHBondContact O-N 3.44Å; I122-G124 PolarHBondContact O-N 3.36Å; I122-M125 WeakPolarHBondContact O-CB 3.16Å; I122-M125 PolarHBondContact O-N 3.07Å; I122-M125 VanDerWaalsContact O-N 3.12Å; I122-L126 HydrophobicContact CG2-CD1 3.89Å; I122-L126 HydrophobicContact CG2-CG 4.17Å; I122-L126 WeakPolarHBondContact O-CB 3.48Å; I122-L126 VanDerWaalsContact O-CG 3.31Å; I122-L126 WeakPolarHBondContact O-CG 3.42Å; I122-L126 PolarHBondContact O-N 2.95Å; I122-H394 HydrophobicContact CG2-CB 4.21Å; I122-H394 WeakPolarHBondContact CG2-ND1 3.35Å; I122-K397 HydrophobicContact CD1-CB 4.45Å; I122-K397 HydrophobicContact CD1-CD 4.32Å
123	N	90.2	Very high	91	Very high	25 Å²	25	50.8 Å²	50.8	13%	0.134	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-38	175.5	-167.9	26.9	0	0	0	111.6	V119 S120 Q121 S127	V119-N123 WeakPolarHBondContact O-CB 3.31Å; V119-N123 PolarHBondContact O-N 3.42Å; S120-N123 PolarHBondContact O-N 3.28Å; Q121-N123 VanDerWaalsContact C-N 3.35Å; N123-S127 PolarHBondContact O-N 3.48Å; N123-S127 VanDerWaalsContact O-N 3.07Å
124	G	87.9	Confident	91.3	Very high	25 Å²	25	46 Å²	46	26%	0.258	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-43.5	171.9	0	0	0	0	0	113.4	S120 Q121 I122 S127 R128	S120-G124 PolarHBondContact O-N 2.73Å; Q121-G124 CarbonylContact O-C 3.55Å; Q121-G124 WeakPolarHBondContact O-CA 3.44Å; Q121-G124 PolarHBondContact O-N 2.73Å; Q121-G124 VanDerWaalsContact O-N 3.16Å; I122-G124 PolarHBondContact O-N 3.36Å; G124-S127 PolarHBondContact O-N 2.99Å; G124-S127 PolarHBondContact O-OG 2.86Å; G124-R128 PolarHBondContact O-N 3.35Å
125	M	89.7	Confident	91.5	Very high	83 Å²	83	42.4 Å²	42.4	41%	0.409	23%	0.228	S	C	.	.	H	α-helix	trans	-62.1	-51.2	174.9	-70	170.7	173.2	0	0	111.1	Q121 I122 S127 R128 D129	Q121-M125 HydrophobicContact CG-CE 3.87Å; Q121-M125 HydrophobicContact CG-SD 4.46Å; Q121-M125 WeakPolarHBondContact O-CG 3.38Å; Q121-M125 PolarHBondContact O-N 3.42Å; I122-M125 WeakPolarHBondContact O-CB 3.16Å; I122-M125 PolarHBondContact O-N 3.07Å; I122-M125 VanDerWaalsContact O-N 3.12Å; M125-S127 PolarHBondContact O-N 3.33Å; M125-S127 VanDerWaalsContact O-N 3.09Å; M125-R128 PolarHBondContact O-N 3.5Å; M125-D129 PolarHBondContact O-N 3.09Å
126	L	90.6	Very high	91.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-27.5	177.5	-70.3	172	0	0	0	112.8	K50 I53 Q54 Y57 I122 F391	K50-L126 WeakPolarHBondContact CE-O 3.31Å; I53-L126 HydrophobicContact CG1-CD1 4.15Å; I53-L126 HydrophobicContact CG2-CD1 4.15Å; I53-L126 HydrophobicContact CG2-CD2 3.91Å; Q54-L126 HydrophobicContact CG-CB 3.85Å; Q54-L126 PolarHBondContact NE2-O 3.36Å; Y57-L126 HydrophobicContact CD2-CD1 3.73Å; Y57-L126 HydrophobicContact CE2-CD1 4.18Å; Y57-L126 HydrophobicContact CG-CD1 4.12Å; I122-L126 HydrophobicContact CG2-CD1 3.89Å; I122-L126 HydrophobicContact CG2-CG 4.17Å; I122-L126 WeakPolarHBondContact O-CB 3.48Å; I122-L126 VanDerWaalsContact O-CG 3.31Å; I122-L126 WeakPolarHBondContact O-CG 3.42Å; I122-L126 PolarHBondContact O-N 2.95Å; L126-F391 HydrophobicContact CD2-CD1 3.6Å; L126-F391 HydrophobicContact CD2-CE1 3.76Å
127	S	87.3	Confident	91.7	Very high	61 Å²	61	36.3 Å²	36.3	43%	0.427	20%	0.202	S	C	.	.	H	α-helix	trans	-70.6	-33.8	175.8	77.3	0	0	0	0	113.1	K50 Q54 N123 G124 M125	K50-S127 PolarHBondContact NZ-O 2.9Å; K50-S127 VanDerWaalsContact NZ-O 3.12Å; Q54-S127 VanDerWaalsContact NE2-CA 3.34Å; N123-S127 PolarHBondContact O-N 3.48Å; N123-S127 VanDerWaalsContact O-N 3.07Å; G124-S127 PolarHBondContact O-N 2.99Å; G124-S127 PolarHBondContact O-OG 2.86Å; M125-S127 PolarHBondContact O-N 3.33Å; M125-S127 VanDerWaalsContact O-N 3.09Å
128	R	84.7	Confident	91.8	Very high	200 Å²	200	37.6 Å²	37.6	76%	0.755	19%	0.192	S	C	*	.	H	α-helix	trans	-88.5	-23.4	-176	-63.7	173.4	-175.3	176.1	0.5	112.9	G124 M125 H130	G124-R128 PolarHBondContact O-N 3.35Å; M125-R128 PolarHBondContact O-N 3.5Å; R128-H130 PolarHBondContact O-N 3.33Å; R128-H130 PolarHBondContact O-ND1 2.96Å
129	D	87.2	Confident	91.7	Very high	34 Å²	34	38.1 Å²	38.1	18%	0.182	19%	0.189	C	C	.	.			trans	-56.8	130.2	179.4	-80.4	-32	0	0	0	112.2	K50 M125 K390	K50-D129 WeakPolarHBondContact CE-O 3.48Å; K50-D129 PolarHBondContact NZ-O 3.39Å; M125-D129 PolarHBondContact O-N 3.09Å; D129-K390 HydrophobicContact CB-CD 4.11Å
130	H	93.5	Very high	91.4	Very high	44 Å²	44	42.8 Å²	42.8	20%	0.204	22%	0.222	C	C	.	.			trans	-143.2	159	179.1	53.2	-93.2	0	0	0	108.7	R128 E227 V229 K390	R128-H130 PolarHBondContact O-N 3.33Å; R128-H130 PolarHBondContact O-ND1 2.96Å; H130-E227 HydrophobicContact CB-CB 4.39Å; H130-E227 WeakPolarHBondContact CB-O 3.31Å; H130-V229 HydrophobicContact CB-CG2 4.1Å; H130-V229 WeakPolarHBondContact CD2-CG2 3.45Å; H130-K390 WeakPolarHBondContact O-CE 3.46Å; H130-K390 PolarHBondContact O-NZ 3.29Å
131	M	96.3	Very high	91.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.5	172.8	-76.5	173.3	-70.1	0	0	109.4	L43 F46 N226 E227 V228 V229 D254 I382 A386	L43-M131 HydrophobicContact CB-CE 4.24Å; L43-M131 HydrophobicContact CD2-CE 3.96Å; L43-M131 HydrophobicContact CD2-SD 3.89Å; F46-M131 HydrophobicContact CB-CE 3.83Å; F46-M131 HydrophobicContact CB-SD 3.79Å; F46-M131 HydrophobicContact CD1-CE 3.6Å; F46-M131 HydrophobicContact CD1-CG 4.01Å; F46-M131 HydrophobicContact CD1-SD 4.12Å; F46-M131 HydrophobicContact CD2-CG 4.06Å; F46-M131 HydrophobicContact CD2-SD 4.35Å; F46-M131 HydrophobicContact CE1-CE 4.41Å; F46-M131 HydrophobicContact CE1-CG 4.22Å; F46-M131 HydrophobicContact CE2-CG 4.28Å; F46-M131 HydrophobicContact CG-CE 3.85Å; F46-M131 HydrophobicContact CG-CG 3.93Å; F46-M131 HydrophobicContact CG-SD 3.82Å; F46-M131 HydrophobicContact CZ-CG 4.35Å; M131-N226 WeakPolarHBondContact CE-O 3.46Å; M131-E227 PolarHBondContact N-O 3.26Å; M131-V228 HydrophobicContact CB-CG2 4.19Å; M131-V228 HydrophobicContact CE-CG2 3.77Å; M131-V228 CarbonylContact O-C 3.5Å; M131-V228 WeakPolarHBondContact O-CA 3.3Å; M131-V228 HydrophobicContact SD-CG2 4.42Å; M131-V229 PolarHBondContact O-N 3.45Å; M131-D254 WeakPolarHBondContact CA-OD2 3.28Å; M131-I382 HydrophobicContact CB-CD1 3.87Å; M131-I382 HydrophobicContact CB-CG1 3.96Å; M131-I382 HydrophobicContact CG-CG1 4.24Å; M131-I382 HydrophobicContact SD-CG1 4.48Å; M131-I382 HydrophobicContact SD-CG2 4.09Å; M131-A386 HydrophobicContact CG-CB 3.51Å
132	K	96	Very high	91.5	Very high	8 Å²	8	36.2 Å²	36.2	4%	0.035	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.7	-178	-171.9	178.7	-173.9	-180	0	111.8	V231 H249 D252 D254 V255	K132-V231 HydrophobicContact CG-CG2 4.32Å; K132-H249 WeakPolarHBondContact CE-O 3.49Å; K132-H249 PolarHBondContact NZ-O 3.48Å; K132-D252 WeakPolarHBondContact CD-OD2 3.36Å; K132-D252 IonicContact NZ-OD1 3.72Å; K132-D252 PolarHBondContact NZ-OD1 3.34Å; K132-D252 IonicContact NZ-OD2 2.93Å; K132-D252 PolarHBondContact NZ-OD2 3.5Å; K132-D254 PolarHBondContact N-OD2 2.95Å; K132-D254 PolarHBondContact O-N 3.1Å; K132-V255 PolarHBondContact O-N 3.01Å
133	V	97.3	Very high	91.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.8	171.7	56.3	0	0	0	0	110.7	F135 V228 V229 L230 V231 V255 V257 F378 I382	V133-F135 HydrophobicContact CB-CE2 4.4Å; V133-F135 HydrophobicContact CG1-CE2 3.73Å; V133-F135 HydrophobicContact CG1-CZ 4.21Å; V133-F135 HydrophobicContact CG2-CD2 4.38Å; V133-F135 HydrophobicContact CG2-CE2 3.82Å; V133-F135 HydrophobicContact CG2-CZ 3.97Å; V133-V228 HydrophobicContact CG1-CG1 4.19Å; V133-V229 WeakPolarHBondContact CG1-O 2.95Å; V133-V229 PolarHBondContact N-O 3Å; V133-L230 HydrophobicContact CG1-CB 4.24Å; V133-L230 HydrophobicContact CG1-CD2 4.44Å; V133-L230 HydrophobicContact CG1-CG 3.88Å; V133-V231 PolarHBondContact O-N 3.28Å; V133-V255 VanDerWaalsContact CA-O 3.29Å; V133-V255 WeakPolarHBondContact CA-O 3.43Å; V133-V255 HydrophobicContact CG2-CB 4.33Å; V133-V255 HydrophobicContact CG2-CG1 4.25Å; V133-V257 HydrophobicContact CG2-CG2 3.68Å; V133-F378 HydrophobicContact CB-CE2 3.79Å; V133-F378 HydrophobicContact CB-CZ 3.95Å; V133-F378 HydrophobicContact CG1-CE2 4.13Å; V133-F378 HydrophobicContact CG1-CZ 3.81Å; V133-F378 HydrophobicContact CG2-CE2 3.67Å; V133-F378 HydrophobicContact CG2-CZ 4.22Å; V133-I382 HydrophobicContact CB-CD1 4.04Å; V133-I382 HydrophobicContact CG1-CD1 4.47Å
134	V	96.4	Very high	91.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.3	177.4	-166.2	0	0	0	0	110.6	F136 V231 A253 V255 F256 V257	V134-F136 HydrophobicContact CB-CD2 4.41Å; V134-F136 HydrophobicContact CB-CE2 3.84Å; V134-F136 HydrophobicContact CG1-CD2 3.92Å; V134-F136 HydrophobicContact CG1-CE2 3.19Å; V134-F136 HydrophobicContact CG1-CZ 3.53Å; V134-V231 WeakPolarHBondContact CA-O 3.48Å; V134-V231 HydrophobicContact CB-CB 4.35Å; V134-V231 HydrophobicContact CG1-CB 4.04Å; V134-V231 HydrophobicContact CG1-CG1 4.06Å; V134-V231 HydrophobicContact CG2-CB 4.11Å; V134-V231 HydrophobicContact CG2-CG2 4.41Å; V134-A253 HydrophobicContact CG2-CB 3.68Å; V134-V255 PolarHBondContact N-O 3.49Å; V134-F256 HydrophobicContact CB-CD1 4.24Å; V134-F256 HydrophobicContact CB-CE1 4.4Å; V134-F256 WeakPolarHBondContact O-CA 3.37Å; V134-V257 PolarHBondContact O-N 2.97Å
135	F	95.9	Very high	92	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	123	-179.4	-64.1	-96.7	0	0	0	110.2	V133 V146 V147 M150 L230 V231 S233 V257 V259	V133-F135 HydrophobicContact CB-CE2 4.4Å; V133-F135 HydrophobicContact CG1-CE2 3.73Å; V133-F135 HydrophobicContact CG1-CZ 4.21Å; V133-F135 HydrophobicContact CG2-CD2 4.38Å; V133-F135 HydrophobicContact CG2-CE2 3.82Å; V133-F135 HydrophobicContact CG2-CZ 3.97Å; F135-V146 HydrophobicContact CD1-CG1 4.15Å; F135-V146 HydrophobicContact CE1-CG1 3.75Å; F135-V147 HydrophobicContact CD1-CG2 4.21Å; F135-V147 HydrophobicContact CD2-CG2 3.55Å; F135-V147 HydrophobicContact CE1-CG2 4.34Å; F135-V147 HydrophobicContact CE2-CG2 3.71Å; F135-V147 HydrophobicContact CG-CG2 3.84Å; F135-V147 HydrophobicContact CZ-CG2 4.11Å; F135-M150 HydrophobicContact CE1-SD 3.79Å; F135-M150 HydrophobicContact CZ-CE 4.34Å; F135-M150 HydrophobicContact CZ-SD 3.52Å; F135-M150 VanDerWaalsContact CZ-SD 3.52Å; F135-L230 HydrophobicContact CE2-CB 4.12Å; F135-L230 HydrophobicContact CE2-CD2 4.04Å; F135-L230 HydrophobicContact CE2-CG 4.39Å; F135-L230 HydrophobicContact CZ-CD2 4.26Å; F135-V231 WeakPolarHBondContact CD2-O 3.43Å; F135-V231 PolarHBondContact N-O 3.21Å; F135-S233 WeakPolarHBondContact O-CB 3.31Å; F135-S233 PolarHBondContact O-N 3.32Å; F135-S233 VanDerWaalsContact O-N 3.15Å; F135-S233 PolarHBondContact O-OG 3.37Å; F135-V257 CarbonylContact C-O 3.59Å; F135-V257 WeakPolarHBondContact CA-O 3.49Å; F135-V257 HydrophobicContact CD1-CB 3.58Å; F135-V257 HydrophobicContact CD1-CG1 3.76Å; F135-V257 HydrophobicContact CD1-CG2 4.16Å; F135-V257 HydrophobicContact CE1-CB 3.76Å; F135-V257 HydrophobicContact CE1-CG1 3.85Å; F135-V257 HydrophobicContact CE1-CG2 3.83Å; F135-V257 HydrophobicContact CG-CB 4.31Å; F135-V257 HydrophobicContact CZ-CG2 4.31Å; F135-V259 HydrophobicContact CD1-CG2 4.31Å
136	F	93.8	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	160.5	177.6	-74.5	-75.8	0	0	0	111.7	V134 F167 S233 I236 W245 C250 F256 V257 L258 V259 F273 F274	V134-F136 HydrophobicContact CB-CD2 4.41Å; V134-F136 HydrophobicContact CB-CE2 3.84Å; V134-F136 HydrophobicContact CG1-CD2 3.92Å; V134-F136 HydrophobicContact CG1-CE2 3.19Å; V134-F136 HydrophobicContact CG1-CZ 3.53Å; F136-F167 HydrophobicContact CE1-CE1 4.19Å; F136-F167 HydrophobicContact CE1-CZ 4.32Å; F136-F167 HydrophobicContact CZ-CE1 4.18Å; F136-S233 WeakPolarHBondContact CD1-OG 3.43Å; F136-S233 VanDerWaalsContact CE1-CB 3.43Å; F136-I236 HydrophobicContact CB-CG2 4.46Å; F136-I236 HydrophobicContact CD1-CG2 4.18Å; F136-W245 HydrophobicContact CE1-CE3 4.21Å; F136-C250 VanDerWaalsContact CZ-SG 3.54Å; F136-F256 HydrophobicContact CD2-CD1 4.05Å; F136-F256 AromaticContact CE2-CD1 3.85Å; F136-F256 HydrophobicContact CE2-CD1 3.85Å; F136-F256 HydrophobicContact CE2-CE1 4.04Å; F136-V257 PolarHBondContact N-O 3.48Å; F136-L258 CarbonylContact O-C 3.49Å; F136-L258 WeakPolarHBondContact O-CA 3.29Å; F136-V259 PolarHBondContact O-N 2.98Å; F136-F273 HydrophobicContact CB-CD1 4.44Å; F136-F273 HydrophobicContact CB-CE1 4.12Å; F136-F273 HydrophobicContact CD1-CD1 4.35Å; F136-F273 AromaticContact CD1-CE1 3.61Å; F136-F273 HydrophobicContact CD1-CE1 3.61Å; F136-F273 HydrophobicContact CD1-CE2 4.11Å; F136-F273 AromaticContact CD1-CZ 3.49Å; F136-F273 HydrophobicContact CD1-CZ 3.49Å; F136-F273 VanDerWaalsContact CD1-CZ 3.49Å; F136-F273 AromaticContact CD2-CE1 3.48Å; F136-F273 HydrophobicContact CD2-CE1 3.48Å; F136-F273 VanDerWaalsContact CD2-CE1 3.48Å; F136-F273 AromaticContact CD2-CZ 3.84Å; F136-F273 HydrophobicContact CD2-CZ 3.84Å; F136-F273 AromaticContact CE1-CE1 3.85Å; F136-F273 HydrophobicContact CE1-CE1 3.85Å; F136-F273 AromaticContact CE1-CE2 3.85Å; F136-F273 HydrophobicContact CE1-CE2 3.85Å; F136-F273 AromaticContact CE1-CZ 3.25Å; F136-F273 HydrophobicContact CE1-CZ 3.25Å; F136-F273 AromaticContact CE2-CE1 3.69Å; F136-F273 HydrophobicContact CE2-CE1 3.69Å; F136-F273 AromaticContact CE2-CZ 3.59Å; F136-F273 HydrophobicContact CE2-CZ 3.59Å; F136-F273 HydrophobicContact CG-CD1 4.19Å; F136-F273 AromaticContact CG-CE1 3.43Å; F136-F273 HydrophobicContact CG-CE1 3.43Å; F136-F273 VanDerWaalsContact CG-CE1 3.43Å; F136-F273 AromaticContact CG-CZ 3.79Å; F136-F273 HydrophobicContact CG-CZ 3.79Å; F136-F273 AromaticContact CZ-CE1 3.9Å; F136-F273 HydrophobicContact CZ-CE1 3.9Å; F136-F273 HydrophobicContact CZ-CE2 4.24Å; F136-F273 AromaticContact CZ-CZ 3.32Å; F136-F273 HydrophobicContact CZ-CZ 3.32Å; F136-F274 HydrophobicContact CB-CE2 4.16Å; F136-F274 HydrophobicContact CB-CZ 4.26Å; F136-F274 HydrophobicContact CD2-CZ 4.49Å
137	G	91.9	Very high	92.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.			trans	148.5	164.5	-178.4	0	0	0	0	0	111.9	K143 I236	G137-K143 PolarHBondContact O-NZ 2.75Å; G137-I236 PolarHBondContact O-N 2.86Å
138	R	90.1	Very high	93	Very high	102 Å²	102	28.7 Å²	28.7	39%	0.385	14%	0.143	S	C	.	.			trans	-63.4	160	-179.1	-65.1	178.9	61.2	166.1	0.2	112.1	S140 N141 K143 I236 E270	R138-S140 PolarHBondContact O-N 3.38Å; R138-N141 PolarHBondContact N-ND2 2.89Å; R138-N141 WeakPolarHBondContact O-CB 3.28Å; R138-N141 PolarHBondContact O-N 2.79Å; R138-K143 PolarHBondContact O-NZ 3.04Å; R138-K143 VanDerWaalsContact O-NZ 3.09Å; R138-I236 HydrophobicContact CB-CG1 4.5Å; R138-I236 HydrophobicContact CG-CD1 3.96Å; R138-I236 HydrophobicContact CG-CG1 3.78Å; R138-E270 HydrophobicContact CG-CG 4.38Å
139	T	88.2	Confident	93.5	Very high	39 Å²	39	19.1 Å²	19.1	24%	0.239	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	137.1	171.5	-54.1	0	0	0	0	109.5	N141 T163 D237	T139-N141 VanDerWaalsContact C-N 3.25Å; T139-N141 PolarHBondContact O-N 3.33Å; T139-T163 HydrophobicContact CG2-CG2 3.7Å; T139-D237 PolarHBondContact N-OD1 3.35Å; T139-D237 PolarHBondContact OG1-OD1 3.48Å
140	S	88	Confident	93.9	Very high	98 Å²	98	17.7 Å²	17.7	69%	0.685	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	7.2	-179.2	-51.6	0	0	0	0	117.2	R138 G142	R138-S140 PolarHBondContact O-N 3.38Å; S140-G142 PolarHBondContact O-N 2.81Å
141	N	91.7	Very high	93.9	Very high	11 Å²	11	15.6 Å²	15.6	6%	0.059	9%	0.09	C	C	.	.	S	Bend	trans	-70	-11.3	169.3	-74.5	6.4	0	0	0	113.3	R138 T139 V259 N261 E270 N291	R138-N141 PolarHBondContact N-ND2 2.89Å; R138-N141 WeakPolarHBondContact O-CB 3.28Å; R138-N141 PolarHBondContact O-N 2.79Å; T139-N141 VanDerWaalsContact C-N 3.25Å; T139-N141 PolarHBondContact O-N 3.33Å; N141-V259 HydrophobicContact CB-CG1 4.36Å; N141-V259 WeakPolarHBondContact CB-O 3.33Å; N141-V259 PolarHBondContact ND2-O 3.48Å; N141-V259 WeakPolarHBondContact O-CG1 3.25Å; N141-N261 PolarHBondContact ND2-N 2.73Å; N141-E270 PolarHBondContact ND2-OE1 2.82Å; N141-N291 PolarHBondContact O-ND2 2.99Å
142	G	92.1	Very high	93.7	Very high	16 Å²	16	19 Å²	19	17%	0.165	11%	0.105	C	C	.	.			trans	93.9	26.6	175.7	0	0	0	0	0	115.8	S140 T145 V146	S140-G142 PolarHBondContact O-N 2.81Å; G142-T145 WeakPolarHBondContact O-CA 3.14Å; G142-T145 WeakPolarHBondContact O-CB 3.25Å; G142-T145 PolarHBondContact O-N 3.18Å; G142-T145 VanDerWaalsContact O-N 3.13Å; G142-V146 WeakPolarHBondContact O-CG2 3.32Å; G142-V146 PolarHBondContact O-N 2.64Å
143	K	93.9	Very high	93.4	Very high	12 Å²	12	19.3 Å²	19.3	5%	0.052	11%	0.109	C	C	.	.	H	α-helix	trans	-51.6	-56.1	176.3	-58.5	-176.3	-64.9	-74.6	0	113.2	G137 R138 T145 V146 V147 D232 S233 V259	G137-K143 PolarHBondContact O-NZ 2.75Å; R138-K143 PolarHBondContact O-NZ 3.04Å; R138-K143 VanDerWaalsContact O-NZ 3.09Å; K143-T145 PolarHBondContact O-N 3.12Å; K143-V146 WeakPolarHBondContact O-CA 3.34Å; K143-V146 WeakPolarHBondContact O-CB 3.29Å; K143-V146 PolarHBondContact O-N 3.49Å; K143-V147 PolarHBondContact O-N 3.39Å; K143-D232 WeakPolarHBondContact CB-OD1 3.45Å; K143-S233 WeakPolarHBondContact CE-O 3.44Å; K143-V259 HydrophobicContact CG-CB 4.01Å; K143-V259 HydrophobicContact CG-CG2 4.17Å
144	S	93.4	Very high	93	Very high	15 Å²	15	22.3 Å²	22.3	11%	0.105	12%	0.122	C	C	.	.	H	α-helix	trans	-60.7	-32.3	178.2	-34.5	0	0	0	0	112.2	V147 N148 P157 T164 D232	S144-V147 PolarHBondContact O-N 2.85Å; S144-N148 WeakPolarHBondContact O-CB 3.39Å; S144-N148 PolarHBondContact O-N 3.49Å; S144-N148 PolarHBondContact O-ND2 3.21Å; S144-P157 VanDerWaalsContact CB-O 3.31Å; S144-P157 WeakPolarHBondContact CB-O 3.46Å; S144-T164 PolarHBondContact OG-OG1 2.68Å; S144-D232 WeakPolarHBondContact CB-OD2 3.4Å; S144-D232 PolarHBondContact OG-OD2 3.36Å
145	T	94.5	Very high	92.6	Very high	23 Å²	23	22.4 Å²	22.4	14%	0.141	12%	0.122	C	C	.	.	H	α-helix	trans	-68.1	-40.2	173.9	-48.4	0	0	0	0	111.9	G142 K143 N148 A149 A339 R340 L343	G142-T145 WeakPolarHBondContact O-CA 3.14Å; G142-T145 WeakPolarHBondContact O-CB 3.25Å; G142-T145 PolarHBondContact O-N 3.18Å; G142-T145 VanDerWaalsContact O-N 3.13Å; K143-T145 PolarHBondContact O-N 3.12Å; T145-N148 PolarHBondContact O-N 3.39Å; T145-A149 WeakPolarHBondContact O-CB 3.27Å; T145-A149 PolarHBondContact O-N 2.86Å; T145-A339 HydrophobicContact CG2-CB 3.91Å; T145-R340 HydrophobicContact CG2-CB 4.43Å; T145-L343 HydrophobicContact CG2-CD2 4.15Å
146	V	96.7	Very high	92.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-48.5	173.3	171.6	0	0	0	0	110.1	F135 G142 K143 N148 A149 M150 V259 L289 A339 F371	F135-V146 HydrophobicContact CD1-CG1 4.15Å; F135-V146 HydrophobicContact CE1-CG1 3.75Å; G142-V146 WeakPolarHBondContact O-CG2 3.32Å; G142-V146 PolarHBondContact O-N 2.64Å; K143-V146 WeakPolarHBondContact O-CA 3.34Å; K143-V146 WeakPolarHBondContact O-CB 3.29Å; K143-V146 PolarHBondContact O-N 3.49Å; V146-N148 PolarHBondContact O-N 3.06Å; V146-A149 WeakPolarHBondContact O-CB 3.44Å; V146-A149 PolarHBondContact O-N 3.47Å; V146-A149 VanDerWaalsContact O-N 3.14Å; V146-M150 HydrophobicContact CG1-CG 4.47Å; V146-M150 HydrophobicContact CG1-SD 4.15Å; V146-M150 WeakPolarHBondContact O-CG 3.43Å; V146-M150 PolarHBondContact O-N 3.47Å; V146-V259 HydrophobicContact CG2-CG1 4.02Å; V146-V259 HydrophobicContact CG2-CG2 4.18Å; V146-L289 HydrophobicContact CG1-CD1 3.67Å; V146-L289 HydrophobicContact CG2-CD1 4.2Å; V146-A339 HydrophobicContact CB-CB 4.36Å; V146-A339 HydrophobicContact CG2-CB 3.6Å; V146-F371 HydrophobicContact CG1-CZ 4.41Å
147	V	96.2	Very high	91.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.7	-47.6	178	174.9	0	0	0	0	110.9	F135 K143 S144 A149 M150 L151 L156 L230 D232	F135-V147 HydrophobicContact CD1-CG2 4.21Å; F135-V147 HydrophobicContact CD2-CG2 3.55Å; F135-V147 HydrophobicContact CE1-CG2 4.34Å; F135-V147 HydrophobicContact CE2-CG2 3.71Å; F135-V147 HydrophobicContact CG-CG2 3.84Å; F135-V147 HydrophobicContact CZ-CG2 4.11Å; K143-V147 PolarHBondContact O-N 3.39Å; S144-V147 PolarHBondContact O-N 2.85Å; V147-A149 VanDerWaalsContact C-N 3.32Å; V147-A149 PolarHBondContact O-N 3.43Å; V147-M150 PolarHBondContact O-N 2.87Å; V147-L151 HydrophobicContact CG1-CD1 3.81Å; V147-L151 HydrophobicContact CG1-CG 4.44Å; V147-L151 WeakPolarHBondContact O-CB 3.3Å; V147-L151 WeakPolarHBondContact O-CG 3.43Å; V147-L151 PolarHBondContact O-N 2.99Å; V147-L156 HydrophobicContact CB-CD1 3.96Å; V147-L156 HydrophobicContact CG1-CD1 3.66Å; V147-L156 HydrophobicContact CG1-CG 4.31Å; V147-L156 HydrophobicContact CG2-CD1 4.37Å; V147-L230 HydrophobicContact CG1-CB 4.26Å; V147-L230 HydrophobicContact CG1-CD2 4.13Å; V147-D232 HydrophobicContact CG2-CB 4.48Å
148	N	94.5	Very high	91.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-60.8	-39.7	176.1	-76.1	-19.9	0	0	0	112.6	S144 T145 V146 L151 H152 S153 V155 L156 L343	S144-N148 WeakPolarHBondContact O-CB 3.39Å; S144-N148 PolarHBondContact O-N 3.49Å; S144-N148 PolarHBondContact O-ND2 3.21Å; T145-N148 PolarHBondContact O-N 3.39Å; V146-N148 PolarHBondContact O-N 3.06Å; N148-L151 PolarHBondContact O-N 3.32Å; N148-H152 PolarHBondContact O-N 3.13Å; N148-H152 VanDerWaalsContact O-N 3.08Å; N148-S153 CarbonylContact C-O 3.59Å; N148-S153 VanDerWaalsContact CA-O 3.27Å; N148-S153 WeakPolarHBondContact CA-O 3.44Å; N148-S153 VanDerWaalsContact CB-O 3.25Å; N148-S153 WeakPolarHBondContact CB-O 3.25Å; N148-S153 PolarHBondContact O-N 3.4Å; N148-S153 VanDerWaalsContact O-N 3.15Å; N148-S153 PolarHBondContact OD1-O 3.47Å; N148-V155 PolarHBondContact OD1-N 2.95Å; N148-L156 PolarHBondContact ND2-O 3.32Å; N148-L156 PolarHBondContact OD1-N 3.02Å; N148-L343 HydrophobicContact CB-CD1 3.99Å; N148-L343 HydrophobicContact CB-CD2 3.85Å
149	A	95.3	Very high	90.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.3	-50.6	175.6	0	0	0	0	0	110.5	T145 V146 V147 L151 H152 V342 L343 R346 F371	T145-A149 WeakPolarHBondContact O-CB 3.27Å; T145-A149 PolarHBondContact O-N 2.86Å; V146-A149 WeakPolarHBondContact O-CB 3.44Å; V146-A149 PolarHBondContact O-N 3.47Å; V146-A149 VanDerWaalsContact O-N 3.14Å; V147-A149 VanDerWaalsContact C-N 3.32Å; V147-A149 PolarHBondContact O-N 3.43Å; A149-L151 VanDerWaalsContact C-N 3.27Å; A149-L151 PolarHBondContact O-N 2.93Å; A149-H152 PolarHBondContact O-CD2 2.86Å; A149-H152 PolarHBondContact O-N 3.36Å; A149-V342 HydrophobicContact CB-CB 4.38Å; A149-V342 HydrophobicContact CB-CG1 4.06Å; A149-L343 HydrophobicContact CB-CB 4.12Å; A149-R346 WeakPolarHBondContact O-CD 3.25Å; A149-R346 PolarHBondContact O-NH1 3.38Å; A149-F371 HydrophobicContact CB-CE1 4.27Å; A149-F371 HydrophobicContact CB-CE2 4.27Å; A149-F371 HydrophobicContact CB-CZ 3.7Å
150	M	96	Very high	89.6	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.015	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-32.8	177.3	-70.4	-178.4	73.3	0	0	113.2	F135 V146 V147 H152 L223 L230 F371 F374 F378	F135-M150 HydrophobicContact CE1-SD 3.79Å; F135-M150 HydrophobicContact CZ-CE 4.34Å; F135-M150 HydrophobicContact CZ-SD 3.52Å; F135-M150 VanDerWaalsContact CZ-SD 3.52Å; V146-M150 HydrophobicContact CG1-CG 4.47Å; V146-M150 HydrophobicContact CG1-SD 4.15Å; V146-M150 WeakPolarHBondContact O-CG 3.43Å; V146-M150 PolarHBondContact O-N 3.47Å; V147-M150 PolarHBondContact O-N 2.87Å; M150-H152 VanDerWaalsContact C-N 3.32Å; M150-H152 PolarHBondContact O-CD2 3.04Å; M150-L223 HydrophobicContact CB-CD1 3.92Å; M150-L223 HydrophobicContact CE-CD1 3.98Å; M150-L230 HydrophobicContact CB-CD2 4.5Å; M150-F371 HydrophobicContact CG-CE1 4.02Å; M150-F371 HydrophobicContact CG-CZ 3.89Å; M150-F374 HydrophobicContact CE-CE1 4.13Å; M150-F374 HydrophobicContact CE-CZ 4.25Å; M150-F374 HydrophobicContact CG-CE1 4.32Å; M150-F374 HydrophobicContact SD-CE1 3.74Å; M150-F374 HydrophobicContact SD-CZ 4.04Å; M150-F378 HydrophobicContact CE-CD1 3.63Å; M150-F378 HydrophobicContact CE-CE1 3.56Å; M150-F378 HydrophobicContact CE-CG 4.2Å; M150-F378 HydrophobicContact CE-CZ 4.07Å
151	L	94.3	Very high	88.7	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-5.6	176.4	-68.1	175.1	0	0	0	113.9	V147 N148 A149 S153 V155 V170 S221 L224 L230	V147-L151 HydrophobicContact CG1-CD1 3.81Å; V147-L151 HydrophobicContact CG1-CG 4.44Å; V147-L151 WeakPolarHBondContact O-CB 3.3Å; V147-L151 WeakPolarHBondContact O-CG 3.43Å; V147-L151 PolarHBondContact O-N 2.99Å; N148-L151 PolarHBondContact O-N 3.32Å; A149-L151 VanDerWaalsContact C-N 3.27Å; A149-L151 PolarHBondContact O-N 2.93Å; L151-S153 PolarHBondContact O-N 3.35Å; L151-S153 VanDerWaalsContact O-N 3.15Å; L151-V155 HydrophobicContact CB-CG2 4.27Å; L151-V155 HydrophobicContact CD1-CB 4.01Å; L151-V155 HydrophobicContact CD1-CG1 4.35Å; L151-V155 HydrophobicContact CD1-CG2 3.76Å; L151-V170 HydrophobicContact CD1-CB 4.39Å; L151-V170 HydrophobicContact CD1-CG1 3.9Å; L151-V170 HydrophobicContact CD1-CG2 4.36Å; L151-S221 WeakPolarHBondContact CD2-OG 3.18Å; L151-L224 HydrophobicContact CD2-CD1 4.27Å; L151-L224 HydrophobicContact CD2-CD2 4.1Å; L151-L224 HydrophobicContact CD2-CG 3.92Å; L151-L230 HydrophobicContact CD2-CD1 3.87Å; L151-L230 HydrophobicContact CD2-CD2 4.35Å; L151-L230 HydrophobicContact CG-CD2 4.33Å
152	H	92.3	Very high	87.7	Confident	71 Å²	71	34.1 Å²	34.1	33%	0.329	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	32.8	-174.1	-63.7	-138.5	0	0	0	112.1	N148 A149 M150 R346 K350	N148-H152 PolarHBondContact O-N 3.13Å; N148-H152 VanDerWaalsContact O-N 3.08Å; A149-H152 PolarHBondContact O-CD2 2.86Å; A149-H152 PolarHBondContact O-N 3.36Å; M150-H152 VanDerWaalsContact C-N 3.32Å; M150-H152 PolarHBondContact O-CD2 3.04Å; H152-R346 HydrophobicContact CB-CB 4.47Å; H152-R346 PolarHBondContact CD2-NH1 3.12Å; H152-R346 VanDerWaalsContact NE2-CZ 3.27Å; H152-R346 PolarHBondContact NE2-NE 3.43Å; H152-R346 PolarHBondContact NE2-NH1 3.03Å; H152-R346 VanDerWaalsContact NE2-NH1 3.18Å; H152-K350 WeakPolarHBondContact O-CD 3.4Å; H152-K350 WeakPolarHBondContact O-CE 3.46Å; H152-K350 PolarHBondContact O-NZ 3.08Å
153	S	89	Confident	86.7	Confident	15 Å²	15	37.1 Å²	37.1	11%	0.105	22%	0.217	C	C	.	.	S	Bend	trans	-158.8	155.3	-172.5	-171.7	0	0	0	0	110.8	N148 L151 V155	N148-S153 CarbonylContact C-O 3.59Å; N148-S153 VanDerWaalsContact CA-O 3.27Å; N148-S153 WeakPolarHBondContact CA-O 3.44Å; N148-S153 VanDerWaalsContact CB-O 3.25Å; N148-S153 WeakPolarHBondContact CB-O 3.25Å; N148-S153 PolarHBondContact O-N 3.4Å; N148-S153 VanDerWaalsContact O-N 3.15Å; N148-S153 PolarHBondContact OD1-O 3.47Å; L151-S153 PolarHBondContact O-N 3.35Å; L151-S153 VanDerWaalsContact O-N 3.15Å; S153-V155 PolarHBondContact O-N 3.23Å
154	K	88.2	Confident	85.9	Confident	63 Å²	63	37.7 Å²	37.7	27%	0.274	22%	0.221	S	C	.	.			trans	-87.4	85.1	173.5	-57.4	175.8	179.5	-162.8	0	108.1	Y158 I194 L347	K154-Y158 HydrophobicContact CB-CE1 4.08Å; K154-Y158 HydrophobicContact CD-CE1 3.7Å; K154-Y158 WeakPolarHBondContact CE-OH 3.29Å; K154-Y158 HydrophobicContact CG-CE1 3.73Å; K154-Y158 PolarHBondContact NZ-OH 2.97Å; K154-I194 HydrophobicContact CB-CD1 3.35Å; K154-I194 HydrophobicContact CD-CD1 4.45Å; K154-I194 WeakPolarHBondContact O-CD1 3.44Å; K154-L347 HydrophobicContact CD-CD1 4.14Å; K154-L347 HydrophobicContact CG-CD1 3.81Å; K154-L347 HydrophobicContact CG-CD2 4.13Å
155	V	89	Confident	85.3	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	24%	0.244	C	C	.	.			trans	-94.7	-48.7	-177.4	-179	0	0	0	0	110.6	N148 L151 S153 V170 M197 V214 W216	N148-V155 PolarHBondContact OD1-N 2.95Å; L151-V155 HydrophobicContact CB-CG2 4.27Å; L151-V155 HydrophobicContact CD1-CB 4.01Å; L151-V155 HydrophobicContact CD1-CG1 4.35Å; L151-V155 HydrophobicContact CD1-CG2 3.76Å; S153-V155 PolarHBondContact O-N 3.23Å; V155-V170 HydrophobicContact CG1-CG1 3.91Å; V155-V170 HydrophobicContact CG1-CG2 3.99Å; V155-M197 WeakPolarHBondContact O-CE 3.39Å; V155-V214 HydrophobicContact CG1-CG1 3.87Å; V155-W216 HydrophobicContact CB-CE3 4.5Å; V155-W216 HydrophobicContact CG1-CD2 4.1Å; V155-W216 HydrophobicContact CG1-CE3 3.79Å; V155-W216 HydrophobicContact CG1-CZ3 4.15Å; V155-W216 HydrophobicContact CG2-CD2 3.98Å; V155-W216 HydrophobicContact CG2-CE3 4.31Å; V155-W216 HydrophobicContact CG2-CG 4.43Å; V155-W216 HydrophobicContact CG2-CH2 4.34Å; V155-W216 HydrophobicContact CG2-CZ2 4.09Å; V155-W216 HydrophobicContact CG2-CZ3 4.47Å
156	L	89.3	Confident	84.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-97.3	151.2	-179.7	-57.6	-176.5	0	0	0	111.2	V147 N148 Y158 L168 V170 V214 D232	V147-L156 HydrophobicContact CB-CD1 3.96Å; V147-L156 HydrophobicContact CG1-CD1 3.66Å; V147-L156 HydrophobicContact CG1-CG 4.31Å; V147-L156 HydrophobicContact CG2-CD1 4.37Å; N148-L156 PolarHBondContact ND2-O 3.32Å; N148-L156 PolarHBondContact OD1-N 3.02Å; L156-Y158 PolarHBondContact O-N 3.04Å; L156-L168 HydrophobicContact CD2-CB 3.98Å; L156-L168 HydrophobicContact CD2-CD1 3.89Å; L156-V170 HydrophobicContact CD1-CG2 4.37Å; L156-V170 HydrophobicContact CD2-CG2 3.74Å; L156-V170 HydrophobicContact CG-CG2 4.16Å; L156-V214 HydrophobicContact CD2-CG2 4.28Å; L156-D232 HydrophobicContact CD1-CB 3.57Å
157	P	84.7	Confident	84.4	Confident	11 Å²	11	43.4 Å²	43.4	7%	0.071	24%	0.239	C	C	.	.			trans	-54.3	133.7	171.1	-24	34.3	0	0	0	111.3	S144 H162 I194 M197 A198 F201	S144-P157 VanDerWaalsContact CB-O 3.31Å; S144-P157 WeakPolarHBondContact CB-O 3.46Å; P157-H162 HydrophobicContact CB-CB 4.41Å; P157-I194 HydrophobicContact CB-CG2 4.37Å; P157-I194 HydrophobicContact CG-CG2 4.23Å; P157-M197 HydrophobicContact CG-SD 4.29Å; P157-A198 HydrophobicContact CG-CB 4.44Å; P157-F201 HydrophobicContact CG-CE2 4.42Å
158	Y	80.9	Confident	84.2	Confident	71 Å²	71	43.5 Å²	43.5	28%	0.278	24%	0.239	S	C	.	.			trans	-147.5	148.3	-179.2	79.3	-76.3	0	0	0	110.7	K154 L156 L343	K154-Y158 HydrophobicContact CB-CE1 4.08Å; K154-Y158 HydrophobicContact CD-CE1 3.7Å; K154-Y158 WeakPolarHBondContact CE-OH 3.29Å; K154-Y158 HydrophobicContact CG-CE1 3.73Å; K154-Y158 PolarHBondContact NZ-OH 2.97Å; L156-Y158 PolarHBondContact O-N 3.04Å; Y158-L343 HydrophobicContact CD2-CD2 4.14Å; Y158-L343 HydrophobicContact CE2-CD2 4.1Å; Y158-L343 HydrophobicContact CG-CD2 4.5Å
159	G	72.4	Confident	84.2	Confident	45 Å²	45	44.2 Å²	44.2	46%	0.464	24%	0.242	S	C	.	.	S	Bend	trans	123.8	174.4	179.1	0	0	0	0	0	113.4	G161 H162	G159-G161 PolarHBondContact O-N 2.83Å; G159-H162 PolarHBondContact O-N 3.48Å
160	M	69.8	Low	84.1	Confident	198 Å²	198	44.2 Å²	44.2	98%	0.975	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	132.1	178.5	-68.9	176.8	116.6	0	0	110.2
161	G	67.8	Low	83.9	Confident	80 Å²	80	45.2 Å²	45.2	83%	0.825	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.5	-9	179.9	0	0	0	0	0	115.4	G159	G159-G161 PolarHBondContact O-N 2.83Å
162	H	70.8	Confident	83.8	Confident	92 Å²	92	46.3 Å²	46.3	43%	0.426	26%	0.258	S	S	.	.			trans	-92.9	116.5	172.9	-66.9	-72	0	0	0	110.6	P157 G159	P157-H162 HydrophobicContact CB-CB 4.41Å; G159-H162 PolarHBondContact O-N 3.48Å
163	T	70.4	Confident	83.6	Confident	79 Å²	79	43.7 Å²	43.7	49%	0.485	25%	0.248	S	C	.	.			trans	-118.3	120.6	176.5	56.4	0	0	0	0	110.6	T139 R165	T139-T163 HydrophobicContact CG2-CG2 3.7Å; T163-R165 PolarHBondContact O-N 2.85Å
164	T	78.2	Confident	83.3	Confident	24 Å²	24	48.7 Å²	48.7	15%	0.147	28%	0.283	C	S	.	.			trans	-69.6	111.6	172.3	-52.4	0	0	0	0	109.6	S144 C166 L168 D232 P234	S144-T164 PolarHBondContact OG-OG1 2.68Å; T164-C166 WeakPolarHBondContact CG2-O 3.16Å; T164-L168 HydrophobicContact CG2-CD1 3.92Å; T164-L168 HydrophobicContact CG2-CG 4.06Å; T164-D232 PolarHBondContact OG1-OD2 2.75Å; T164-P234 WeakPolarHBondContact O-CA 3.45Å
165	R	79.8	Confident	82.8	Confident	153 Å²	153	49.3 Å²	49.3	58%	0.577	30%	0.295	S	S	*	.			trans	-96.6	-18.8	-179.1	-60.3	-169.9	80.1	124.5	2.6	114.3	T163 E208 P234	T163-R165 PolarHBondContact O-N 2.85Å; R165-E208 WeakPolarHBondContact O-CA 3.34Å; R165-P234 WeakPolarHBondContact O-CG 3.41Å
166	C	84.7	Confident	82.2	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.034	32%	0.319	C	S	.	.	S	Bend	trans	-128.8	166.8	-177.7	60.2	0	0	0	0	110.2	T164 V210 F212	T164-C166 WeakPolarHBondContact CG2-O 3.16Å; C166-V210 WeakPolarHBondContact CB-O 3.47Å; C166-F212 HydrophobicContact CB-CD2 4.42Å
167	F	89.3	Confident	81.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.9	175.7	-75.4	-98.5	0	0	0	110.8	F136 E208 V210 L211 F212 V231 D232 P234 W245 H249	F136-F167 HydrophobicContact CE1-CE1 4.19Å; F136-F167 HydrophobicContact CE1-CZ 4.32Å; F136-F167 HydrophobicContact CZ-CE1 4.18Å; F167-E208 WeakPolarHBondContact CD2-O 3.34Å; F167-V210 PolarHBondContact N-O 3.38Å; F167-L211 HydrophobicContact CB-CB 4.44Å; F167-L211 HydrophobicContact CB-CD1 3.37Å; F167-L211 HydrophobicContact CG-CD1 4.44Å; F167-L211 WeakPolarHBondContact O-CA 3.5Å; F167-F212 PolarHBondContact O-N 2.87Å; F167-V231 HydrophobicContact CD1-CG1 3.76Å; F167-D232 WeakPolarHBondContact CA-O 3.08Å; F167-P234 HydrophobicContact CD2-CG 4.03Å; F167-P234 HydrophobicContact CE2-CG 4.02Å; F167-W245 HydrophobicContact CE2-CB 4.2Å; F167-W245 AromaticContact CE2-CD1 3.94Å; F167-W245 AromaticContact CE2-CD2 3.55Å; F167-W245 HydrophobicContact CE2-CD2 3.55Å; F167-W245 AromaticContact CE2-CE2 3.82Å; F167-W245 AromaticContact CE2-CE3 3.99Å; F167-W245 HydrophobicContact CE2-CE3 3.99Å; F167-W245 AromaticContact CE2-CG 3.65Å; F167-W245 HydrophobicContact CE2-CG 3.65Å; F167-W245 HydrophobicContact CE2-CZ2 4.48Å; F167-W245 HydrophobicContact CZ-CB 3.85Å; F167-W245 AromaticContact CZ-CD2 3.56Å; F167-W245 HydrophobicContact CZ-CD2 3.56Å; F167-W245 AromaticContact CZ-CE3 3.59Å; F167-W245 HydrophobicContact CZ-CE3 3.59Å; F167-W245 AromaticContact CZ-CG 3.7Å; F167-W245 HydrophobicContact CZ-CG 3.7Å; F167-W245 HydrophobicContact CZ-CZ3 4.35Å; F167-H249 HydrophobicContact CD1-CB 4.31Å; F167-H249 AromaticContact CD2-CD2 3.62Å; F167-H249 HydrophobicContact CE1-CB 4.27Å; F167-H249 AromaticContact CE2-CD2 3.78Å; F167-H249 AromaticContact CG-CD2 3.84Å
168	L	91.2	Very high	81.9	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.4	176.9	-55.7	-179.6	0	0	0	109.7	L156 T164 F201 F212 V231 D232	L156-L168 HydrophobicContact CD2-CB 3.98Å; L156-L168 HydrophobicContact CD2-CD1 3.89Å; T164-L168 HydrophobicContact CG2-CD1 3.92Å; T164-L168 HydrophobicContact CG2-CG 4.06Å; L168-F201 HydrophobicContact CD1-CE2 4.11Å; L168-F201 HydrophobicContact CD1-CZ 4.29Å; L168-F201 HydrophobicContact CD2-CE1 3.69Å; L168-F201 HydrophobicContact CD2-CE2 3.9Å; L168-F201 HydrophobicContact CD2-CZ 3.26Å; L168-F201 HydrophobicContact CG-CZ 4.43Å; L168-F212 HydrophobicContact CD2-CB 3.99Å; L168-V231 CarbonylContact O-C 3.59Å; L168-V231 WeakPolarHBondContact O-CA 3.4Å; L168-D232 HydrophobicContact CB-CB 4.37Å; L168-D232 PolarHBondContact N-O 3.39Å; L168-D232 PolarHBondContact O-N 3.46Å
169	Q	93.6	Very high	82.1	Confident	14 Å²	14	58.9 Å²	58.9	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	109.1	179.6	176.2	160.5	-53.2	0	0	110.7	E171 L211 F212 R213 V214 V229 L230 V231	Q169-E171 HydrophobicContact CG-CG 3.93Å; Q169-E171 PolarHBondContact NE2-OE1 2.94Å; Q169-L211 HydrophobicContact CB-CD1 3.77Å; Q169-L211 HydrophobicContact CB-CD2 4.4Å; Q169-L211 HydrophobicContact CB-CG 4.23Å; Q169-F212 PolarHBondContact N-O 3.48Å; Q169-R213 CarbonylContact O-C 3.44Å; Q169-R213 VanDerWaalsContact O-CA 3.31Å; Q169-R213 WeakPolarHBondContact O-CA 3.28Å; Q169-V214 PolarHBondContact O-N 3.48Å; Q169-V229 HydrophobicContact CG-CG1 3.35Å; Q169-L230 CarbonylContact C-O 3.58Å; Q169-L230 WeakPolarHBondContact CA-O 3.43Å; Q169-V231 HydrophobicContact CB-CG2 4.1Å; Q169-V231 HydrophobicContact CG-CG2 3.98Å
170	V	94.1	Very high	82.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.1	176.7	-171.4	0	0	0	0	110	L151 V155 L156 V214 W216 L224 V229 L230	L151-V170 HydrophobicContact CD1-CB 4.39Å; L151-V170 HydrophobicContact CD1-CG1 3.9Å; L151-V170 HydrophobicContact CD1-CG2 4.36Å; V155-V170 HydrophobicContact CG1-CG1 3.91Å; V155-V170 HydrophobicContact CG1-CG2 3.99Å; L156-V170 HydrophobicContact CD1-CG2 4.37Å; L156-V170 HydrophobicContact CD2-CG2 3.74Å; L156-V170 HydrophobicContact CG-CG2 4.16Å; V170-V214 WeakPolarHBondContact CA-O 3.21Å; V170-V214 HydrophobicContact CG2-CB 4.28Å; V170-W216 HydrophobicContact CG1-CB 4.27Å; V170-L224 HydrophobicContact CG1-CD1 4.28Å; V170-L224 HydrophobicContact CG1-CD2 4.13Å; V170-V229 WeakPolarHBondContact O-CA 3.33Å; V170-L230 HydrophobicContact CB-CB 4.49Å; V170-L230 PolarHBondContact N-O 3.3Å; V170-L230 PolarHBondContact O-N 3.45Å; V170-L230 VanDerWaalsContact O-N 3.12Å
171	E	92.6	Very high	83.6	Confident	25 Å²	25	48 Å²	48	12%	0.117	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.3	-179.9	-58.5	175.9	-156.2	0	0	112.3	Q169 S173 R213 V214 L215 W216 V229	Q169-E171 HydrophobicContact CG-CG 3.93Å; Q169-E171 PolarHBondContact NE2-OE1 2.94Å; E171-S173 PolarHBondContact O-N 3.32Å; E171-R213 IonicContact OE1-CZ 2.97Å; E171-R213 IonicContact OE1-NE 3.25Å; E171-R213 PolarHBondContact OE1-NE 3.35Å; E171-R213 IonicContact OE1-NH2 3.68Å; E171-R213 IonicContact OE2-CZ 3.85Å; E171-R213 IonicContact OE2-NE 3.3Å; E171-R213 PolarHBondContact OE2-NE 2.99Å; E171-R213 IonicContact OE2-NH2 3.78Å; E171-R213 PolarHBondContact OE2-NH2 3.45Å; E171-V214 PolarHBondContact N-O 3.07Å; E171-L215 HydrophobicContact CB-CD2 4.01Å; E171-W216 PolarHBondContact O-N 3.42Å; E171-V229 HydrophobicContact CB-CG2 4.47Å; E171-V229 HydrophobicContact CG-CB 4.48Å; E171-V229 HydrophobicContact CG-CG1 3.87Å; E171-V229 HydrophobicContact CG-CG2 3.87Å
172	G	91.1	Very high	84.3	Confident	23 Å²	23	47.8 Å²	47.8	24%	0.237	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	116.2	176.6	0	0	0	0	0	113.5	W216 K218	G172-W216 CarbonylContact C-O 3.6Å; G172-W216 WeakPolarHBondContact CA-O 3.34Å; G172-K218 WeakPolarHBondContact O-CE 3.28Å
173	S	87.9	Confident	84.7	Confident	16 Å²	16	47.7 Å²	47.7	11%	0.112	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.1	174.5	-174	0	0	0	0	112.1	E171 S175 W216 K218	E171-S173 PolarHBondContact O-N 3.32Å; S173-S175 PolarHBondContact OG-N 3.49Å; S173-S175 PolarHBondContact OG-OG 3.02Å; S173-W216 PolarHBondContact N-O 3.32Å; S173-K218 PolarHBondContact O-N 2.96Å
174	S	82.3	Confident	85	Confident	120 Å²	120	48.2 Å²	48.2	84%	0.839	29%	0.288	S	S	*	.	S	Bend	trans	-79.5	-22.3	173.7	50.4	0	0	0	0	113.4	G176	S174-G176 PolarHBondContact O-N 2.84Å
175	S	79.2	Confident	84.9	Confident	76 Å²	76	48.8 Å²	48.8	53%	0.531	29%	0.293	S	S	.	.	S	Bend	trans	-71	-12.3	-179	65.2	0	0	0	0	113.9	S173 Q177	S173-S175 PolarHBondContact OG-N 3.49Å; S173-S175 PolarHBondContact OG-OG 3.02Å; S175-Q177 PolarHBondContact O-N 3.44Å; S175-Q177 VanDerWaalsContact O-N 3.16Å; S175-Q177 PolarHBondContact OG-N 3.49Å
176	G	76	Confident	84.4	Confident	48 Å²	48	50.2 Å²	50.2	50%	0.495	31%	0.306	S	S	.	.			trans	69.8	0.3	-174.2	0	0	0	0	0	114.3	S174 P217	S174-G176 PolarHBondContact O-N 2.84Å; G176-P217 WeakPolarHBondContact O-CG 3.3Å
177	Q	78.9	Confident	83.7	Confident	141 Å²	141	55.7 Å²	55.7	66%	0.659	34%	0.335	S	S	*	.			trans	-92.1	142.2	177.4	-65.7	-171.2	-10.2	0	0	111.6	S175	S175-Q177 PolarHBondContact O-N 3.44Å; S175-Q177 VanDerWaalsContact O-N 3.16Å; S175-Q177 PolarHBondContact OG-N 3.49Å
178	K	87.9	Confident	82.9	Confident	80 Å²	80	60.9 Å²	60.9	35%	0.348	36%	0.363	S	S	.	.			trans	-90.2	118.5	174.3	-61.9	171.5	-178.5	-178.4	0	108.8	L191 L215 W216 P217	K178-L191 HydrophobicContact CB-CB 3.87Å; K178-L191 WeakPolarHBondContact CB-O 3.35Å; K178-L191 PolarHBondContact O-N 2.89Å; K178-L215 WeakPolarHBondContact CA-O 3.32Å; K178-W216 HydrophobicContact CB-CE3 4.39Å; K178-W216 HydrophobicContact CB-CZ3 4.44Å; K178-W216 HydrophobicContact CD-CD2 4.43Å; K178-W216 HydrophobicContact CD-CE3 4.01Å; K178-W216 HydrophobicContact CD-CH2 3.6Å; K178-W216 HydrophobicContact CD-CZ2 3.98Å; K178-W216 HydrophobicContact CD-CZ3 3.6Å; K178-W216 VanDerWaalsContact CE-CH2 3.49Å; K178-W216 HydrophobicContact CG-CD2 4.24Å; K178-W216 HydrophobicContact CG-CE3 3.89Å; K178-W216 HydrophobicContact CG-CH2 4.38Å; K178-W216 HydrophobicContact CG-CZ3 3.98Å; K178-W216 VanDerWaalsContact NZ-CZ2 3.35Å; K178-P217 HydrophobicContact CG-CG 4.21Å
179	C	86.4	Confident	82.2	Confident	16 Å²	16	64.7 Å²	64.7	11%	0.108	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.9	178.2	48.2	0	0	0	0	112.6	I189 L215	C179-I189 CarbonylContact C-O 3.56Å; C179-I189 VanDerWaalsContact CA-O 3.25Å; C179-I189 WeakPolarHBondContact CA-O 3.3Å; C179-L215 PolarHBondContact N-O 3Å; C179-L215 VanDerWaalsContact N-O 3.11Å; C179-L215 PolarHBondContact O-N 3.23Å; C179-L215 WeakPolarHBondContact SG-CB 3.29Å; C179-L215 VanDerWaalsContact SG-CD1 3.52Å
180	L	86	Confident	81.3	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.2	173.9	-173.4	71.9	0	0	0	107.9	I189 L191 M197 A200 F201 F212 R213 V214	L180-I189 HydrophobicContact CB-CB 4.28Å; L180-I189 PolarHBondContact N-O 3.31Å; L180-I189 PolarHBondContact O-N 2.9Å; L180-L191 HydrophobicContact CB-CD1 3.99Å; L180-L191 HydrophobicContact CB-CD2 4.09Å; L180-L191 HydrophobicContact CB-CG 4.02Å; L180-M197 HydrophobicContact CD1-CG 4.31Å; L180-M197 HydrophobicContact CD2-CG 4.19Å; L180-A200 HydrophobicContact CD2-CB 4.37Å; L180-F201 HydrophobicContact CD1-CZ 4.13Å; L180-F201 HydrophobicContact CD2-CE1 4.18Å; L180-F201 HydrophobicContact CD2-CZ 4.12Å; L180-F212 HydrophobicContact CD1-CB 3.82Å; L180-F212 HydrophobicContact CD1-CD1 4.12Å; L180-F212 HydrophobicContact CD1-CG 4.3Å; L180-F212 HydrophobicContact CD2-CD1 4.09Å; L180-F212 HydrophobicContact CD2-CE1 4.32Å; L180-F212 HydrophobicContact CG-CB 4.49Å; L180-F212 HydrophobicContact CG-CD1 3.88Å; L180-R213 WeakPolarHBondContact CA-O 3.33Å; L180-V214 HydrophobicContact CD1-CG2 3.73Å
181	V	86.4	Confident	80.2	Confident	12 Å²	12	68 Å²	68	7%	0.073	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125	-178.4	-168	0	0	0	0	108.4	N188 F212 R213 L215	V181-N188 WeakPolarHBondContact CG2-OD1 3.4Å; V181-F212 CarbonylContact O-C 3.59Å; V181-F212 WeakPolarHBondContact O-CA 3.32Å; V181-R213 HydrophobicContact CB-CB 4.33Å; V181-R213 PolarHBondContact N-O 2.91Å; V181-R213 PolarHBondContact O-N 3.01Å; V181-L215 HydrophobicContact CG2-CD1 3.95Å; V181-L215 HydrophobicContact CG2-CG 4.27Å
182	K	83	Confident	79	Confident	77 Å²	77	72.6 Å²	72.6	34%	0.335	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	132.5	173.7	-178.5	177.8	173.2	171.4	0	109.2	G184 S185 M206 V210 F212	K182-G184 PolarHBondContact O-N 3.03Å; K182-S185 PolarHBondContact O-N 2.85Å; K182-S185 VanDerWaalsContact O-O 3.14Å; K182-M206 HydrophobicContact CD-CE 3.74Å; K182-M206 HydrophobicContact CG-CE 4.47Å; K182-M206 PolarHBondContact NZ-SD 2.81Å; K182-M206 VanDerWaalsContact NZ-SD 3.4Å; K182-V210 HydrophobicContact CG-CG1 4.35Å; K182-F212 HydrophobicContact CB-CD1 3.93Å; K182-F212 HydrophobicContact CB-CE1 3.72Å; K182-F212 HydrophobicContact CD-CE1 4.49Å; K182-F212 HydrophobicContact CG-CD1 4.45Å; K182-F212 HydrophobicContact CG-CE1 4.1Å; K182-F212 HydrophobicContact CG-CZ 4.44Å
183	E	79.8	Confident	77.7	Confident	90 Å²	90	73.6 Å²	73.6	42%	0.421	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	125.2	175	-173.8	176.3	-135.9	0	0	110.5	L211 H249	E183-L211 HydrophobicContact CB-CB 3.96Å; E183-L211 VanDerWaalsContact CB-O 3.27Å; E183-L211 WeakPolarHBondContact CB-O 3.42Å; E183-L211 PolarHBondContact N-O 3.15Å; E183-L211 VanDerWaalsContact OE2-CB 3.28Å; E183-L211 WeakPolarHBondContact OE2-CB 3.49Å; E183-H249 IonicContact OE2-CE1 3.34Å
184	G	76.1	Confident	76.6	Confident	90 Å²	90	74.9 Å²	74.9	93%	0.928	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-1.8	-175.6	0	0	0	0	0	115.9	K182	K182-G184 PolarHBondContact O-N 3.03Å
185	S	77.4	Confident	75.9	Confident	36 Å²	36	74.1 Å²	74.1	25%	0.252	43%	0.427	S	S	.	.			trans	-115.6	147.6	169	-176.5	0	0	0	0	111.2	K182 D187	K182-S185 PolarHBondContact O-N 2.85Å; K182-S185 VanDerWaalsContact O-O 3.14Å; S185-D187 VanDerWaalsContact C-N 3.29Å; S185-D187 WeakPolarHBondContact OG-CB 3.47Å; S185-D187 PolarHBondContact OG-N 3.39Å; S185-D187 VanDerWaalsContact OG-N 3.07Å; S185-D187 PolarHBondContact OG-OD2 3.45Å
186	E	68.9	Low	75.2	Confident	183 Å²	183	75.3 Å²	75.3	86%	0.855	42%	0.422	S	S	*	.			trans	-86.1	-0.9	169.9	-65	-168.3	165.7	0	0	112.7	N188	E186-N188 PolarHBondContact O-N 3.14Å; E186-N188 VanDerWaalsContact O-N 3.08Å
187	D	69.6	Low	74.8	Confident	120 Å²	120	73.1 Å²	73.1	64%	0.642	40%	0.399	S	S	*	.			trans	-68.6	107.8	-179.4	-62.8	-39.9	0	0	0	111.1	S185	S185-D187 VanDerWaalsContact C-N 3.29Å; S185-D187 WeakPolarHBondContact OG-CB 3.47Å; S185-D187 PolarHBondContact OG-N 3.39Å; S185-D187 VanDerWaalsContact OG-N 3.07Å; S185-D187 PolarHBondContact OG-OD2 3.45Å
188	N	72.5	Confident	74.2	Confident	109 Å²	109	67.1 Å²	67.1	58%	0.583	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	114.3	176.4	-66.1	-34.1	0	0	0	110.1	V181 E186	V181-N188 WeakPolarHBondContact CG2-OD1 3.4Å; E186-N188 PolarHBondContact O-N 3.14Å; E186-N188 VanDerWaalsContact O-N 3.08Å
189	I	76	Confident	73.1	Confident	82 Å²	82	70 Å²	70	42%	0.421	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	120.6	173.6	-56	170.7	0	0	0	108.4	C179 L180 L191	C179-I189 CarbonylContact C-O 3.56Å; C179-I189 VanDerWaalsContact CA-O 3.25Å; C179-I189 WeakPolarHBondContact CA-O 3.3Å; L180-I189 HydrophobicContact CB-CB 4.28Å; L180-I189 PolarHBondContact N-O 3.31Å; L180-I189 PolarHBondContact O-N 2.9Å; I189-L191 PolarHBondContact O-N 2.87Å
190	S	74.9	Confident	72.1	Confident	74 Å²	74	70.2 Å²	70.2	52%	0.517	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	131.4	176.1	66.7	0	0	0	0	111.3
191	L	70.8	Confident	71.1	Confident	9 Å²	9	71.9 Å²	71.9	5%	0.047	40%	0.398	C	S	.	.			trans	-101.6	89.9	-178.3	-71.3	171.1	0	0	0	110.4	K178 L180 I189 M197 V214	K178-L191 HydrophobicContact CB-CB 3.87Å; K178-L191 WeakPolarHBondContact CB-O 3.35Å; K178-L191 PolarHBondContact O-N 2.89Å; L180-L191 HydrophobicContact CB-CD1 3.99Å; L180-L191 HydrophobicContact CB-CD2 4.09Å; L180-L191 HydrophobicContact CB-CG 4.02Å; I189-L191 PolarHBondContact O-N 2.87Å; L191-M197 HydrophobicContact CD1-CE 3.54Å; L191-M197 HydrophobicContact CD2-CB 3.89Å; L191-M197 HydrophobicContact CD2-CE 4Å; L191-M197 HydrophobicContact CD2-CG 3.93Å; L191-M197 HydrophobicContact CG-CE 4.42Å; L191-V214 HydrophobicContact CD1-CG1 3.99Å
192	D	67	Low	69.6	Low	121 Å²	121	76.8 Å²	76.8	65%	0.647	43%	0.432	S	S	*	.	S	Bend	trans	-84.4	-28.5	172	-54.5	-43.5	0	0	0	112.2	K196	D192-K196 IonicContact OD2-NZ 2.76Å; D192-K196 PolarHBondContact OD2-NZ 3.49Å
193	S	63.9	Low	68.3	Low	45 Å²	45	77.4 Å²	77.4	32%	0.315	45%	0.446	S	S	.	.			trans	-145.5	151	176.4	78.4	0	0	0	0	112.2	D195 K196	S193-D195 PolarHBondContact O-N 3.47Å; S193-K196 WeakPolarHBondContact O-CB 3.42Å; S193-K196 PolarHBondContact O-N 3.05Å
194	I	66.1	Low	67.1	Low	42 Å²	42	78.1 Å²	78.1	22%	0.215	45%	0.449	C	S	.	.	H	α-helix	trans	-60.5	-31.1	176.4	-58.8	166.5	0	0	0	110.7	K154 P157 K196 M197 A198	K154-I194 HydrophobicContact CB-CD1 3.35Å; K154-I194 HydrophobicContact CD-CD1 4.45Å; K154-I194 WeakPolarHBondContact O-CD1 3.44Å; P157-I194 HydrophobicContact CB-CG2 4.37Å; P157-I194 HydrophobicContact CG-CG2 4.23Å; I194-K196 VanDerWaalsContact C-N 3.28Å; I194-K196 PolarHBondContact O-N 3.48Å; I194-M197 WeakPolarHBondContact O-CA 3.23Å; I194-M197 WeakPolarHBondContact O-CB 3.36Å; I194-M197 PolarHBondContact O-N 3.1Å; I194-A198 PolarHBondContact O-N 2.98Å
195	D	66.1	Low	66.1	Low	105 Å²	105	83.8 Å²	83.8	56%	0.561	45%	0.452	S	S	*	.	H	α-helix	trans	-63.8	-35	179.8	-50.6	-48.8	0	0	0	111.7	S193 M197 A198 H199	S193-D195 PolarHBondContact O-N 3.47Å; D195-M197 VanDerWaalsContact C-N 3.28Å; D195-M197 PolarHBondContact O-N 3.41Å; D195-A198 PolarHBondContact O-N 3.05Å; D195-H199 WeakPolarHBondContact O-CB 3.45Å; D195-H199 PolarHBondContact O-CD2 3.01Å; D195-H199 PolarHBondContact O-N 3.35Å
196	K	66.2	Low	65.4	Low	100 Å²	100	84.2 Å²	84.2	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-63.4	-37.3	172	-67.6	-175.8	-179.1	-176.6	0	111.3	D192 S193 I194 H199 A200	D192-K196 IonicContact OD2-NZ 2.76Å; D192-K196 PolarHBondContact OD2-NZ 3.49Å; S193-K196 WeakPolarHBondContact O-CB 3.42Å; S193-K196 PolarHBondContact O-N 3.05Å; I194-K196 VanDerWaalsContact C-N 3.28Å; I194-K196 PolarHBondContact O-N 3.48Å; K196-H199 PolarHBondContact O-N 2.98Å; K196-A200 WeakPolarHBondContact O-CB 3.41Å; K196-A200 PolarHBondContact O-N 3.19Å
197	M	67.9	Low	65.3	Low	3 Å²	3	77.2 Å²	77.2	2%	0.015	43%	0.427	C	S	.	.	H	α-helix	trans	-65.4	-48.7	176	-151	-160.7	-83.9	0	0	110.7	V155 P157 L180 L191 I194 D195 H199 A200 F201 V214	V155-M197 WeakPolarHBondContact O-CE 3.39Å; P157-M197 HydrophobicContact CG-SD 4.29Å; L180-M197 HydrophobicContact CD1-CG 4.31Å; L180-M197 HydrophobicContact CD2-CG 4.19Å; L191-M197 HydrophobicContact CD1-CE 3.54Å; L191-M197 HydrophobicContact CD2-CB 3.89Å; L191-M197 HydrophobicContact CD2-CE 4Å; L191-M197 HydrophobicContact CD2-CG 3.93Å; L191-M197 HydrophobicContact CG-CE 4.42Å; I194-M197 WeakPolarHBondContact O-CA 3.23Å; I194-M197 WeakPolarHBondContact O-CB 3.36Å; I194-M197 PolarHBondContact O-N 3.1Å; D195-M197 VanDerWaalsContact C-N 3.28Å; D195-M197 PolarHBondContact O-N 3.41Å; M197-H199 VanDerWaalsContact C-N 3.31Å; M197-H199 PolarHBondContact O-N 2.9Å; M197-A200 PolarHBondContact O-N 3.44Å; M197-F201 HydrophobicContact CB-CE2 4.22Å; M197-F201 HydrophobicContact CG-CD2 4.33Å; M197-F201 HydrophobicContact CG-CE2 3.36Å; M197-F201 HydrophobicContact CG-CZ 3.62Å; M197-F201 WeakPolarHBondContact O-CD2 3.45Å; M197-F201 WeakPolarHBondContact O-CE2 3.3Å; M197-F201 WeakPolarHBondContact O-CG 3.35Å; M197-F201 PolarHBondContact O-N 2.83Å; M197-F201 HydrophobicContact SD-CE2 3.69Å; M197-F201 HydrophobicContact SD-CZ 3.99Å; M197-V214 HydrophobicContact CE-CB 4.45Å; M197-V214 HydrophobicContact CE-CG1 3.67Å; M197-V214 HydrophobicContact CE-CG2 3.86Å; M197-V214 HydrophobicContact SD-CG2 4.23Å
198	A	65.8	Low	65.4	Low	15 Å²	15	74 Å²	74	12%	0.124	41%	0.408	C	S	.	.	H	α-helix	trans	-59.1	-41.2	176.6	0	0	0	0	0	112.2	P157 I194 D195 F201 C202	P157-A198 HydrophobicContact CG-CB 4.44Å; I194-A198 PolarHBondContact O-N 2.98Å; D195-A198 PolarHBondContact O-N 3.05Å; A198-F201 PolarHBondContact O-N 3.37Å; A198-C202 PolarHBondContact O-N 2.98Å; A198-C202 VanDerWaalsContact O-N 3.15Å; A198-C202 PolarHBondContact O-SG 3.5Å; A198-C202 VanDerWaalsContact O-SG 3.42Å
199	H	64.4	Low	65.6	Low	139 Å²	139	70.7 Å²	70.7	64%	0.644	39%	0.391	S	S	*	.	H	α-helix	trans	-66.8	-39.1	175.2	-93.7	-67.8	0	0	0	113.6	D195 K196 M197 F201 C202 S203	D195-H199 WeakPolarHBondContact O-CB 3.45Å; D195-H199 PolarHBondContact O-CD2 3.01Å; D195-H199 PolarHBondContact O-N 3.35Å; K196-H199 PolarHBondContact O-N 2.98Å; M197-H199 VanDerWaalsContact C-N 3.31Å; M197-H199 PolarHBondContact O-N 2.9Å; H199-F201 VanDerWaalsContact C-N 3.26Å; H199-F201 PolarHBondContact O-N 2.68Å; H199-C202 PolarHBondContact O-N 3.26Å; H199-S203 WeakPolarHBondContact O-CB 3.5Å; H199-S203 PolarHBondContact O-N 2.73Å; H199-S203 VanDerWaalsContact O-N 3.16Å; H199-S203 PolarHBondContact O-OG 3.2Å
200	A	65.5	Low	66	Low	22 Å²	22	67.9 Å²	67.9	18%	0.182	38%	0.377	C	S	.	.	H	α-helix	trans	-60.6	-37.1	176.5	0	0	0	0	0	111.7	L180 K196 M197 S203	L180-A200 HydrophobicContact CD2-CB 4.37Å; K196-A200 WeakPolarHBondContact O-CB 3.41Å; K196-A200 PolarHBondContact O-N 3.19Å; M197-A200 PolarHBondContact O-N 3.44Å; A200-S203 PolarHBondContact O-OG 3.19Å
201	F	64	Low	66.6	Low	35 Å²	35	64.5 Å²	64.5	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-76.7	-29.6	177.5	-57.2	-49.2	0	0	0	114.1	P157 L168 L180 M197 A198 H199 F212	P157-F201 HydrophobicContact CG-CE2 4.42Å; L168-F201 HydrophobicContact CD1-CE2 4.11Å; L168-F201 HydrophobicContact CD1-CZ 4.29Å; L168-F201 HydrophobicContact CD2-CE1 3.69Å; L168-F201 HydrophobicContact CD2-CE2 3.9Å; L168-F201 HydrophobicContact CD2-CZ 3.26Å; L168-F201 HydrophobicContact CG-CZ 4.43Å; L180-F201 HydrophobicContact CD1-CZ 4.13Å; L180-F201 HydrophobicContact CD2-CE1 4.18Å; L180-F201 HydrophobicContact CD2-CZ 4.12Å; M197-F201 HydrophobicContact CB-CE2 4.22Å; M197-F201 HydrophobicContact CG-CD2 4.33Å; M197-F201 HydrophobicContact CG-CE2 3.36Å; M197-F201 HydrophobicContact CG-CZ 3.62Å; M197-F201 WeakPolarHBondContact O-CD2 3.45Å; M197-F201 WeakPolarHBondContact O-CE2 3.3Å; M197-F201 WeakPolarHBondContact O-CG 3.35Å; M197-F201 PolarHBondContact O-N 2.83Å; M197-F201 HydrophobicContact SD-CE2 3.69Å; M197-F201 HydrophobicContact SD-CZ 3.99Å; A198-F201 PolarHBondContact O-N 3.37Å; H199-F201 VanDerWaalsContact C-N 3.26Å; H199-F201 PolarHBondContact O-N 2.68Å; F201-F212 HydrophobicContact CD1-CD2 4.26Å; F201-F212 AromaticContact CD1-CE2 4Å; F201-F212 HydrophobicContact CD1-CE2 4Å; F201-F212 HydrophobicContact CD1-CZ 4.38Å; F201-F212 HydrophobicContact CE1-CB 4.36Å; F201-F212 HydrophobicContact CE1-CD1 4.35Å; F201-F212 AromaticContact CE1-CD2 3.64Å; F201-F212 HydrophobicContact CE1-CD2 3.64Å; F201-F212 HydrophobicContact CE1-CE1 4.48Å; F201-F212 AromaticContact CE1-CE2 3.78Å; F201-F212 HydrophobicContact CE1-CE2 3.78Å; F201-F212 AromaticContact CE1-CG 3.89Å; F201-F212 HydrophobicContact CE1-CG 3.89Å; F201-F212 HydrophobicContact CE1-CZ 4.17Å
202	C	56.7	Low	67.4	Low	115 Å²	115	64.5 Å²	64.5	78%	0.777	35%	0.353	S	S	*	.	H	α-helix	trans	-78.2	-19.8	177.3	-73.6	0	0	0	0	113.7	A198 H199	A198-C202 PolarHBondContact O-N 2.98Å; A198-C202 VanDerWaalsContact O-N 3.15Å; A198-C202 PolarHBondContact O-SG 3.5Å; A198-C202 VanDerWaalsContact O-SG 3.42Å; H199-C202 PolarHBondContact O-N 3.26Å
203	S	55	Low	68.5	Low	91 Å²	91	63 Å²	63	64%	0.636	34%	0.338	S	S	*	.	S	Bend	trans	-95.9	-9.3	-169.5	50.8	0	0	0	0	115.2	H199 A200	H199-S203 WeakPolarHBondContact O-CB 3.5Å; H199-S203 PolarHBondContact O-N 2.73Å; H199-S203 VanDerWaalsContact O-N 3.16Å; H199-S203 PolarHBondContact O-OG 3.2Å; A200-S203 PolarHBondContact O-OG 3.19Å
204	Q	54.9	Low	69.8	Low	104 Å²	104	60.9 Å²	60.9	49%	0.486	32%	0.323	S	S	.	.	S	Bend	trans	-118.7	132.4	-179.3	-63.3	-172.4	-14.8	0	0	110.8	M206	Q204-M206 VanDerWaalsContact C-N 3.25Å; Q204-M206 HydrophobicContact CB-CG 3.35Å; Q204-M206 HydrophobicContact CB-SD 4.21Å; Q204-M206 PolarHBondContact O-N 3.31Å
205	E	53.8	Low	71	Confident	210 Å²	210	60.2 Å²	60.2	98%	0.981	32%	0.32	S	S	*	.			trans	-65.8	87.4	164.9	-72.1	-170.8	164.7	0	0	108.5
206	M	63.9	Low	72.2	Confident	45 Å²	45	56 Å²	56	22%	0.222	30%	0.296	C	S	.	.			trans	-112.1	132.3	-173.6	-69.6	-79.2	-93.5	0	0	110.1	K182 Q204 V210 F212	K182-M206 HydrophobicContact CD-CE 3.74Å; K182-M206 HydrophobicContact CG-CE 4.47Å; K182-M206 PolarHBondContact NZ-SD 2.81Å; K182-M206 VanDerWaalsContact NZ-SD 3.4Å; Q204-M206 VanDerWaalsContact C-N 3.25Å; Q204-M206 HydrophobicContact CB-CG 3.35Å; Q204-M206 HydrophobicContact CB-SD 4.21Å; Q204-M206 PolarHBondContact O-N 3.31Å; M206-V210 HydrophobicContact CE-CG1 3.83Å; M206-F212 HydrophobicContact CE-CE1 4.28Å; M206-F212 HydrophobicContact CE-CE2 3.49Å; M206-F212 VanDerWaalsContact CE-CE2 3.49Å; M206-F212 HydrophobicContact CE-CZ 3.21Å
207	G	67.1	Low	73.3	Confident	36 Å²	36	51.6 Å²	51.6	37%	0.371	28%	0.278	S	S	.	.			trans	-61	150.3	173.3	0	0	0	0	0	111.9	D209 V210	G207-D209 PolarHBondContact O-N 2.85Å; G207-V210 WeakPolarHBondContact O-CB 3.39Å; G207-V210 WeakPolarHBondContact O-CG2 3.49Å; G207-V210 PolarHBondContact O-N 3.32Å
208	E	71.9	Confident	74.4	Confident	51 Å²	51	54.7 Å²	54.7	24%	0.238	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-15.2	-174.8	-59	173	-173.2	0	0	112.7	R165 F167 V238 T239 W245	R165-E208 WeakPolarHBondContact O-CA 3.34Å; F167-E208 WeakPolarHBondContact CD2-O 3.34Å; E208-V238 VanDerWaalsContact CD-CG1 3.44Å; E208-V238 WeakPolarHBondContact OE1-CG1 3.5Å; E208-V238 WeakPolarHBondContact OE2-CG1 3.41Å; E208-T239 WeakPolarHBondContact OE2-CB 3.35Å; E208-T239 WeakPolarHBondContact OE2-CG2 3.43Å; E208-W245 HydrophobicContact CB-CZ2 3.99Å
209	D	76.5	Confident	75.5	Confident	41 Å²	41	59.9 Å²	59.9	22%	0.219	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.9	177	75.4	-55.2	0	0	0	113.4	G207 K248 H249	G207-D209 PolarHBondContact O-N 2.85Å; D209-K248 PolarHBondContact O-NZ 3.41Å; D209-K248 IonicContact OD2-NZ 2.74Å; D209-K248 PolarHBondContact OD2-NZ 3.26Å; D209-H249 PolarHBondContact O-NE2 3.08Å
210	V	84.3	Confident	76.5	Confident	22 Å²	22	56 Å²	56	13%	0.133	31%	0.306	C	S	.	.			trans	-76.7	135.1	179.9	179.6	0	0	0	0	110.5	C166 F167 K182 M206 G207 F212	C166-V210 WeakPolarHBondContact CB-O 3.47Å; F167-V210 PolarHBondContact N-O 3.38Å; K182-V210 HydrophobicContact CG-CG1 4.35Å; M206-V210 HydrophobicContact CE-CG1 3.83Å; G207-V210 WeakPolarHBondContact O-CB 3.39Å; G207-V210 WeakPolarHBondContact O-CG2 3.49Å; G207-V210 PolarHBondContact O-N 3.32Å; V210-F212 HydrophobicContact CG1-CD2 4.28Å; V210-F212 HydrophobicContact CG1-CE2 4.07Å
211	L	87.3	Confident	77.7	Confident	4 Å²	4	55.3 Å²	55.3	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.9	174.6	-172.6	68.7	0	0	0	110.9	F167 Q169 E183 V231	F167-L211 HydrophobicContact CB-CB 4.44Å; F167-L211 HydrophobicContact CB-CD1 3.37Å; F167-L211 HydrophobicContact CG-CD1 4.44Å; F167-L211 WeakPolarHBondContact O-CA 3.5Å; Q169-L211 HydrophobicContact CB-CD1 3.77Å; Q169-L211 HydrophobicContact CB-CD2 4.4Å; Q169-L211 HydrophobicContact CB-CG 4.23Å; E183-L211 HydrophobicContact CB-CB 3.96Å; E183-L211 VanDerWaalsContact CB-O 3.27Å; E183-L211 WeakPolarHBondContact CB-O 3.42Å; E183-L211 PolarHBondContact N-O 3.15Å; E183-L211 VanDerWaalsContact OE2-CB 3.28Å; E183-L211 WeakPolarHBondContact OE2-CB 3.49Å; L211-V231 HydrophobicContact CD1-CG1 4.46Å
212	F	87.8	Confident	79	Confident	9 Å²	9	59.4 Å²	59.4	4%	0.039	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132	165.5	-75	-91.1	0	0	0	110.6	C166 F167 L168 Q169 L180 V181 K182 F201 M206 V210	C166-F212 HydrophobicContact CB-CD2 4.42Å; F167-F212 PolarHBondContact O-N 2.87Å; L168-F212 HydrophobicContact CD2-CB 3.99Å; Q169-F212 PolarHBondContact N-O 3.48Å; L180-F212 HydrophobicContact CD1-CB 3.82Å; L180-F212 HydrophobicContact CD1-CD1 4.12Å; L180-F212 HydrophobicContact CD1-CG 4.3Å; L180-F212 HydrophobicContact CD2-CD1 4.09Å; L180-F212 HydrophobicContact CD2-CE1 4.32Å; L180-F212 HydrophobicContact CG-CB 4.49Å; L180-F212 HydrophobicContact CG-CD1 3.88Å; V181-F212 CarbonylContact O-C 3.59Å; V181-F212 WeakPolarHBondContact O-CA 3.32Å; K182-F212 HydrophobicContact CB-CD1 3.93Å; K182-F212 HydrophobicContact CB-CE1 3.72Å; K182-F212 HydrophobicContact CD-CE1 4.49Å; K182-F212 HydrophobicContact CG-CD1 4.45Å; K182-F212 HydrophobicContact CG-CE1 4.1Å; K182-F212 HydrophobicContact CG-CZ 4.44Å; F201-F212 HydrophobicContact CD1-CD2 4.26Å; F201-F212 AromaticContact CD1-CE2 4Å; F201-F212 HydrophobicContact CD1-CE2 4Å; F201-F212 HydrophobicContact CD1-CZ 4.38Å; F201-F212 HydrophobicContact CE1-CB 4.36Å; F201-F212 HydrophobicContact CE1-CD1 4.35Å; F201-F212 AromaticContact CE1-CD2 3.64Å; F201-F212 HydrophobicContact CE1-CD2 3.64Å; F201-F212 HydrophobicContact CE1-CE1 4.48Å; F201-F212 AromaticContact CE1-CE2 3.78Å; F201-F212 HydrophobicContact CE1-CE2 3.78Å; F201-F212 AromaticContact CE1-CG 3.89Å; F201-F212 HydrophobicContact CE1-CG 3.89Å; F201-F212 HydrophobicContact CE1-CZ 4.17Å; M206-F212 HydrophobicContact CE-CE1 4.28Å; M206-F212 HydrophobicContact CE-CE2 3.49Å; M206-F212 VanDerWaalsContact CE-CE2 3.49Å; M206-F212 HydrophobicContact CE-CZ 3.21Å; V210-F212 HydrophobicContact CG1-CD2 4.28Å; V210-F212 HydrophobicContact CG1-CE2 4.07Å
213	R	90.1	Very high	80.8	Confident	89 Å²	89	54.3 Å²	54.3	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.6	173.3	-63.8	170.9	64.7	-149.5	-1.6	109.2	Q169 E171 L180 V181	Q169-R213 CarbonylContact O-C 3.44Å; Q169-R213 VanDerWaalsContact O-CA 3.31Å; Q169-R213 WeakPolarHBondContact O-CA 3.28Å; E171-R213 IonicContact OE1-CZ 2.97Å; E171-R213 IonicContact OE1-NE 3.25Å; E171-R213 PolarHBondContact OE1-NE 3.35Å; E171-R213 IonicContact OE1-NH2 3.68Å; E171-R213 IonicContact OE2-CZ 3.85Å; E171-R213 IonicContact OE2-NE 3.3Å; E171-R213 PolarHBondContact OE2-NE 2.99Å; E171-R213 IonicContact OE2-NH2 3.78Å; E171-R213 PolarHBondContact OE2-NH2 3.45Å; L180-R213 WeakPolarHBondContact CA-O 3.33Å; V181-R213 HydrophobicContact CB-CB 4.33Å; V181-R213 PolarHBondContact N-O 2.91Å; V181-R213 PolarHBondContact O-N 3.01Å
214	V	90.7	Very high	82.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	96.2	172.6	-176.7	0	0	0	0	107.3	V155 L156 Q169 V170 E171 L180 L191 M197 W216	V155-V214 HydrophobicContact CG1-CG1 3.87Å; L156-V214 HydrophobicContact CD2-CG2 4.28Å; Q169-V214 PolarHBondContact O-N 3.48Å; V170-V214 WeakPolarHBondContact CA-O 3.21Å; V170-V214 HydrophobicContact CG2-CB 4.28Å; E171-V214 PolarHBondContact N-O 3.07Å; L180-V214 HydrophobicContact CD1-CG2 3.73Å; L191-V214 HydrophobicContact CD1-CG1 3.99Å; M197-V214 HydrophobicContact CE-CB 4.45Å; M197-V214 HydrophobicContact CE-CG1 3.67Å; M197-V214 HydrophobicContact CE-CG2 3.86Å; M197-V214 HydrophobicContact SD-CG2 4.23Å; V214-W216 HydrophobicContact CG1-CE3 4.39Å; V214-W216 PolarHBondContact O-N 3.03Å
215	L	90.3	Very high	84.4	Confident	29 Å²	29	51 Å²	51	15%	0.152	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.3	176.3	-63.7	-172.9	0	0	0	108.8	E171 K178 C179 V181	E171-L215 HydrophobicContact CB-CD2 4.01Å; K178-L215 WeakPolarHBondContact CA-O 3.32Å; C179-L215 PolarHBondContact N-O 3Å; C179-L215 VanDerWaalsContact N-O 3.11Å; C179-L215 PolarHBondContact O-N 3.23Å; C179-L215 WeakPolarHBondContact SG-CB 3.29Å; C179-L215 VanDerWaalsContact SG-CD1 3.52Å; V181-L215 HydrophobicContact CG2-CD1 3.95Å; V181-L215 HydrophobicContact CG2-CG 4.27Å
216	W	91.3	Very high	86.3	Confident	15 Å²	15	41.5 Å²	41.5	6%	0.057	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.3	-175.3	-161.7	-88.4	0	0	0	111.4	V155 V170 E171 G172 S173 K178 V214 K218 D220 L224	V155-W216 HydrophobicContact CB-CE3 4.5Å; V155-W216 HydrophobicContact CG1-CD2 4.1Å; V155-W216 HydrophobicContact CG1-CE3 3.79Å; V155-W216 HydrophobicContact CG1-CZ3 4.15Å; V155-W216 HydrophobicContact CG2-CD2 3.98Å; V155-W216 HydrophobicContact CG2-CE3 4.31Å; V155-W216 HydrophobicContact CG2-CG 4.43Å; V155-W216 HydrophobicContact CG2-CH2 4.34Å; V155-W216 HydrophobicContact CG2-CZ2 4.09Å; V155-W216 HydrophobicContact CG2-CZ3 4.47Å; V170-W216 HydrophobicContact CG1-CB 4.27Å; E171-W216 PolarHBondContact O-N 3.42Å; G172-W216 CarbonylContact C-O 3.6Å; G172-W216 WeakPolarHBondContact CA-O 3.34Å; S173-W216 PolarHBondContact N-O 3.32Å; K178-W216 HydrophobicContact CB-CE3 4.39Å; K178-W216 HydrophobicContact CB-CZ3 4.44Å; K178-W216 HydrophobicContact CD-CD2 4.43Å; K178-W216 HydrophobicContact CD-CE3 4.01Å; K178-W216 HydrophobicContact CD-CH2 3.6Å; K178-W216 HydrophobicContact CD-CZ2 3.98Å; K178-W216 HydrophobicContact CD-CZ3 3.6Å; K178-W216 VanDerWaalsContact CE-CH2 3.49Å; K178-W216 HydrophobicContact CG-CD2 4.24Å; K178-W216 HydrophobicContact CG-CE3 3.89Å; K178-W216 HydrophobicContact CG-CH2 4.38Å; K178-W216 HydrophobicContact CG-CZ3 3.98Å; K178-W216 VanDerWaalsContact NZ-CZ2 3.35Å; V214-W216 HydrophobicContact CG1-CE3 4.39Å; V214-W216 PolarHBondContact O-N 3.03Å; W216-K218 PolarHBondContact O-N 3.45Å; W216-D220 PolarHBondContact NE1-OD2 2.76Å; W216-L224 HydrophobicContact CB-CD1 3.77Å; W216-L224 HydrophobicContact CG-CD1 4.16Å
217	P	91.1	Very high	87.7	Confident	8 Å²	8	41.4 Å²	41.4	5%	0.052	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	128.7	-179.4	-28.6	35.6	0	0	0	113.4	G176 K178 T219 D220	G176-P217 WeakPolarHBondContact O-CG 3.3Å; K178-P217 HydrophobicContact CG-CG 4.21Å; P217-T219 PolarHBondContact O-N 3.33Å; P217-D220 PolarHBondContact O-N 3.27Å; P217-D220 VanDerWaalsContact O-N 3.17Å
218	K	90.6	Very high	89.1	Confident	68 Å²	68	39.8 Å²	39.8	30%	0.296	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-58.2	-28.9	176.4	-73.4	-171.4	177.7	-168.4	0	113.1	G172 S173 W216 D220 S221	G172-K218 WeakPolarHBondContact O-CE 3.28Å; S173-K218 PolarHBondContact O-N 2.96Å; W216-K218 PolarHBondContact O-N 3.45Å; K218-D220 PolarHBondContact O-N 2.84Å; K218-S221 VanDerWaalsContact O-O 3.1Å
219	T	88	Confident	90.3	Very high	125 Å²	125	37.7 Å²	37.7	77%	0.767	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-67.2	-21.2	-179.6	49.3	0	0	0	0	113.9	P217	P217-T219 PolarHBondContact O-N 3.33Å
220	D	86	Confident	91.2	Very high	56 Å²	56	35.7 Å²	35.7	30%	0.299	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-86.3	-18.3	-171.3	-71.3	8.8	0	0	0	113.1	W216 P217 K218 K350	W216-D220 PolarHBondContact NE1-OD2 2.76Å; P217-D220 PolarHBondContact O-N 3.27Å; P217-D220 VanDerWaalsContact O-N 3.17Å; K218-D220 PolarHBondContact O-N 2.84Å; D220-K350 PolarHBondContact O-NZ 3.44Å; D220-K350 VanDerWaalsContact O-NZ 3.16Å
221	S	90.3	Very high	91.8	Very high	8 Å²	8	34.7 Å²	34.7	6%	0.056	17%	0.165	C	C	.	.			trans	-144.4	127.3	-174.2	171.5	0	0	0	0	111.9	L151 K218 L223 L224 Q225	L151-S221 WeakPolarHBondContact CD2-OG 3.18Å; K218-S221 VanDerWaalsContact O-O 3.1Å; S221-L223 PolarHBondContact O-N 3.36Å; S221-L223 PolarHBondContact OG-N 3.17Å; S221-L224 PolarHBondContact O-N 3.09Å; S221-Q225 PolarHBondContact O-N 2.94Å
222	R	91.5	Very high	92.1	Very high	122 Å²	122	34.5 Å²	34.5	46%	0.46	16%	0.164	S	C	.	.	H	α-helix	trans	-57.2	-36.2	173.2	172	178.4	156.1	152.3	-4.4	112.2	N226 E379	R222-N226 PolarHBondContact O-N 3.29Å; R222-N226 PolarHBondContact O-ND2 3.22Å; R222-E379 IonicContact CZ-OE1 3.2Å; R222-E379 IonicContact CZ-OE2 3.69Å; R222-E379 IonicContact NE-OE1 3.31Å; R222-E379 PolarHBondContact NE-OE1 3.16Å; R222-E379 IonicContact NE-OE2 2.75Å; R222-E379 IonicContact NH2-OE1 2.94Å; R222-E379 PolarHBondContact NH2-OE1 3.05Å; R222-E379 IonicContact NH2-OE2 3.07Å; R222-E379 PolarHBondContact NH2-OE2 3.47Å
223	L	94.6	Very high	92.2	Very high	8 Å²	8	34 Å²	34	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-46.9	179.1	-63	-178.1	0	0	0	110.7	L43 M150 S221 Q225 N226 E227 V228 L230 F378	L43-L223 HydrophobicContact CD1-CD2 3.57Å; M150-L223 HydrophobicContact CB-CD1 3.92Å; M150-L223 HydrophobicContact CE-CD1 3.98Å; S221-L223 PolarHBondContact O-N 3.36Å; S221-L223 PolarHBondContact OG-N 3.17Å; L223-Q225 PolarHBondContact O-N 3.29Å; L223-N226 CarbonylContact O-C 3.54Å; L223-N226 PolarHBondContact O-N 3.48Å; L223-E227 PolarHBondContact O-N 3.24Å; L223-V228 HydrophobicContact CB-CB 4.06Å; L223-V228 HydrophobicContact CB-CG2 4.43Å; L223-V228 HydrophobicContact CD2-CG2 4.43Å; L223-V228 WeakPolarHBondContact O-CB 3.47Å; L223-V228 PolarHBondContact O-N 3.38Å; L223-L230 HydrophobicContact CD1-CD2 4.15Å; L223-F378 HydrophobicContact CD2-CE1 4.43Å
224	L	93.7	Very high	92.2	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-68.6	-35.1	179.7	-58.1	-176.5	0	0	0	112.3	L151 V170 W216 S221 N226 E227 V228 L230	L151-L224 HydrophobicContact CD2-CD1 4.27Å; L151-L224 HydrophobicContact CD2-CD2 4.1Å; L151-L224 HydrophobicContact CD2-CG 3.92Å; V170-L224 HydrophobicContact CG1-CD1 4.28Å; V170-L224 HydrophobicContact CG1-CD2 4.13Å; W216-L224 HydrophobicContact CB-CD1 3.77Å; W216-L224 HydrophobicContact CG-CD1 4.16Å; S221-L224 PolarHBondContact O-N 3.09Å; L224-N226 VanDerWaalsContact C-N 3.25Å; L224-N226 PolarHBondContact O-N 2.96Å; L224-E227 PolarHBondContact O-N 3.27Å; L224-V228 WeakPolarHBondContact CD2-O 3.14Å; L224-L230 HydrophobicContact CD2-CD1 3.93Å
225	Q	92.3	Very high	92	Very high	122 Å²	122	29.9 Å²	29.9	57%	0.57	15%	0.147	S	C	*	.	H	α-helix	trans	-60	-38.3	173.8	-170.4	179	13.4	0	0	111.7	S221 L223 E227	S221-Q225 PolarHBondContact O-N 2.94Å; L223-Q225 PolarHBondContact O-N 3.29Å; Q225-E227 VanDerWaalsContact C-N 3.33Å; Q225-E227 PolarHBondContact O-N 2.79Å
226	N	93.7	Very high	91.8	Very high	11 Å²	11	28.7 Å²	28.7	6%	0.059	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	28.3	179.6	-60.9	-65.8	0	0	0	113.2	L43 Q44 V47 M131 R222 L223 L224 V228	L43-N226 HydrophobicContact CB-CB 3.55Å; L43-N226 HydrophobicContact CD1-CB 4.16Å; Q44-N226 WeakPolarHBondContact CG-OD1 3.46Å; V47-N226 HydrophobicContact CG2-CB 4.14Å; M131-N226 WeakPolarHBondContact CE-O 3.46Å; R222-N226 PolarHBondContact O-N 3.29Å; R222-N226 PolarHBondContact O-ND2 3.22Å; L223-N226 CarbonylContact O-C 3.54Å; L223-N226 PolarHBondContact O-N 3.48Å; L224-N226 VanDerWaalsContact C-N 3.25Å; L224-N226 PolarHBondContact O-N 2.96Å; N226-V228 VanDerWaalsContact C-N 3.32Å; N226-V228 PolarHBondContact O-N 2.96Å
227	E	93.4	Very high	91.4	Very high	44 Å²	44	31.5 Å²	31.5	21%	0.206	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	35.6	172.7	-52.5	-166.5	137.4	0	0	115.1	K50 H130 M131 L223 L224 Q225	K50-E227 WeakPolarHBondContact CD-OE2 3.49Å; K50-E227 WeakPolarHBondContact CE-OE2 3.34Å; K50-E227 IonicContact NZ-OE1 3.23Å; K50-E227 PolarHBondContact NZ-OE1 3.1Å; K50-E227 IonicContact NZ-OE2 2.73Å; K50-E227 PolarHBondContact NZ-OE2 2.9Å; H130-E227 HydrophobicContact CB-CB 4.39Å; H130-E227 WeakPolarHBondContact CB-O 3.31Å; M131-E227 PolarHBondContact N-O 3.26Å; L223-E227 PolarHBondContact O-N 3.24Å; L224-E227 PolarHBondContact O-N 3.27Å; Q225-E227 VanDerWaalsContact C-N 3.33Å; Q225-E227 PolarHBondContact O-N 2.79Å
228	V	96.1	Very high	90.7	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.5	166.6	-176.7	0	0	0	0	109.4	L43 M131 V133 L223 L224 N226 L230 F378 I382	L43-V228 HydrophobicContact CD1-CG2 4.01Å; L43-V228 HydrophobicContact CD2-CG2 3.93Å; M131-V228 HydrophobicContact CB-CG2 4.19Å; M131-V228 HydrophobicContact CE-CG2 3.77Å; M131-V228 CarbonylContact O-C 3.5Å; M131-V228 WeakPolarHBondContact O-CA 3.3Å; M131-V228 HydrophobicContact SD-CG2 4.42Å; V133-V228 HydrophobicContact CG1-CG1 4.19Å; L223-V228 HydrophobicContact CB-CB 4.06Å; L223-V228 HydrophobicContact CB-CG2 4.43Å; L223-V228 HydrophobicContact CD2-CG2 4.43Å; L223-V228 WeakPolarHBondContact O-CB 3.47Å; L223-V228 PolarHBondContact O-N 3.38Å; L224-V228 WeakPolarHBondContact CD2-O 3.14Å; N226-V228 VanDerWaalsContact C-N 3.32Å; N226-V228 PolarHBondContact O-N 2.96Å; V228-L230 HydrophobicContact CG1-CD1 4.18Å; V228-L230 HydrophobicContact CG1-CG 4.37Å; V228-F378 HydrophobicContact CG1-CZ 4.31Å; V228-I382 HydrophobicContact CG1-CD1 4.16Å
229	V	96	Very high	89.8	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129	173.9	174.4	0	0	0	0	108.8	H130 M131 V133 Q169 V170 E171 V231	H130-V229 HydrophobicContact CB-CG2 4.1Å; H130-V229 WeakPolarHBondContact CD2-CG2 3.45Å; M131-V229 PolarHBondContact O-N 3.45Å; V133-V229 WeakPolarHBondContact CG1-O 2.95Å; V133-V229 PolarHBondContact N-O 3Å; Q169-V229 HydrophobicContact CG-CG1 3.35Å; V170-V229 WeakPolarHBondContact O-CA 3.33Å; E171-V229 HydrophobicContact CB-CG2 4.47Å; E171-V229 HydrophobicContact CG-CB 4.48Å; E171-V229 HydrophobicContact CG-CG1 3.87Å; E171-V229 HydrophobicContact CG-CG2 3.87Å; V229-V231 HydrophobicContact CG1-CG2 4.42Å
230	L	97.1	Very high	89	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	122.1	-176	-58.8	88.7	0	0	0	109.7	V133 F135 V147 M150 L151 Q169 V170 L223 L224 V228	V133-L230 HydrophobicContact CG1-CB 4.24Å; V133-L230 HydrophobicContact CG1-CD2 4.44Å; V133-L230 HydrophobicContact CG1-CG 3.88Å; F135-L230 HydrophobicContact CE2-CB 4.12Å; F135-L230 HydrophobicContact CE2-CD2 4.04Å; F135-L230 HydrophobicContact CE2-CG 4.39Å; F135-L230 HydrophobicContact CZ-CD2 4.26Å; V147-L230 HydrophobicContact CG1-CB 4.26Å; V147-L230 HydrophobicContact CG1-CD2 4.13Å; M150-L230 HydrophobicContact CB-CD2 4.5Å; L151-L230 HydrophobicContact CD2-CD1 3.87Å; L151-L230 HydrophobicContact CD2-CD2 4.35Å; L151-L230 HydrophobicContact CG-CD2 4.33Å; Q169-L230 CarbonylContact C-O 3.58Å; Q169-L230 WeakPolarHBondContact CA-O 3.43Å; V170-L230 HydrophobicContact CB-CB 4.49Å; V170-L230 PolarHBondContact N-O 3.3Å; V170-L230 PolarHBondContact O-N 3.45Å; V170-L230 VanDerWaalsContact O-N 3.12Å; L223-L230 HydrophobicContact CD1-CD2 4.15Å; L224-L230 HydrophobicContact CD2-CD1 3.93Å; V228-L230 HydrophobicContact CG1-CD1 4.18Å; V228-L230 HydrophobicContact CG1-CG 4.37Å
231	V	95.4	Very high	88.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114.8	-179.8	-175.6	0	0	0	0	109.8	K132 V133 V134 F135 F167 L168 Q169 L211 V229	K132-V231 HydrophobicContact CG-CG2 4.32Å; V133-V231 PolarHBondContact O-N 3.28Å; V134-V231 WeakPolarHBondContact CA-O 3.48Å; V134-V231 HydrophobicContact CB-CB 4.35Å; V134-V231 HydrophobicContact CG1-CB 4.04Å; V134-V231 HydrophobicContact CG1-CG1 4.06Å; V134-V231 HydrophobicContact CG2-CB 4.11Å; V134-V231 HydrophobicContact CG2-CG2 4.41Å; F135-V231 WeakPolarHBondContact CD2-O 3.43Å; F135-V231 PolarHBondContact N-O 3.21Å; F167-V231 HydrophobicContact CD1-CG1 3.76Å; L168-V231 CarbonylContact O-C 3.59Å; L168-V231 WeakPolarHBondContact O-CA 3.4Å; Q169-V231 HydrophobicContact CB-CG2 4.1Å; Q169-V231 HydrophobicContact CG-CG2 3.98Å; L211-V231 HydrophobicContact CD1-CG1 4.46Å; V229-V231 HydrophobicContact CG1-CG2 4.42Å
232	D	93.4	Very high	87.6	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.8	170.6	-172.4	30	0	0	0	109.6	K143 S144 V147 L156 T164 F167 L168	K143-D232 WeakPolarHBondContact CB-OD1 3.45Å; S144-D232 WeakPolarHBondContact CB-OD2 3.4Å; S144-D232 PolarHBondContact OG-OD2 3.36Å; V147-D232 HydrophobicContact CG2-CB 4.48Å; L156-D232 HydrophobicContact CD1-CB 3.57Å; T164-D232 PolarHBondContact OG1-OD2 2.75Å; F167-D232 WeakPolarHBondContact CA-O 3.08Å; L168-D232 HydrophobicContact CB-CB 4.37Å; L168-D232 PolarHBondContact N-O 3.39Å; L168-D232 PolarHBondContact O-N 3.46Å
233	S	91.7	Very high	87	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-85.6	160.4	179.6	83.7	0	0	0	0	112	F135 F136 K143	F135-S233 WeakPolarHBondContact O-CB 3.31Å; F135-S233 PolarHBondContact O-N 3.32Å; F135-S233 VanDerWaalsContact O-N 3.15Å; F135-S233 PolarHBondContact O-OG 3.37Å; F136-S233 WeakPolarHBondContact CD1-OG 3.43Å; F136-S233 VanDerWaalsContact CE1-CB 3.43Å; K143-S233 WeakPolarHBondContact CE-O 3.44Å
234	P	88.3	Confident	86.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-61.3	165.8	160.6	-10.9	24.1	0	0	0	111.2	T164 R165 F167 I236 W245	T164-P234 WeakPolarHBondContact O-CA 3.45Å; R165-P234 WeakPolarHBondContact O-CG 3.41Å; F167-P234 HydrophobicContact CD2-CG 4.03Å; F167-P234 HydrophobicContact CE2-CG 4.02Å; P234-I236 PolarHBondContact O-N 3.1Å; P234-W245 HydrophobicContact CB-CH2 3.6Å; P234-W245 HydrophobicContact CB-CZ2 4.02Å; P234-W245 HydrophobicContact CB-CZ3 4.36Å; P234-W245 HydrophobicContact CG-CH2 3.77Å; P234-W245 HydrophobicContact CG-CZ2 3.83Å; P234-W245 HydrophobicContact CG-CZ3 4.37Å
235	G	87.6	Confident	86.1	Confident	1 Å²	1	36 Å²	36	1%	0.01	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-60.4	131.8	174.3	0	0	0	0	0	111.8	D237 V238	G235-D237 PolarHBondContact O-N 2.86Å; G235-V238 WeakPolarHBondContact O-CB 3.48Å; G235-V238 VanDerWaalsContact O-CG2 3.23Å; G235-V238 WeakPolarHBondContact O-CG2 3.36Å; G235-V238 PolarHBondContact O-N 3.2Å; G235-V238 VanDerWaalsContact O-N 3.08Å
236	I	86.6	Confident	85.7	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.021	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.5	178.1	62.6	152.6	0	0	0	113.6	F136 G137 R138 P234 F242 A269 E270	F136-I236 HydrophobicContact CB-CG2 4.46Å; F136-I236 HydrophobicContact CD1-CG2 4.18Å; G137-I236 PolarHBondContact O-N 2.86Å; R138-I236 HydrophobicContact CB-CG1 4.5Å; R138-I236 HydrophobicContact CG-CD1 3.96Å; R138-I236 HydrophobicContact CG-CG1 3.78Å; P234-I236 PolarHBondContact O-N 3.1Å; I236-F242 HydrophobicContact CB-CE1 4.2Å; I236-F242 VanDerWaalsContact O-CE1 3.3Å; I236-F242 WeakPolarHBondContact O-CE1 3.44Å; I236-F242 VanDerWaalsContact O-CZ 3.32Å; I236-F242 WeakPolarHBondContact O-CZ 3.46Å; I236-A269 HydrophobicContact CD1-CB 3.96Å; I236-E270 HydrophobicContact CD1-CB 3.99Å; I236-E270 HydrophobicContact CD1-CG 3.26Å; I236-E270 HydrophobicContact CG1-CG 4.42Å
237	D	81.9	Confident	85.3	Confident	75 Å²	75	33.7 Å²	33.7	40%	0.401	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3	178.8	53.1	-38.5	0	0	0	113	T139 G235	T139-D237 PolarHBondContact N-OD1 3.35Å; T139-D237 PolarHBondContact OG1-OD1 3.48Å; G235-D237 PolarHBondContact O-N 2.86Å
238	V	75.9	Confident	85	Confident	60 Å²	60	36 Å²	36	36%	0.364	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-41.9	-176.9	-172.4	0	0	0	0	111.6	E208 G235	E208-V238 VanDerWaalsContact CD-CG1 3.44Å; E208-V238 WeakPolarHBondContact OE1-CG1 3.5Å; E208-V238 WeakPolarHBondContact OE2-CG1 3.41Å; G235-V238 WeakPolarHBondContact O-CB 3.48Å; G235-V238 VanDerWaalsContact O-CG2 3.23Å; G235-V238 WeakPolarHBondContact O-CG2 3.36Å; G235-V238 PolarHBondContact O-N 3.2Å; G235-V238 VanDerWaalsContact O-N 3.08Å
239	T	72.5	Confident	84.6	Confident	19 Å²	19	36.1 Å²	36.1	12%	0.117	19%	0.189	C	C	.	.			trans	-139.6	145	179.9	-179	0	0	0	0	112.9	E208 Q241 F242 W245	E208-T239 WeakPolarHBondContact OE2-CB 3.35Å; E208-T239 WeakPolarHBondContact OE2-CG2 3.43Å; T239-Q241 VanDerWaalsContact C-N 3.27Å; T239-Q241 PolarHBondContact O-N 3.08Å; T239-Q241 PolarHBondContact OG1-N 3.15Å; T239-F242 WeakPolarHBondContact O-CE1 3.26Å; T239-W245 HydrophobicContact CG2-CH2 3.87Å; T239-W245 HydrophobicContact CG2-CZ2 3.28Å
240	P	70.1	Confident	84.2	Confident	101 Å²	101	35.8 Å²	35.8	66%	0.656	19%	0.187	S	C	*	.	S	Bend	trans	-78.8	-2.7	171.6	32.2	-35	0	0	0	114.1	F242	P240-F242 VanDerWaalsContact C-N 3.29Å; P240-F242 PolarHBondContact O-N 3.36Å
241	Q	71.9	Confident	83.8	Confident	122 Å²	122	39.9 Å²	39.9	57%	0.57	21%	0.209	S	C	*	.			trans	-84.3	55.7	-173.7	-66	178.1	-18.5	0	0	113.7	T239 D243	T239-Q241 VanDerWaalsContact C-N 3.27Å; T239-Q241 PolarHBondContact O-N 3.08Å; T239-Q241 PolarHBondContact OG1-N 3.15Å; Q241-D243 VanDerWaalsContact C-N 3.28Å; Q241-D243 PolarHBondContact O-N 3.27Å
242	F	76.7	Confident	83.5	Confident	16 Å²	16	43.4 Å²	43.4	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-25.7	-176	-56.1	-47	0	0	0	114.8	I236 T239 P240 E244 W245 I246 F273	I236-F242 HydrophobicContact CB-CE1 4.2Å; I236-F242 VanDerWaalsContact O-CE1 3.3Å; I236-F242 WeakPolarHBondContact O-CE1 3.44Å; I236-F242 VanDerWaalsContact O-CZ 3.32Å; I236-F242 WeakPolarHBondContact O-CZ 3.46Å; T239-F242 WeakPolarHBondContact O-CE1 3.26Å; P240-F242 VanDerWaalsContact C-N 3.29Å; P240-F242 PolarHBondContact O-N 3.36Å; F242-E244 PolarHBondContact O-N 3.48Å; F242-W245 PolarHBondContact O-N 3.24Å; F242-I246 VanDerWaalsContact O-CG1 3.27Å; F242-I246 WeakPolarHBondContact O-CG1 3.34Å; F242-I246 PolarHBondContact O-N 3.42Å; F242-I246 VanDerWaalsContact O-N 3.1Å; F242-F273 HydrophobicContact CB-CD2 3.79Å; F242-F273 HydrophobicContact CB-CE2 4.1Å; F242-F273 AromaticContact CD1-CD2 3.58Å; F242-F273 HydrophobicContact CD1-CD2 3.58Å; F242-F273 HydrophobicContact CD1-CE2 4.17Å; F242-F273 HydrophobicContact CD2-CD2 4.3Å; F242-F273 HydrophobicContact CE1-CD2 4.2Å; F242-F273 AromaticContact CG-CD2 3.63Å; F242-F273 HydrophobicContact CG-CD2 3.63Å; F242-F273 HydrophobicContact CG-CE2 4.33Å
243	D	78.1	Confident	83.5	Confident	70 Å²	70	44.1 Å²	44.1	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-67.8	-40.2	-171.6	-62.1	-30.2	0	0	0	112	Q241 I246 D247 R276 K280	Q241-D243 VanDerWaalsContact C-N 3.28Å; Q241-D243 PolarHBondContact O-N 3.27Å; D243-I246 PolarHBondContact O-N 3.11Å; D243-D247 PolarHBondContact O-N 3.18Å; D243-R276 WeakPolarHBondContact OD1-CD 3.33Å; D243-R276 IonicContact OD1-CZ 2.67Å; D243-R276 IonicContact OD1-NE 3.1Å; D243-R276 IonicContact OD1-NH1 3.19Å; D243-R276 PolarHBondContact OD1-NH1 3.38Å; D243-R276 IonicContact OD2-CZ 3.79Å; D243-R276 IonicContact OD2-NH1 2.67Å; D243-R276 PolarHBondContact OD2-NH1 3.23Å; D243-K280 PolarHBondContact O-NZ 2.88Å
244	E	84.3	Confident	83.7	Confident	99 Å²	99	44.5 Å²	44.5	46%	0.463	24%	0.235	S	C	.	.	H	α-helix	trans	-66.1	-40	178.1	-175.3	170	-164.9	0	0	111.6	F242 I246 D247 K248	F242-E244 PolarHBondContact O-N 3.48Å; E244-I246 VanDerWaalsContact C-N 3.32Å; E244-I246 PolarHBondContact O-N 3.15Å; E244-D247 PolarHBondContact O-N 3.41Å; E244-K248 VanDerWaalsContact O-CB 3.31Å; E244-K248 WeakPolarHBondContact O-CB 3.48Å; E244-K248 PolarHBondContact O-N 3.41Å
245	W	85.6	Confident	84.1	Confident	5 Å²	5	44.5 Å²	44.5	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-42.4	173.9	-71.9	12.9	0	0	0	112	F136 F167 E208 P234 T239 F242 H249	F136-W245 HydrophobicContact CE1-CE3 4.21Å; F167-W245 HydrophobicContact CE2-CB 4.2Å; F167-W245 AromaticContact CE2-CD1 3.94Å; F167-W245 AromaticContact CE2-CD2 3.55Å; F167-W245 HydrophobicContact CE2-CD2 3.55Å; F167-W245 AromaticContact CE2-CE2 3.82Å; F167-W245 AromaticContact CE2-CE3 3.99Å; F167-W245 HydrophobicContact CE2-CE3 3.99Å; F167-W245 AromaticContact CE2-CG 3.65Å; F167-W245 HydrophobicContact CE2-CG 3.65Å; F167-W245 HydrophobicContact CE2-CZ2 4.48Å; F167-W245 HydrophobicContact CZ-CB 3.85Å; F167-W245 AromaticContact CZ-CD2 3.56Å; F167-W245 HydrophobicContact CZ-CD2 3.56Å; F167-W245 AromaticContact CZ-CE3 3.59Å; F167-W245 HydrophobicContact CZ-CE3 3.59Å; F167-W245 AromaticContact CZ-CG 3.7Å; F167-W245 HydrophobicContact CZ-CG 3.7Å; F167-W245 HydrophobicContact CZ-CZ3 4.35Å; E208-W245 HydrophobicContact CB-CZ2 3.99Å; P234-W245 HydrophobicContact CB-CH2 3.6Å; P234-W245 HydrophobicContact CB-CZ2 4.02Å; P234-W245 HydrophobicContact CB-CZ3 4.36Å; P234-W245 HydrophobicContact CG-CH2 3.77Å; P234-W245 HydrophobicContact CG-CZ2 3.83Å; P234-W245 HydrophobicContact CG-CZ3 4.37Å; T239-W245 HydrophobicContact CG2-CH2 3.87Å; T239-W245 HydrophobicContact CG2-CZ2 3.28Å; F242-W245 PolarHBondContact O-N 3.24Å; W245-H249 PolarHBondContact O-N 3.34Å
246	I	82.5	Confident	84.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-45.7	-179.4	-61.9	162.5	0	0	0	110.1	F242 D243 E244 K248 C250 L251 F273 R276 V277 K280	F242-I246 VanDerWaalsContact O-CG1 3.27Å; F242-I246 WeakPolarHBondContact O-CG1 3.34Å; F242-I246 PolarHBondContact O-N 3.42Å; F242-I246 VanDerWaalsContact O-N 3.1Å; D243-I246 PolarHBondContact O-N 3.11Å; E244-I246 VanDerWaalsContact C-N 3.32Å; E244-I246 PolarHBondContact O-N 3.15Å; I246-K248 PolarHBondContact O-N 3.03Å; I246-C250 HydrophobicContact CB-CB 4.41Å; I246-C250 HydrophobicContact CG2-CB 4.06Å; I246-C250 WeakPolarHBondContact O-CB 3.41Å; I246-C250 PolarHBondContact O-N 3.48Å; I246-C250 VanDerWaalsContact O-N 3.08Å; I246-L251 HydrophobicContact CG2-CD2 4.45Å; I246-L251 PolarHBondContact O-N 3.5Å; I246-F273 HydrophobicContact CD1-CE2 4.26Å; I246-F273 HydrophobicContact CG1-CE2 4.09Å; I246-F273 HydrophobicContact CG1-CZ 4.14Å; I246-R276 HydrophobicContact CD1-CB 3.72Å; I246-V277 HydrophobicContact CD1-CG2 3.85Å; I246-V277 HydrophobicContact CG1-CG2 4.08Å; I246-K280 HydrophobicContact CB-CD 4.1Å; I246-K280 HydrophobicContact CG2-CB 4.2Å; I246-K280 HydrophobicContact CG2-CD 3.61Å; I246-K280 HydrophobicContact CG2-CG 4.41Å
247	D	85.9	Confident	85	Confident	83 Å²	83	44.3 Å²	44.3	44%	0.444	23%	0.234	S	C	.	.	H	α-helix	trans	-63.4	-41.1	-178.6	-73	-24.8	0	0	0	112.5	D243 E244 L251 K280	D243-D247 PolarHBondContact O-N 3.18Å; E244-D247 PolarHBondContact O-N 3.41Å; D247-L251 WeakPolarHBondContact O-CD1 3.46Å; D247-K280 WeakPolarHBondContact OD1-CD 3.41Å; D247-K280 WeakPolarHBondContact OD1-CE 3.37Å; D247-K280 IonicContact OD1-NZ 3.46Å; D247-K280 PolarHBondContact OD1-NZ 3.11Å; D247-K280 IonicContact OD2-NZ 2.77Å; D247-K280 PolarHBondContact OD2-NZ 2.65Å
248	K	87.1	Confident	85.7	Confident	93 Å²	93	40.8 Å²	40.8	40%	0.404	22%	0.215	S	C	.	.	H	α-helix	trans	-80.8	-40.6	-174.2	-160.4	176.5	177.2	-170.6	0	112.8	D209 E244 I246	D209-K248 PolarHBondContact O-NZ 3.41Å; D209-K248 IonicContact OD2-NZ 2.74Å; D209-K248 PolarHBondContact OD2-NZ 3.26Å; E244-K248 VanDerWaalsContact O-CB 3.31Å; E244-K248 WeakPolarHBondContact O-CB 3.48Å; E244-K248 PolarHBondContact O-N 3.41Å; I246-K248 PolarHBondContact O-N 3.03Å
249	H	88.2	Confident	86.6	Confident	3 Å²	3	37.9 Å²	37.9	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-120.3	-11.5	-164.7	-61	-48.9	0	0	0	115.5	K132 F167 E183 D209 W245	K132-H249 WeakPolarHBondContact CE-O 3.49Å; K132-H249 PolarHBondContact NZ-O 3.48Å; F167-H249 HydrophobicContact CD1-CB 4.31Å; F167-H249 AromaticContact CD2-CD2 3.62Å; F167-H249 HydrophobicContact CE1-CB 4.27Å; F167-H249 AromaticContact CE2-CD2 3.78Å; F167-H249 AromaticContact CG-CD2 3.84Å; E183-H249 IonicContact OE2-CE1 3.34Å; D209-H249 PolarHBondContact O-NE2 3.08Å; W245-H249 PolarHBondContact O-N 3.34Å
250	C	88.1	Confident	87.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	-14.8	-166.5	-56.1	0	0	0	0	115.5	F136 I246 D252 A253 F256	F136-C250 VanDerWaalsContact CZ-SG 3.54Å; I246-C250 HydrophobicContact CB-CB 4.41Å; I246-C250 HydrophobicContact CG2-CB 4.06Å; I246-C250 WeakPolarHBondContact O-CB 3.41Å; I246-C250 PolarHBondContact O-N 3.48Å; I246-C250 VanDerWaalsContact O-N 3.08Å; C250-D252 PolarHBondContact O-N 3.36Å; C250-A253 VanDerWaalsContact O-CB 3.24Å; C250-A253 WeakPolarHBondContact O-CB 3.2Å; C250-A253 PolarHBondContact O-N 3.19Å; C250-A253 VanDerWaalsContact O-N 3.13Å; C250-F256 HydrophobicContact CB-CE1 3.84Å; C250-F256 HydrophobicContact CB-CZ 4.04Å
251	L	88	Confident	88.7	Confident	87 Å²	87	33.7 Å²	33.7	46%	0.455	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.7	-174.3	-67.7	179.2	0	0	0	113.7	I246 D247 K280 L281	I246-L251 HydrophobicContact CG2-CD2 4.45Å; I246-L251 PolarHBondContact O-N 3.5Å; D247-L251 WeakPolarHBondContact O-CD1 3.46Å; L251-K280 HydrophobicContact CD2-CB 4.32Å; L251-L281 HydrophobicContact CD2-CD2 4.17Å
252	D	89.3	Confident	89.7	Confident	73 Å²	73	27.9 Å²	27.9	39%	0.39	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7.1	178.8	65.5	-34.3	0	0	0	113.3	K132 C250	K132-D252 WeakPolarHBondContact CD-OD2 3.36Å; K132-D252 IonicContact NZ-OD1 3.72Å; K132-D252 PolarHBondContact NZ-OD1 3.34Å; K132-D252 IonicContact NZ-OD2 2.93Å; K132-D252 PolarHBondContact NZ-OD2 3.5Å; C250-D252 PolarHBondContact O-N 3.36Å
253	A	93.3	Very high	90.2	Very high	15 Å²	15	30.8 Å²	30.8	12%	0.124	16%	0.156	C	C	.	.			trans	-76.1	130.7	-179.7	0	0	0	0	0	111.8	V134 C250 F256	V134-A253 HydrophobicContact CG2-CB 3.68Å; C250-A253 VanDerWaalsContact O-CB 3.24Å; C250-A253 WeakPolarHBondContact O-CB 3.2Å; C250-A253 PolarHBondContact O-N 3.19Å; C250-A253 VanDerWaalsContact O-N 3.13Å; A253-F256 HydrophobicContact CB-CE1 4.08Å; A253-F256 HydrophobicContact CB-CE2 4.03Å; A253-F256 HydrophobicContact CB-CZ 3.66Å
254	D	95.2	Very high	90.5	Very high	8 Å²	8	29.7 Å²	29.7	4%	0.043	16%	0.157	C	C	.	.	S	Bend	trans	-84.2	-32	177.4	-60.3	-65.9	0	0	0	111.7	M131 K132 N285 I382 S385 A386 T389 K390	M131-D254 WeakPolarHBondContact CA-OD2 3.28Å; K132-D254 PolarHBondContact N-OD2 2.95Å; K132-D254 PolarHBondContact O-N 3.1Å; D254-N285 PolarHBondContact O-ND2 3Å; D254-I382 HydrophobicContact CB-CG1 3.9Å; D254-S385 PolarHBondContact O-OG 3.47Å; D254-A386 HydrophobicContact CB-CB 4.47Å; D254-A386 WeakPolarHBondContact OD1-CA 3.34Å; D254-T389 PolarHBondContact OD1-OG1 3.47Å; D254-K390 VanDerWaalsContact OD1-CE 3.3Å; D254-K390 WeakPolarHBondContact OD1-CE 3.28Å; D254-K390 WeakPolarHBondContact OD2-CE 3.26Å; D254-K390 IonicContact OD2-NZ 3.74Å
255	V	96.6	Very high	90.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.2	-179.2	175.2	0	0	0	0	111.2	K132 V133 V134 V257 N285 F287 F378 I382	K132-V255 PolarHBondContact O-N 3.01Å; V133-V255 VanDerWaalsContact CA-O 3.29Å; V133-V255 WeakPolarHBondContact CA-O 3.43Å; V133-V255 HydrophobicContact CG2-CB 4.33Å; V133-V255 HydrophobicContact CG2-CG1 4.25Å; V134-V255 PolarHBondContact N-O 3.49Å; V255-V257 HydrophobicContact CG1-CG2 4.3Å; V255-N285 HydrophobicContact CG2-CB 4.07Å; V255-F287 HydrophobicContact CG1-CD2 3.56Å; V255-F287 HydrophobicContact CG1-CE2 3.84Å; V255-F378 HydrophobicContact CB-CE2 4.24Å; V255-F378 HydrophobicContact CG1-CD2 4.05Å; V255-F378 HydrophobicContact CG1-CE2 4.05Å; V255-I382 HydrophobicContact CB-CG1 4.44Å; V255-I382 HydrophobicContact CG2-CB 3.73Å; V255-I382 HydrophobicContact CG2-CG1 3.9Å
256	F	96.6	Very high	90.5	Very high	1 Å²	1	28.8 Å²	28.8	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.4	169.4	-63.5	-90.9	0	0	0	110.5	V134 F136 C250 A253 F274 V277 L281 P284 N285 V286 F287	V134-F256 HydrophobicContact CB-CD1 4.24Å; V134-F256 HydrophobicContact CB-CE1 4.4Å; V134-F256 WeakPolarHBondContact O-CA 3.37Å; F136-F256 HydrophobicContact CD2-CD1 4.05Å; F136-F256 AromaticContact CE2-CD1 3.85Å; F136-F256 HydrophobicContact CE2-CD1 3.85Å; F136-F256 HydrophobicContact CE2-CE1 4.04Å; C250-F256 HydrophobicContact CB-CE1 3.84Å; C250-F256 HydrophobicContact CB-CZ 4.04Å; A253-F256 HydrophobicContact CB-CE1 4.08Å; A253-F256 HydrophobicContact CB-CE2 4.03Å; A253-F256 HydrophobicContact CB-CZ 3.66Å; F256-F274 HydrophobicContact CB-CE1 3.62Å; F256-F274 HydrophobicContact CB-CZ 4.14Å; F256-F274 HydrophobicContact CD1-CE1 4.49Å; F256-F274 HydrophobicContact CG-CE1 4.18Å; F256-V277 HydrophobicContact CD1-CG1 4.48Å; F256-V277 HydrophobicContact CD2-CG1 4.26Å; F256-V277 HydrophobicContact CE1-CG1 4.06Å; F256-V277 HydrophobicContact CE2-CG1 3.83Å; F256-V277 HydrophobicContact CZ-CG1 3.71Å; F256-L281 HydrophobicContact CE2-CD1 3.59Å; F256-L281 HydrophobicContact CZ-CD1 3.52Å; F256-P284 HydrophobicContact CD2-CB 3.97Å; F256-P284 HydrophobicContact CE2-CB 3.98Å; F256-N285 PolarHBondContact N-O 3.49Å; F256-V286 HydrophobicContact CB-CG2 4.4Å; F256-V286 CarbonylContact O-C 3.58Å; F256-V286 WeakPolarHBondContact O-CA 3.44Å; F256-F287 PolarHBondContact O-N 3.01Å
257	V	97.4	Very high	90.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	112.9	175.2	-177.2	0	0	0	0	109	V133 V134 F135 F136 V255 V259 F287 L289 F374	V133-V257 HydrophobicContact CG2-CG2 3.68Å; V134-V257 PolarHBondContact O-N 2.97Å; F135-V257 CarbonylContact C-O 3.59Å; F135-V257 WeakPolarHBondContact CA-O 3.49Å; F135-V257 HydrophobicContact CD1-CB 3.58Å; F135-V257 HydrophobicContact CD1-CG1 3.76Å; F135-V257 HydrophobicContact CD1-CG2 4.16Å; F135-V257 HydrophobicContact CE1-CB 3.76Å; F135-V257 HydrophobicContact CE1-CG1 3.85Å; F135-V257 HydrophobicContact CE1-CG2 3.83Å; F135-V257 HydrophobicContact CG-CB 4.31Å; F135-V257 HydrophobicContact CZ-CG2 4.31Å; F136-V257 PolarHBondContact N-O 3.48Å; V255-V257 HydrophobicContact CG1-CG2 4.3Å; V257-V259 HydrophobicContact CG1-CG2 4.21Å; V257-F287 HydrophobicContact CG1-CB 4.48Å; V257-F287 HydrophobicContact CG2-CB 4.28Å; V257-L289 HydrophobicContact CG1-CD1 3.66Å; V257-L289 HydrophobicContact CG1-CG 3.82Å; V257-F374 HydrophobicContact CG1-CZ 4.44Å; V257-F374 HydrophobicContact CG2-CZ 4.39Å
258	L	96.3	Very high	90.9	Very high	1 Å²	1	32 Å²	32	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	114	171.4	174.5	54.3	0	0	0	109.7	F136 L266 E270 F274 F287 I288 L289 F317	F136-L258 CarbonylContact O-C 3.49Å; F136-L258 WeakPolarHBondContact O-CA 3.29Å; L258-L266 HydrophobicContact CD2-CD1 3.58Å; L258-E270 HydrophobicContact CD1-CB 4.18Å; L258-E270 HydrophobicContact CD1-CG 4.01Å; L258-E270 HydrophobicContact CD2-CB 4.33Å; L258-F274 HydrophobicContact CB-CE2 3.63Å; L258-F274 HydrophobicContact CB-CZ 3.79Å; L258-F274 HydrophobicContact CD1-CE2 3.89Å; L258-F274 HydrophobicContact CD2-CD2 4.11Å; L258-F274 HydrophobicContact CD2-CE2 3.95Å; L258-F274 HydrophobicContact CG-CE2 4Å; L258-F287 PolarHBondContact N-O 3.37Å; L258-I288 HydrophobicContact CB-CG1 4.4Å; L258-I288 HydrophobicContact CD2-CG1 4.42Å; L258-I288 WeakPolarHBondContact O-CA 3.38Å; L258-L289 PolarHBondContact O-N 3.21Å; L258-F317 HydrophobicContact CD2-CE1 4.44Å
259	V	96.1	Very high	90.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	104.5	175.5	-171.3	0	0	0	0	109.2	F135 F136 N141 K143 V146 V257 N291	F135-V259 HydrophobicContact CD1-CG2 4.31Å; F136-V259 PolarHBondContact O-N 2.98Å; N141-V259 HydrophobicContact CB-CG1 4.36Å; N141-V259 WeakPolarHBondContact CB-O 3.33Å; N141-V259 PolarHBondContact ND2-O 3.48Å; N141-V259 WeakPolarHBondContact O-CG1 3.25Å; K143-V259 HydrophobicContact CG-CB 4.01Å; K143-V259 HydrophobicContact CG-CG2 4.17Å; V146-V259 HydrophobicContact CG2-CG1 4.02Å; V146-V259 HydrophobicContact CG2-CG2 4.18Å; V257-V259 HydrophobicContact CG1-CG2 4.21Å; V259-N291 HydrophobicContact CG1-CB 3.85Å
260	C	94.6	Very high	90.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.014	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	153.8	176.4	-64.2	0	0	0	0	110.8	L289 N291	C260-L289 PolarHBondContact N-O 3.18Å; C260-N291 WeakPolarHBondContact O-CB 3.46Å; C260-N291 PolarHBondContact O-N 3.47Å
261	N	92	Very high	91	Very high	29 Å²	29	31.5 Å²	31.5	16%	0.155	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	116.6	164.1	-179.7	7.4	0	0	0	108.9	N141 E263 A264	N141-N261 PolarHBondContact ND2-N 2.73Å; N261-E263 PolarHBondContact O-N 3.13Å; N261-E263 WeakPolarHBondContact OD1-CB 3.33Å; N261-E263 PolarHBondContact OD1-N 3.35Å; N261-E263 VanDerWaalsContact OD1-N 3.14Å; N261-A264 CarbonylContact O-C 3.52Å; N261-A264 PolarHBondContact O-N 3.21Å
262	A	91.5	Very high	91.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.6	-176.8	0	0	0	0	0	114.2	A264 N290 N291 W293 C296 H310	A262-A264 PolarHBondContact O-N 3.36Å; A262-N290 HydrophobicContact CB-CB 3.9Å; A262-N291 WeakPolarHBondContact CB-O 3.38Å; A262-N291 PolarHBondContact N-O 3.48Å; A262-W293 HydrophobicContact CB-CE3 3.48Å; A262-W293 VanDerWaalsContact CB-CE3 3.48Å; A262-W293 HydrophobicContact CB-CZ3 4.02Å; A262-C296 PolarHBondContact O-SG 3.17Å; A262-C296 VanDerWaalsContact O-SG 3.33Å; A262-H310 PolarHBondContact O-CE1 2.9Å
263	E	87.8	Confident	91.1	Very high	78 Å²	78	30 Å²	30	36%	0.364	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-18.3	169.4	-64.1	162.1	-139.4	0	0	111.8	N261 R292 V295 C296	N261-E263 PolarHBondContact O-N 3.13Å; N261-E263 WeakPolarHBondContact OD1-CB 3.33Å; N261-E263 PolarHBondContact OD1-N 3.35Å; N261-E263 VanDerWaalsContact OD1-N 3.14Å; E263-R292 IonicContact OE1-CZ 3.61Å; E263-R292 IonicContact OE1-NE 2.72Å; E263-R292 PolarHBondContact OE1-NE 3.41Å; E263-R292 VanDerWaalsContact OE1-NE 3.1Å; E263-R292 IonicContact OE1-NH1 3.89Å; E263-R292 PolarHBondContact OE1-NH1 3.23Å; E263-R292 IonicContact OE1-NH2 3.47Å; E263-R292 PolarHBondContact OE1-NH2 2.88Å; E263-R292 IonicContact OE2-CZ 3.56Å; E263-R292 IonicContact OE2-NH1 3.82Å; E263-R292 IonicContact OE2-NH2 2.72Å; E263-V295 HydrophobicContact CG-CB 4.22Å; E263-V295 HydrophobicContact CG-CG1 4.08Å; E263-V295 WeakPolarHBondContact OE1-CB 3.47Å; E263-V295 WeakPolarHBondContact OE1-CG1 3.45Å; E263-C296 PolarHBondContact N-SG 3.34Å
264	A	84.3	Confident	91	Very high	47 Å²	47	29.4 Å²	29.4	39%	0.388	16%	0.162	S	C	.	.	S	Bend	trans	-125.4	160.2	-179.2	0	0	0	0	0	111.7	N261 A262 H310	N261-A264 CarbonylContact O-C 3.52Å; N261-A264 PolarHBondContact O-N 3.21Å; A262-A264 PolarHBondContact O-N 3.36Å; A264-H310 PolarHBondContact O-CE1 3.1Å
265	T	81.9	Confident	90.7	Very high	65 Å²	65	33.1 Å²	33.1	40%	0.399	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-81.9	153.8	175	63.8	0	0	0	0	111.1	T267	T265-T267 PolarHBondContact O-N 3.13Å
266	L	88.8	Confident	90.4	Very high	20 Å²	20	37.1 Å²	37.1	11%	0.105	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-47.1	122	171.5	-176	69.5	0	0	0	111.3	L258 E270 K271 F317	L258-L266 HydrophobicContact CD2-CD1 3.58Å; L266-E270 HydrophobicContact CD1-CB 3.78Å; L266-K271 HydrophobicContact CD2-CD 4.29Å; L266-K271 HydrophobicContact CD2-CG 3.77Å; L266-K271 HydrophobicContact CG-CG 3.97Å; L266-F317 HydrophobicContact CD2-CB 3.88Å; L266-F317 HydrophobicContact CD2-CD1 3.63Å; L266-F317 HydrophobicContact CD2-CD2 4.19Å; L266-F317 HydrophobicContact CD2-CE1 4.17Å; L266-F317 HydrophobicContact CD2-CG 3.62Å
267	T	89.2	Confident	90.1	Very high	28 Å²	28	37 Å²	37	17%	0.172	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-88.2	155.4	-171.3	65.1	0	0	0	0	111.8	T265 A269 E270 K271	T265-T267 PolarHBondContact O-N 3.13Å; T267-A269 PolarHBondContact O-N 2.96Å; T267-E270 WeakPolarHBondContact CB-OE2 3.34Å; T267-E270 PolarHBondContact N-OE2 3.28Å; T267-E270 PolarHBondContact O-N 3.44Å; T267-E270 VanDerWaalsContact O-N 3.17Å; T267-E270 VanDerWaalsContact OG1-CG 3.27Å; T267-E270 WeakPolarHBondContact OG1-CG 3.41Å; T267-E270 PolarHBondContact OG1-N 2.75Å; T267-E270 PolarHBondContact OG1-OE2 2.66Å; T267-K271 PolarHBondContact O-N 2.67Å
268	N	86.6	Confident	89.7	Confident	122 Å²	122	40.2 Å²	40.2	65%	0.652	21%	0.208	S	C	*	.	H	α-helix	trans	-62.1	-27.2	176.7	-72.9	-22.6	0	0	0	113.1	K272	N268-K272 WeakPolarHBondContact O-CB 3.32Å; N268-K272 VanDerWaalsContact O-CG 3.25Å; N268-K272 WeakPolarHBondContact O-CG 3.42Å; N268-K272 PolarHBondContact O-N 2.82Å
269	A	85.5	Confident	89.3	Confident	40 Å²	40	44.3 Å²	44.3	33%	0.331	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-46.4	174.7	0	0	0	0	0	111.2	I236 T267 K271 K272 F273	I236-A269 HydrophobicContact CD1-CB 3.96Å; T267-A269 PolarHBondContact O-N 2.96Å; A269-K271 VanDerWaalsContact C-N 3.34Å; A269-K271 PolarHBondContact O-N 2.92Å; A269-K272 PolarHBondContact O-N 3.26Å; A269-F273 PolarHBondContact O-N 3.17Å
270	E	90.2	Very high	89	Confident	5 Å²	5	47.6 Å²	47.6	2%	0.023	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-45.7	175.5	-68.4	159	155.6	0	0	110.7	R138 N141 I236 L258 L266 T267 F273 F274	R138-E270 HydrophobicContact CG-CG 4.38Å; N141-E270 PolarHBondContact ND2-OE1 2.82Å; I236-E270 HydrophobicContact CD1-CB 3.99Å; I236-E270 HydrophobicContact CD1-CG 3.26Å; I236-E270 HydrophobicContact CG1-CG 4.42Å; L258-E270 HydrophobicContact CD1-CB 4.18Å; L258-E270 HydrophobicContact CD1-CG 4.01Å; L258-E270 HydrophobicContact CD2-CB 4.33Å; L266-E270 HydrophobicContact CD1-CB 3.78Å; T267-E270 WeakPolarHBondContact CB-OE2 3.34Å; T267-E270 PolarHBondContact N-OE2 3.28Å; T267-E270 PolarHBondContact O-N 3.44Å; T267-E270 VanDerWaalsContact O-N 3.17Å; T267-E270 VanDerWaalsContact OG1-CG 3.27Å; T267-E270 WeakPolarHBondContact OG1-CG 3.41Å; T267-E270 PolarHBondContact OG1-N 2.75Å; T267-E270 PolarHBondContact OG1-OE2 2.66Å; E270-F273 PolarHBondContact O-N 3.03Å; E270-F274 PolarHBondContact O-N 3.37Å
271	K	90.7	Very high	88.5	Confident	41 Å²	41	49 Å²	49	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-50.1	176.9	-67.6	-171.6	169.9	-162	0	112.6	L266 T267 A269 F273 F274 Q275 F317 E321	L266-K271 HydrophobicContact CD2-CD 4.29Å; L266-K271 HydrophobicContact CD2-CG 3.77Å; L266-K271 HydrophobicContact CG-CG 3.97Å; T267-K271 PolarHBondContact O-N 2.67Å; A269-K271 VanDerWaalsContact C-N 3.34Å; A269-K271 PolarHBondContact O-N 2.92Å; K271-F273 VanDerWaalsContact C-N 3.31Å; K271-F273 PolarHBondContact O-N 3.24Å; K271-F274 PolarHBondContact O-N 2.99Å; K271-Q275 WeakPolarHBondContact O-CG 3.33Å; K271-Q275 PolarHBondContact O-N 3.18Å; K271-F317 HydrophobicContact CB-CD2 4.37Å; K271-F317 HydrophobicContact CB-CE2 3.74Å; K271-F317 HydrophobicContact CB-CZ 4.28Å; K271-F317 HydrophobicContact CD-CD2 4.14Å; K271-F317 HydrophobicContact CD-CE2 4.34Å; K271-F317 HydrophobicContact CG-CD2 3.82Å; K271-F317 HydrophobicContact CG-CE2 3.63Å; K271-F317 HydrophobicContact CG-CZ 4.2Å; K271-E321 IonicContact NZ-OE1 2.58Å; K271-E321 PolarHBondContact NZ-OE1 2.65Å; K271-E321 IonicContact NZ-OE2 2.71Å
272	K	89.1	Confident	88	Confident	129 Å²	129	53.4 Å²	53.4	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-61.1	-37.7	-179.3	-78.9	179.1	-179.6	-175.3	0	112.6	N268 A269 Q275 R276	N268-K272 WeakPolarHBondContact O-CB 3.32Å; N268-K272 VanDerWaalsContact O-CG 3.25Å; N268-K272 WeakPolarHBondContact O-CG 3.42Å; N268-K272 PolarHBondContact O-N 2.82Å; A269-K272 PolarHBondContact O-N 3.26Å; K272-Q275 PolarHBondContact O-N 2.91Å; K272-R276 WeakPolarHBondContact O-CG 3.39Å; K272-R276 PolarHBondContact O-N 3.23Å
273	F	89	Confident	87.8	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-59.1	-52.8	176.6	176.9	-95.6	0	0	0	111.2	F136 F242 I246 A269 E270 K271 Q275 R276 V277	F136-F273 HydrophobicContact CB-CD1 4.44Å; F136-F273 HydrophobicContact CB-CE1 4.12Å; F136-F273 HydrophobicContact CD1-CD1 4.35Å; F136-F273 AromaticContact CD1-CE1 3.61Å; F136-F273 HydrophobicContact CD1-CE1 3.61Å; F136-F273 HydrophobicContact CD1-CE2 4.11Å; F136-F273 AromaticContact CD1-CZ 3.49Å; F136-F273 HydrophobicContact CD1-CZ 3.49Å; F136-F273 VanDerWaalsContact CD1-CZ 3.49Å; F136-F273 AromaticContact CD2-CE1 3.48Å; F136-F273 HydrophobicContact CD2-CE1 3.48Å; F136-F273 VanDerWaalsContact CD2-CE1 3.48Å; F136-F273 AromaticContact CD2-CZ 3.84Å; F136-F273 HydrophobicContact CD2-CZ 3.84Å; F136-F273 AromaticContact CE1-CE1 3.85Å; F136-F273 HydrophobicContact CE1-CE1 3.85Å; F136-F273 AromaticContact CE1-CE2 3.85Å; F136-F273 HydrophobicContact CE1-CE2 3.85Å; F136-F273 AromaticContact CE1-CZ 3.25Å; F136-F273 HydrophobicContact CE1-CZ 3.25Å; F136-F273 AromaticContact CE2-CE1 3.69Å; F136-F273 HydrophobicContact CE2-CE1 3.69Å; F136-F273 AromaticContact CE2-CZ 3.59Å; F136-F273 HydrophobicContact CE2-CZ 3.59Å; F136-F273 HydrophobicContact CG-CD1 4.19Å; F136-F273 AromaticContact CG-CE1 3.43Å; F136-F273 HydrophobicContact CG-CE1 3.43Å; F136-F273 VanDerWaalsContact CG-CE1 3.43Å; F136-F273 AromaticContact CG-CZ 3.79Å; F136-F273 HydrophobicContact CG-CZ 3.79Å; F136-F273 AromaticContact CZ-CE1 3.9Å; F136-F273 HydrophobicContact CZ-CE1 3.9Å; F136-F273 HydrophobicContact CZ-CE2 4.24Å; F136-F273 AromaticContact CZ-CZ 3.32Å; F136-F273 HydrophobicContact CZ-CZ 3.32Å; F242-F273 HydrophobicContact CB-CD2 3.79Å; F242-F273 HydrophobicContact CB-CE2 4.1Å; F242-F273 AromaticContact CD1-CD2 3.58Å; F242-F273 HydrophobicContact CD1-CD2 3.58Å; F242-F273 HydrophobicContact CD1-CE2 4.17Å; F242-F273 HydrophobicContact CD2-CD2 4.3Å; F242-F273 HydrophobicContact CE1-CD2 4.2Å; F242-F273 AromaticContact CG-CD2 3.63Å; F242-F273 HydrophobicContact CG-CD2 3.63Å; F242-F273 HydrophobicContact CG-CE2 4.33Å; I246-F273 HydrophobicContact CD1-CE2 4.26Å; I246-F273 HydrophobicContact CG1-CE2 4.09Å; I246-F273 HydrophobicContact CG1-CZ 4.14Å; A269-F273 PolarHBondContact O-N 3.17Å; E270-F273 PolarHBondContact O-N 3.03Å; K271-F273 VanDerWaalsContact C-N 3.31Å; K271-F273 PolarHBondContact O-N 3.24Å; F273-Q275 VanDerWaalsContact C-N 3.33Å; F273-Q275 PolarHBondContact O-N 3.17Å; F273-R276 WeakPolarHBondContact O-CA 3.42Å; F273-R276 WeakPolarHBondContact O-CB 3.35Å; F273-R276 PolarHBondContact O-N 2.93Å; F273-V277 HydrophobicContact CD1-CG2 4.07Å; F273-V277 HydrophobicContact CE1-CG2 3.53Å; F273-V277 HydrophobicContact CZ-CG2 3.82Å; F273-V277 PolarHBondContact O-N 3.1Å
274	F	90.9	Very high	88.1	Confident	1 Å²	1	56.8 Å²	56.8	0%	0.004	31%	0.311	C	S	.	.	H	α-helix	trans	-71.2	-26	-178.6	-84.5	-84.2	0	0	0	113.9	F136 F256 L258 E270 K271 R276 V277 K278 V286 F317 L322	F136-F274 HydrophobicContact CB-CE2 4.16Å; F136-F274 HydrophobicContact CB-CZ 4.26Å; F136-F274 HydrophobicContact CD2-CZ 4.49Å; F256-F274 HydrophobicContact CB-CE1 3.62Å; F256-F274 HydrophobicContact CB-CZ 4.14Å; F256-F274 HydrophobicContact CD1-CE1 4.49Å; F256-F274 HydrophobicContact CG-CE1 4.18Å; L258-F274 HydrophobicContact CB-CE2 3.63Å; L258-F274 HydrophobicContact CB-CZ 3.79Å; L258-F274 HydrophobicContact CD1-CE2 3.89Å; L258-F274 HydrophobicContact CD2-CD2 4.11Å; L258-F274 HydrophobicContact CD2-CE2 3.95Å; L258-F274 HydrophobicContact CG-CE2 4Å; E270-F274 PolarHBondContact O-N 3.37Å; K271-F274 PolarHBondContact O-N 2.99Å; F274-R276 VanDerWaalsContact C-N 3.27Å; F274-R276 PolarHBondContact O-N 3.43Å; F274-V277 PolarHBondContact O-N 3.01Å; F274-K278 WeakPolarHBondContact O-CB 3.15Å; F274-K278 PolarHBondContact O-N 3.42Å; F274-V286 HydrophobicContact CD1-CG1 3.87Å; F274-V286 HydrophobicContact CD1-CG2 3.74Å; F274-V286 HydrophobicContact CE1-CB 4.31Å; F274-V286 HydrophobicContact CE1-CG1 3.53Å; F274-V286 HydrophobicContact CE1-CG2 3.78Å; F274-V286 HydrophobicContact CZ-CG1 4.1Å; F274-F317 HydrophobicContact CB-CE1 4.38Å; F274-F317 HydrophobicContact CB-CZ 3.81Å; F274-L322 HydrophobicContact CB-CD1 3.95Å; F274-L322 HydrophobicContact CB-CD2 4.22Å
275	Q	90.3	Very high	88.6	Confident	86 Å²	86	56.5 Å²	56.5	40%	0.402	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-37.7	167.6	-73.8	170.3	-5.6	0	0	111.5	K271 K272 F273 A279 L322	K271-Q275 WeakPolarHBondContact O-CG 3.33Å; K271-Q275 PolarHBondContact O-N 3.18Å; K272-Q275 PolarHBondContact O-N 2.91Å; F273-Q275 VanDerWaalsContact C-N 3.33Å; F273-Q275 PolarHBondContact O-N 3.17Å; Q275-A279 PolarHBondContact O-N 2.9Å; Q275-L322 HydrophobicContact CG-CD2 4Å
276	R	89.4	Confident	89.2	Confident	84 Å²	84	53.6 Å²	53.6	32%	0.317	29%	0.285	S	S	.	.	H	α-helix	trans	-70.6	-38.7	173.3	-66.3	172.9	175.3	-140.7	9.6	112.3	D243 I246 K272 F273 F274 A279 K280	D243-R276 WeakPolarHBondContact OD1-CD 3.33Å; D243-R276 IonicContact OD1-CZ 2.67Å; D243-R276 IonicContact OD1-NE 3.1Å; D243-R276 IonicContact OD1-NH1 3.19Å; D243-R276 PolarHBondContact OD1-NH1 3.38Å; D243-R276 IonicContact OD2-CZ 3.79Å; D243-R276 IonicContact OD2-NH1 2.67Å; D243-R276 PolarHBondContact OD2-NH1 3.23Å; I246-R276 HydrophobicContact CD1-CB 3.72Å; K272-R276 WeakPolarHBondContact O-CG 3.39Å; K272-R276 PolarHBondContact O-N 3.23Å; F273-R276 WeakPolarHBondContact O-CA 3.42Å; F273-R276 WeakPolarHBondContact O-CB 3.35Å; F273-R276 PolarHBondContact O-N 2.93Å; F274-R276 VanDerWaalsContact C-N 3.27Å; F274-R276 PolarHBondContact O-N 3.43Å; R276-A279 WeakPolarHBondContact O-CB 3.43Å; R276-A279 PolarHBondContact O-N 2.97Å; R276-A279 VanDerWaalsContact O-N 3.13Å; R276-K280 PolarHBondContact O-N 2.79Å
277	V	89.7	Confident	89.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.7	-48.4	173.2	177.8	0	0	0	0	110.4	I246 F256 F273 F274 A279 K280 L281 P284	I246-V277 HydrophobicContact CD1-CG2 3.85Å; I246-V277 HydrophobicContact CG1-CG2 4.08Å; F256-V277 HydrophobicContact CD1-CG1 4.48Å; F256-V277 HydrophobicContact CD2-CG1 4.26Å; F256-V277 HydrophobicContact CE1-CG1 4.06Å; F256-V277 HydrophobicContact CE2-CG1 3.83Å; F256-V277 HydrophobicContact CZ-CG1 3.71Å; F273-V277 HydrophobicContact CD1-CG2 4.07Å; F273-V277 HydrophobicContact CE1-CG2 3.53Å; F273-V277 HydrophobicContact CZ-CG2 3.82Å; F273-V277 PolarHBondContact O-N 3.1Å; F274-V277 PolarHBondContact O-N 3.01Å; V277-A279 VanDerWaalsContact C-N 3.26Å; V277-A279 PolarHBondContact O-N 3.49Å; V277-K280 PolarHBondContact O-N 3.45Å; V277-K280 VanDerWaalsContact O-N 3.11Å; V277-L281 HydrophobicContact CG1-CD1 4.11Å; V277-L281 PolarHBondContact O-N 3.34Å; V277-P284 HydrophobicContact CG1-CB 4.14Å; V277-P284 HydrophobicContact CG1-CG 4.18Å
278	K	89.6	Confident	90	Very high	66 Å²	66	51.3 Å²	51.3	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-36.2	174.3	179.7	-165	177	170	0	112.6	F274 K280 L281 E321 L322	F274-K278 WeakPolarHBondContact O-CB 3.15Å; F274-K278 PolarHBondContact O-N 3.42Å; K278-K280 VanDerWaalsContact C-N 3.26Å; K278-K280 PolarHBondContact O-N 3.11Å; K278-L281 CarbonylContact C-O 3.57Å; K278-E321 PolarHBondContact NZ-O 2.91Å; K278-L322 HydrophobicContact CB-CD2 4.43Å; K278-L322 HydrophobicContact CD-CD2 4.43Å; K278-L322 WeakPolarHBondContact CD-O 3.06Å; K278-L322 WeakPolarHBondContact CE-O 3.41Å; K278-L322 VanDerWaalsContact NZ-C 3.34Å; K278-L322 PolarHBondContact NZ-O 3.48Å
279	A	89.1	Confident	90.5	Very high	87 Å²	87	45.5 Å²	45.5	72%	0.719	24%	0.24	S	C	*	.	H	α-helix	trans	-67.5	-27.4	179.2	0	0	0	0	0	112.8	Q275 R276 V277	Q275-A279 PolarHBondContact O-N 2.9Å; R276-A279 WeakPolarHBondContact O-CB 3.43Å; R276-A279 PolarHBondContact O-N 2.97Å; R276-A279 VanDerWaalsContact O-N 3.13Å; V277-A279 VanDerWaalsContact C-N 3.26Å; V277-A279 PolarHBondContact O-N 3.49Å
280	K	88	Confident	91	Very high	70 Å²	70	43.7 Å²	43.7	30%	0.304	23%	0.225	S	C	.	.	H	α-helix	trans	-97.8	-30.9	179.7	-65.9	-169.4	177.4	-171.7	0	113.8	D243 I246 D247 L251 R276 V277 K278	D243-K280 PolarHBondContact O-NZ 2.88Å; I246-K280 HydrophobicContact CB-CD 4.1Å; I246-K280 HydrophobicContact CG2-CB 4.2Å; I246-K280 HydrophobicContact CG2-CD 3.61Å; I246-K280 HydrophobicContact CG2-CG 4.41Å; D247-K280 WeakPolarHBondContact OD1-CD 3.41Å; D247-K280 WeakPolarHBondContact OD1-CE 3.37Å; D247-K280 IonicContact OD1-NZ 3.46Å; D247-K280 PolarHBondContact OD1-NZ 3.11Å; D247-K280 IonicContact OD2-NZ 2.77Å; D247-K280 PolarHBondContact OD2-NZ 2.65Å; L251-K280 HydrophobicContact CD2-CB 4.32Å; R276-K280 PolarHBondContact O-N 2.79Å; V277-K280 PolarHBondContact O-N 3.45Å; V277-K280 VanDerWaalsContact O-N 3.11Å; K278-K280 VanDerWaalsContact C-N 3.26Å; K278-K280 PolarHBondContact O-N 3.11Å
281	L	85.6	Confident	91.3	Very high	32 Å²	32	43.7 Å²	43.7	17%	0.168	23%	0.226	C	C	.	.	S	Bend	trans	-115.8	129.6	-178.5	-66.2	174.3	0	0	0	110.8	L251 F256 V277 K278 K283 P284	L251-L281 HydrophobicContact CD2-CD2 4.17Å; F256-L281 HydrophobicContact CE2-CD1 3.59Å; F256-L281 HydrophobicContact CZ-CD1 3.52Å; V277-L281 HydrophobicContact CG1-CD1 4.11Å; V277-L281 PolarHBondContact O-N 3.34Å; K278-L281 CarbonylContact C-O 3.57Å; L281-K283 PolarHBondContact O-N 3.08Å; L281-P284 HydrophobicContact CB-CB 4.4Å; L281-P284 WeakPolarHBondContact O-CD 3.48Å
282	S	81.4	Confident	91.3	Very high	121 Å²	121	46.1 Å²	46.1	85%	0.846	23%	0.233	S	C	*	.	S	Bend	trans	-72.7	114.7	174.5	58.8	0	0	0	0	110.3
283	K	87.7	Confident	91.5	Very high	138 Å²	138	40.1 Å²	40.1	60%	0.6	21%	0.207	S	C	*	.	S	Bend	trans	56.3	59.6	174.2	-159.1	-176.7	179.8	-176.6	0	113.9	L281 V324	L281-K283 PolarHBondContact O-N 3.08Å; K283-V324 WeakPolarHBondContact CE-O 3.43Å; K283-V324 WeakPolarHBondContact CG-O 3.34Å
284	P	92.5	Very high	91.5	Very high	11 Å²	11	41 Å²	41	7%	0.071	21%	0.212	C	C	.	.			trans	-64.3	140.9	179.8	27.4	-36.1	0	0	0	111.9	F256 V277 L281 V286 V324	F256-P284 HydrophobicContact CD2-CB 3.97Å; F256-P284 HydrophobicContact CE2-CB 3.98Å; V277-P284 HydrophobicContact CG1-CB 4.14Å; V277-P284 HydrophobicContact CG1-CG 4.18Å; L281-P284 HydrophobicContact CB-CB 4.4Å; L281-P284 WeakPolarHBondContact O-CD 3.48Å; P284-V286 HydrophobicContact CB-CG2 4.37Å; P284-V286 HydrophobicContact CG-CG2 4.36Å; P284-V286 PolarHBondContact O-N 3.04Å; P284-V324 HydrophobicContact CG-CG1 3.93Å
285	N	94.6	Very high	91.4	Very high	41 Å²	41	42 Å²	42	22%	0.219	22%	0.219	C	C	.	.			trans	-78.4	105.6	175.4	-62.4	-63.8	0	0	0	110.2	D254 V255 F256 C381 S385	D254-N285 PolarHBondContact O-ND2 3Å; V255-N285 HydrophobicContact CG2-CB 4.07Å; F256-N285 PolarHBondContact N-O 3.49Å; N285-C381 VanDerWaalsContact CG-SG 3.6Å; N285-S385 WeakPolarHBondContact ND2-CB 3.47Å; N285-S385 PolarHBondContact ND2-OG 3.26Å
286	V	95.9	Very high	91.1	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.9	-177.3	-173.7	0	0	0	0	111.1	F256 F274 P284 L318	F256-V286 HydrophobicContact CB-CG2 4.4Å; F256-V286 CarbonylContact O-C 3.58Å; F256-V286 WeakPolarHBondContact O-CA 3.44Å; F274-V286 HydrophobicContact CD1-CG1 3.87Å; F274-V286 HydrophobicContact CD1-CG2 3.74Å; F274-V286 HydrophobicContact CE1-CB 4.31Å; F274-V286 HydrophobicContact CE1-CG1 3.53Å; F274-V286 HydrophobicContact CE1-CG2 3.78Å; F274-V286 HydrophobicContact CZ-CG1 4.1Å; P284-V286 HydrophobicContact CB-CG2 4.37Å; P284-V286 HydrophobicContact CG-CG2 4.36Å; P284-V286 PolarHBondContact O-N 3.04Å; V286-L318 HydrophobicContact CB-CD2 3.95Å; V286-L318 HydrophobicContact CG1-CD2 4.02Å
287	F	97.5	Very high	90.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.5	166.1	-76.1	-93.6	0	0	0	110.6	V255 F256 V257 L258 N332 R333 F335 F374 Q377 F378 C381	V255-F287 HydrophobicContact CG1-CD2 3.56Å; V255-F287 HydrophobicContact CG1-CE2 3.84Å; F256-F287 PolarHBondContact O-N 3.01Å; V257-F287 HydrophobicContact CG1-CB 4.48Å; V257-F287 HydrophobicContact CG2-CB 4.28Å; L258-F287 PolarHBondContact N-O 3.37Å; F287-N332 WeakPolarHBondContact CE1-O 3.46Å; F287-R333 CarbonylContact C-O 3.46Å; F287-R333 WeakPolarHBondContact CA-O 3.26Å; F287-R333 HydrophobicContact CD1-CB 4.37Å; F287-F335 HydrophobicContact CD1-CD2 4.32Å; F287-F335 AromaticContact CD1-CE2 3.73Å; F287-F335 HydrophobicContact CD1-CE2 3.73Å; F287-F335 AromaticContact CE1-CE2 3.87Å; F287-F335 HydrophobicContact CE1-CE2 3.87Å; F287-F374 HydrophobicContact CB-CE2 4.23Å; F287-F374 AromaticContact CD1-CD2 3.96Å; F287-F374 HydrophobicContact CD1-CD2 3.96Å; F287-F374 HydrophobicContact CD1-CE2 4.01Å; F287-F374 HydrophobicContact CE1-CD2 4.36Å; F287-F374 HydrophobicContact CG-CE2 4.12Å; F287-Q377 HydrophobicContact CE1-CB 3.99Å; F287-Q377 HydrophobicContact CZ-CB 4.28Å; F287-F378 HydrophobicContact CE2-CB 4.5Å; F287-F378 HydrophobicContact CE2-CD2 4.47Å; F287-F378 HydrophobicContact CZ-CB 4.26Å; F287-C381 HydrophobicContact CE2-CB 3.99Å; F287-C381 HydrophobicContact CZ-CB 4.04Å
288	I	97	Very high	90	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117	174.8	-57.2	177.6	0	0	0	108.9	L258 C314 F317 L318 R333 I334 F335	L258-I288 HydrophobicContact CB-CG1 4.4Å; L258-I288 HydrophobicContact CD2-CG1 4.42Å; L258-I288 WeakPolarHBondContact O-CA 3.38Å; I288-C314 HydrophobicContact CD1-CB 3.95Å; I288-F317 HydrophobicContact CD1-CD1 3.96Å; I288-L318 HydrophobicContact CD1-CD1 4.02Å; I288-L318 HydrophobicContact CD1-CD2 3.94Å; I288-L318 HydrophobicContact CD1-CG 3.82Å; I288-L318 HydrophobicContact CG1-CD1 4.41Å; I288-L318 HydrophobicContact CG1-CD2 4.38Å; I288-R333 PolarHBondContact N-O 3.31Å; I288-I334 HydrophobicContact CB-CG1 4.43Å; I288-I334 WeakPolarHBondContact O-CA 3.4Å; I288-F335 PolarHBondContact O-N 2.92Å
289	L	97.2	Very high	89.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	107.1	173.2	-62	-175.7	0	0	0	109.2	V146 V257 L258 C260 N291 F335 V337 F374	V146-L289 HydrophobicContact CG1-CD1 3.67Å; V146-L289 HydrophobicContact CG2-CD1 4.2Å; V257-L289 HydrophobicContact CG1-CD1 3.66Å; V257-L289 HydrophobicContact CG1-CG 3.82Å; L258-L289 PolarHBondContact O-N 3.21Å; C260-L289 PolarHBondContact N-O 3.18Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3.37Å; L289-F335 HydrophobicContact CD2-CB 3.82Å; L289-F335 HydrophobicContact CD2-CD2 4.16Å; L289-F335 HydrophobicContact CD2-CG 4.36Å; L289-V337 HydrophobicContact CB-CG2 4.25Å; L289-V337 HydrophobicContact CD2-CG2 4.5Å; L289-F374 HydrophobicContact CD1-CD1 4.34Å; L289-F374 HydrophobicContact CD1-CE1 3.92Å; L289-F374 HydrophobicContact CD1-CE2 4.29Å; L289-F374 HydrophobicContact CD1-CZ 3.89Å; L289-F374 HydrophobicContact CD2-CB 4.3Å; L289-F374 HydrophobicContact CD2-CD1 4.1Å; L289-F374 HydrophobicContact CD2-CD2 3.64Å; L289-F374 HydrophobicContact CD2-CE1 4.37Å; L289-F374 HydrophobicContact CD2-CE2 3.93Å; L289-F374 HydrophobicContact CD2-CG 3.72Å; L289-F374 HydrophobicContact CD2-CZ 4.3Å; L289-F374 HydrophobicContact CG-CE2 4.36Å; L289-F374 HydrophobicContact CG-CZ 4.46Å
290	N	96.3	Very high	88.5	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.016	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	88.5	166.8	-67.1	-81.7	0	0	0	107.6	A262 F335 F336 V337	A262-N290 HydrophobicContact CB-CB 3.9Å; N290-F335 PolarHBondContact N-O 3.38Å; N290-F336 HydrophobicContact CB-CD1 3.67Å; N290-F336 HydrophobicContact CB-CE1 3.9Å; N290-F336 HydrophobicContact CB-CG 4.24Å; N290-V337 PolarHBondContact O-N 3.4Å
291	N	95.2	Very high	88	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	165.3	-176.1	-170.7	34.9	0	0	0	111.7	N141 V259 C260 A262 L289 W293 V337 A339	N141-N291 PolarHBondContact O-ND2 2.99Å; V259-N291 HydrophobicContact CG1-CB 3.85Å; C260-N291 WeakPolarHBondContact O-CB 3.46Å; C260-N291 PolarHBondContact O-N 3.47Å; A262-N291 WeakPolarHBondContact CB-O 3.38Å; A262-N291 PolarHBondContact N-O 3.48Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3.37Å; N291-W293 VanDerWaalsContact C-N 3.25Å; N291-V337 CarbonylContact C-O 3.48Å; N291-V337 WeakPolarHBondContact CA-O 3.4Å; N291-V337 HydrophobicContact CB-CG2 4.38Å; N291-V337 PolarHBondContact OD1-O 2.89Å; N291-A339 WeakPolarHBondContact OD1-CB 3.4Å; N291-A339 PolarHBondContact OD1-N 3.35Å
292	R	92.2	Very high	87.8	Confident	91 Å²	91	55.4 Å²	55.4	34%	0.343	28%	0.28	S	S	.	.			trans	65.2	27.2	-173.9	-51.8	-178.1	65.9	-160.9	-8.5	113.3	E263 D294 V295 V337	E263-R292 IonicContact OE1-CZ 3.61Å; E263-R292 IonicContact OE1-NE 2.72Å; E263-R292 PolarHBondContact OE1-NE 3.41Å; E263-R292 VanDerWaalsContact OE1-NE 3.1Å; E263-R292 IonicContact OE1-NH1 3.89Å; E263-R292 PolarHBondContact OE1-NH1 3.23Å; E263-R292 IonicContact OE1-NH2 3.47Å; E263-R292 PolarHBondContact OE1-NH2 2.88Å; E263-R292 IonicContact OE2-CZ 3.56Å; E263-R292 IonicContact OE2-NH1 3.82Å; E263-R292 IonicContact OE2-NH2 2.72Å; R292-D294 VanDerWaalsContact C-OD1 3.28Å; R292-D294 VanDerWaalsContact CA-OD1 3.29Å; R292-D294 WeakPolarHBondContact CA-OD1 3.39Å; R292-D294 PolarHBondContact O-N 3.15Å; R292-V295 HydrophobicContact CB-CG2 4.35Å; R292-V295 WeakPolarHBondContact O-CB 3.46Å; R292-V295 PolarHBondContact O-N 3.27Å; R292-V337 PolarHBondContact N-O 2.95Å; R292-V337 VanDerWaalsContact N-O 3.13Å
293	W	92.4	Very high	87.9	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-19.9	179.1	-166.2	-120.6	0	0	0	113.5	A262 N291 V295 C296 M297 V303 L306 R307 F336 V337	A262-W293 HydrophobicContact CB-CE3 3.48Å; A262-W293 VanDerWaalsContact CB-CE3 3.48Å; A262-W293 HydrophobicContact CB-CZ3 4.02Å; N291-W293 VanDerWaalsContact C-N 3.25Å; W293-V295 VanDerWaalsContact C-N 3.25Å; W293-V295 PolarHBondContact O-N 3.36Å; W293-C296 HydrophobicContact CD2-CB 4.32Å; W293-C296 HydrophobicContact CE3-CB 3.68Å; W293-C296 HydrophobicContact CH2-CB 4.48Å; W293-C296 HydrophobicContact CZ3-CB 3.79Å; W293-C296 PolarHBondContact O-N 3.01Å; W293-M297 HydrophobicContact CZ2-CE 4.4Å; W293-M297 PolarHBondContact O-N 3.45Å; W293-V303 HydrophobicContact CH2-CG1 4.02Å; W293-V303 HydrophobicContact CZ2-CG1 3.47Å; W293-V303 VanDerWaalsContact CZ2-CG1 3.47Å; W293-L306 HydrophobicContact CH2-CB 4.36Å; W293-L306 HydrophobicContact CH2-CD2 4.07Å; W293-L306 HydrophobicContact CH2-CG 4.1Å; W293-L306 HydrophobicContact CZ3-CD2 4.02Å; W293-L306 HydrophobicContact CZ3-CG 4.32Å; W293-R307 HydrophobicContact CH2-CB 4.09Å; W293-R307 HydrophobicContact CZ2-CB 3.81Å; W293-R307 HydrophobicContact CZ2-CG 4.12Å; W293-F336 HydrophobicContact CB-CB 4.43Å; W293-F336 HydrophobicContact CD2-CB 4.08Å; W293-F336 AromaticContact CD2-CD1 3.7Å; W293-F336 HydrophobicContact CD2-CD1 3.7Å; W293-F336 HydrophobicContact CD2-CG 4.33Å; W293-F336 AromaticContact CE2-CD1 3.79Å; W293-F336 AromaticContact CE3-CD1 3.71Å; W293-F336 HydrophobicContact CE3-CD1 3.71Å; W293-F336 HydrophobicContact CE3-CE1 4.37Å; W293-F336 HydrophobicContact CG-CB 3.88Å; W293-F336 HydrophobicContact CG-CD1 4.36Å; W293-F336 AromaticContact CH2-CD1 3.87Å; W293-F336 HydrophobicContact CH2-CD1 3.87Å; W293-F336 AromaticContact CH2-CE1 3.97Å; W293-F336 HydrophobicContact CH2-CE1 3.97Å; W293-F336 AromaticContact CZ2-CD1 3.89Å; W293-F336 HydrophobicContact CZ2-CD1 3.89Å; W293-F336 HydrophobicContact CZ2-CE1 4.33Å; W293-F336 AromaticContact CZ3-CD1 3.78Å; W293-F336 HydrophobicContact CZ3-CD1 3.78Å; W293-F336 AromaticContact CZ3-CE1 3.99Å; W293-F336 HydrophobicContact CZ3-CE1 3.99Å; W293-V337 WeakPolarHBondContact CB-O 3.35Å; W293-V337 PolarHBondContact N-O 2.86Å
294	D	90.1	Very high	87.8	Confident	17 Å²	17	50.2 Å²	50.2	9%	0.091	25%	0.25	C	C	.	.	H	α-helix	trans	-55.9	-38.6	169.2	52.1	-64.4	0	0	0	112.6	R292 M298 S338	R292-D294 VanDerWaalsContact C-OD1 3.28Å; R292-D294 VanDerWaalsContact CA-OD1 3.29Å; R292-D294 WeakPolarHBondContact CA-OD1 3.39Å; R292-D294 PolarHBondContact O-N 3.15Å; D294-M298 WeakPolarHBondContact O-CG 3.47Å; D294-M298 PolarHBondContact O-N 3.45Å; D294-S338 WeakPolarHBondContact OD1-CB 3.49Å; D294-S338 PolarHBondContact OD1-OG 3.47Å
295	V	87.1	Confident	87.5	Confident	24 Å²	24	55.8 Å²	55.8	15%	0.145	28%	0.275	C	S	.	.	H	α-helix	trans	-71.7	-46	-178.5	-175.8	0	0	0	0	110.8	E263 R292 W293 M297 M298 E299	E263-V295 HydrophobicContact CG-CB 4.22Å; E263-V295 HydrophobicContact CG-CG1 4.08Å; E263-V295 WeakPolarHBondContact OE1-CB 3.47Å; E263-V295 WeakPolarHBondContact OE1-CG1 3.45Å; R292-V295 HydrophobicContact CB-CG2 4.35Å; R292-V295 WeakPolarHBondContact O-CB 3.46Å; R292-V295 PolarHBondContact O-N 3.27Å; W293-V295 VanDerWaalsContact C-N 3.25Å; W293-V295 PolarHBondContact O-N 3.36Å; V295-M297 VanDerWaalsContact C-N 3.25Å; V295-M297 PolarHBondContact O-N 3.06Å; V295-M298 WeakPolarHBondContact O-CB 3.37Å; V295-M298 PolarHBondContact O-N 3.05Å; V295-E299 HydrophobicContact CG1-CG 4.25Å; V295-E299 WeakPolarHBondContact CG1-OE1 3.5Å; V295-E299 PolarHBondContact O-N 2.9Å; V295-E299 VanDerWaalsContact O-N 3.08Å
296	C	84.6	Confident	87.3	Confident	7 Å²	7	55.8 Å²	55.8	5%	0.047	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-35.7	179.9	-59	0	0	0	0	112.8	A262 E263 W293 M298 E299 S300 L306	A262-C296 PolarHBondContact O-SG 3.17Å; A262-C296 VanDerWaalsContact O-SG 3.33Å; E263-C296 PolarHBondContact N-SG 3.34Å; W293-C296 HydrophobicContact CD2-CB 4.32Å; W293-C296 HydrophobicContact CE3-CB 3.68Å; W293-C296 HydrophobicContact CH2-CB 4.48Å; W293-C296 HydrophobicContact CZ3-CB 3.79Å; W293-C296 PolarHBondContact O-N 3.01Å; C296-M298 VanDerWaalsContact C-N 3.27Å; C296-M298 PolarHBondContact O-N 2.94Å; C296-E299 PolarHBondContact O-N 3.15Å; C296-S300 WeakPolarHBondContact O-CB 3.35Å; C296-S300 PolarHBondContact O-N 3.32Å; C296-L306 HydrophobicContact CB-CD2 4.17Å
297	M	80.1	Confident	87	Confident	67 Å²	67	59.4 Å²	59.4	33%	0.33	29%	0.288	S	S	.	.	H	α-helix	trans	-66.6	-28.5	176.3	-79.7	-79.1	173	0	0	113	W293 V295 V303	W293-M297 HydrophobicContact CZ2-CE 4.4Å; W293-M297 PolarHBondContact O-N 3.45Å; V295-M297 VanDerWaalsContact C-N 3.25Å; V295-M297 PolarHBondContact O-N 3.06Å; M297-V303 HydrophobicContact CE-CB 4.03Å; M297-V303 HydrophobicContact CE-CG1 3.29Å; M297-V303 HydrophobicContact CG-CG1 4.05Å; M297-V303 HydrophobicContact SD-CB 3.93Å; M297-V303 HydrophobicContact SD-CG1 3.52Å; M297-V303 VanDerWaalsContact SD-CG1 3.52Å; M297-V303 HydrophobicContact SD-CG2 3.86Å
298	M	75.6	Confident	86.8	Confident	123 Å²	123	65.9 Å²	65.9	61%	0.606	32%	0.318	S	S	*	.	H	α-helix	trans	-83.5	-33.6	177.9	-67	179.3	65.7	0	0	112.8	D294 V295 C296 M361	D294-M298 WeakPolarHBondContact O-CG 3.47Å; D294-M298 PolarHBondContact O-N 3.45Å; V295-M298 WeakPolarHBondContact O-CB 3.37Å; V295-M298 PolarHBondContact O-N 3.05Å; C296-M298 VanDerWaalsContact C-N 3.27Å; C296-M298 PolarHBondContact O-N 2.94Å; M298-M361 HydrophobicContact CE-CE 3.39Å; M298-M361 HydrophobicContact CE-SD 4.44Å; M298-M361 HydrophobicContact CG-CE 4.36Å; M298-M361 HydrophobicContact SD-CE 3.28Å; M298-M361 WeakPolarHBondContact SD-CE 3.38Å; M298-M361 HydrophobicContact SD-SD 3.57Å
299	E	75.6	Confident	86.5	Confident	150 Å²	150	70.2 Å²	70.2	70%	0.701	34%	0.338	S	S	*	.	H	α-helix	trans	-95.7	-13.7	-169.4	-66.8	-177.1	173.4	0	0	114.2	V295 C296	V295-E299 HydrophobicContact CG1-CG 4.25Å; V295-E299 WeakPolarHBondContact CG1-OE1 3.5Å; V295-E299 PolarHBondContact O-N 2.9Å; V295-E299 VanDerWaalsContact O-N 3.08Å; C296-E299 PolarHBondContact O-N 3.15Å
300	S	72.9	Confident	86.3	Confident	43 Å²	43	70.6 Å²	70.6	30%	0.301	34%	0.34	S	S	.	.			trans	-125.5	131.8	-174.5	-174.9	0	0	0	0	112.9	C296 M302 V303	C296-S300 WeakPolarHBondContact O-CB 3.35Å; C296-S300 PolarHBondContact O-N 3.32Å; S300-M302 VanDerWaalsContact C-N 3.33Å; S300-M302 PolarHBondContact OG-N 3.17Å; S300-V303 WeakPolarHBondContact O-CG2 3.38Å
301	E	76.2	Confident	86.2	Confident	204 Å²	204	72.1 Å²	72.1	95%	0.953	35%	0.349	S	S	*	.	S	Bend	trans	-78.5	-16.7	172.5	-65.1	-175.8	172.7	0	0	112.8
302	M	81.5	Confident	86.1	Confident	112 Å²	112	77.8 Å²	77.8	55%	0.552	37%	0.374	S	S	*	.			trans	-111.9	47.8	-176.7	-65.9	-167.7	-70.3	0	0	112.4	S300 D304 Q305 L306	S300-M302 VanDerWaalsContact C-N 3.33Å; S300-M302 PolarHBondContact OG-N 3.17Å; M302-D304 VanDerWaalsContact C-N 3.27Å; M302-D304 PolarHBondContact O-N 3.19Å; M302-Q305 HydrophobicContact CB-CB 4.42Å; M302-Q305 PolarHBondContact O-N 3.49Å; M302-Q305 PolarHBondContact SD-OE1 2.99Å; M302-Q305 VanDerWaalsContact SD-OE1 3.38Å; M302-L306 PolarHBondContact O-N 2.89Å
303	V	83.9	Confident	86.2	Confident	18 Å²	18	77.7 Å²	77.7	11%	0.109	37%	0.373	C	S	.	.	H	α-helix	trans	-61.7	-34.4	-172.8	-164.8	0	0	0	0	113	W293 M297 S300 L306 R307	W293-V303 HydrophobicContact CH2-CG1 4.02Å; W293-V303 HydrophobicContact CZ2-CG1 3.47Å; W293-V303 VanDerWaalsContact CZ2-CG1 3.47Å; M297-V303 HydrophobicContact CE-CB 4.03Å; M297-V303 HydrophobicContact CE-CG1 3.29Å; M297-V303 HydrophobicContact CG-CG1 4.05Å; M297-V303 HydrophobicContact SD-CB 3.93Å; M297-V303 HydrophobicContact SD-CG1 3.52Å; M297-V303 VanDerWaalsContact SD-CG1 3.52Å; M297-V303 HydrophobicContact SD-CG2 3.86Å; S300-V303 WeakPolarHBondContact O-CG2 3.38Å; V303-L306 PolarHBondContact O-N 3.19Å; V303-R307 PolarHBondContact O-N 3.14Å
304	D	85.2	Confident	86.3	Confident	131 Å²	131	77.6 Å²	77.6	70%	0.701	37%	0.374	S	S	*	.	H	α-helix	trans	-65.3	-40.3	178.6	-68.8	-33	0	0	0	112.8	M302 L306 R307 H308	M302-D304 VanDerWaalsContact C-N 3.27Å; M302-D304 PolarHBondContact O-N 3.19Å; D304-L306 VanDerWaalsContact C-N 3.34Å; D304-R307 PolarHBondContact O-N 3.45Å; D304-H308 WeakPolarHBondContact O-CB 3.44Å; D304-H308 PolarHBondContact O-N 3.39Å
305	Q	87	Confident	86.5	Confident	128 Å²	128	78.5 Å²	78.5	60%	0.598	38%	0.378	S	S	*	.	H	α-helix	trans	-66.6	-39.9	176.3	-64.9	-177.2	9	0	0	110.9	M302 H308 Q309	M302-Q305 HydrophobicContact CB-CB 4.42Å; M302-Q305 PolarHBondContact O-N 3.49Å; M302-Q305 PolarHBondContact SD-OE1 2.99Å; M302-Q305 VanDerWaalsContact SD-OE1 3.38Å; Q305-H308 PolarHBondContact O-N 3.48Å; Q305-Q309 WeakPolarHBondContact O-CB 3.31Å; Q305-Q309 PolarHBondContact O-N 3.36Å
306	L	89.2	Confident	86.9	Confident	41 Å²	41	79.6 Å²	79.6	22%	0.215	38%	0.383	C	S	.	.	H	α-helix	trans	-63.7	-44.9	175.5	-173.9	65.7	0	0	0	111.2	W293 C296 M302 V303 D304 H308 Q309 H310	W293-L306 HydrophobicContact CH2-CB 4.36Å; W293-L306 HydrophobicContact CH2-CD2 4.07Å; W293-L306 HydrophobicContact CH2-CG 4.1Å; W293-L306 HydrophobicContact CZ3-CD2 4.02Å; W293-L306 HydrophobicContact CZ3-CG 4.32Å; C296-L306 HydrophobicContact CB-CD2 4.17Å; M302-L306 PolarHBondContact O-N 2.89Å; V303-L306 PolarHBondContact O-N 3.19Å; D304-L306 VanDerWaalsContact C-N 3.34Å; L306-H308 VanDerWaalsContact C-N 3.34Å; L306-H308 PolarHBondContact O-N 2.97Å; L306-Q309 PolarHBondContact O-N 2.67Å; L306-H310 PolarHBondContact O-CD2 3.32Å; L306-H310 VanDerWaalsContact O-CD2 3.3Å; L306-H310 PolarHBondContact O-N 3.19Å
307	R	91.3	Very high	87.4	Confident	80 Å²	80	79.3 Å²	79.3	30%	0.302	38%	0.381	S	S	.	.	H	α-helix	trans	-57.4	-48.5	174.9	-164.9	176.3	-175.9	171.7	1.5	110.4	W293 V303 D304 Q309 H310 T311 F336 E370	W293-R307 HydrophobicContact CH2-CB 4.09Å; W293-R307 HydrophobicContact CZ2-CB 3.81Å; W293-R307 HydrophobicContact CZ2-CG 4.12Å; V303-R307 PolarHBondContact O-N 3.14Å; D304-R307 PolarHBondContact O-N 3.45Å; R307-Q309 VanDerWaalsContact C-N 3.33Å; R307-Q309 PolarHBondContact O-N 3.07Å; R307-H310 PolarHBondContact O-N 3.35Å; R307-T311 WeakPolarHBondContact O-CB 3.46Å; R307-T311 PolarHBondContact O-N 2.93Å; R307-T311 PolarHBondContact O-OG1 3.26Å; R307-F336 HydrophobicContact CG-CD1 4.25Å; R307-F336 HydrophobicContact CG-CD2 3.97Å; R307-F336 HydrophobicContact CG-CE1 4.01Å; R307-F336 HydrophobicContact CG-CE2 3.73Å; R307-F336 HydrophobicContact CG-CG 4.22Å; R307-F336 HydrophobicContact CG-CZ 3.74Å; R307-E370 VanDerWaalsContact NH2-CD 3.31Å; R307-E370 IonicContact NH2-OE1 3.84Å; R307-E370 PolarHBondContact NH2-OE1 3.37Å; R307-E370 IonicContact NH2-OE2 2.73Å; R307-E370 PolarHBondContact NH2-OE2 2.92Å
308	H	91.9	Very high	88.1	Confident	136 Å²	136	76.1 Å²	76.1	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-59.7	-43.6	178.5	-171.9	74.8	0	0	0	112.1	D304 Q305 L306 T311 K312	D304-H308 WeakPolarHBondContact O-CB 3.44Å; D304-H308 PolarHBondContact O-N 3.39Å; Q305-H308 PolarHBondContact O-N 3.48Å; L306-H308 VanDerWaalsContact C-N 3.34Å; L306-H308 PolarHBondContact O-N 2.97Å; H308-T311 PolarHBondContact O-N 2.66Å; H308-K312 WeakPolarHBondContact O-CB 3.4Å; H308-K312 PolarHBondContact O-N 3.05Å
309	Q	91.4	Very high	89.1	Confident	90 Å²	90	71.9 Å²	71.9	42%	0.421	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-44.2	178.6	-165.3	-171.7	44.9	0	0	112.3	Q305 L306 R307 R313	Q305-Q309 WeakPolarHBondContact O-CB 3.31Å; Q305-Q309 PolarHBondContact O-N 3.36Å; L306-Q309 PolarHBondContact O-N 2.67Å; R307-Q309 VanDerWaalsContact C-N 3.33Å; R307-Q309 PolarHBondContact O-N 3.07Å; Q309-R313 VanDerWaalsContact CD-CZ 3.41Å; Q309-R313 VanDerWaalsContact CD-NH2 3.29Å; Q309-R313 WeakPolarHBondContact O-CG 3.5Å; Q309-R313 PolarHBondContact O-N 3.21Å; Q309-R313 VanDerWaalsContact O-N 3.07Å
310	H	92.7	Very high	89.9	Confident	8 Å²	8	71 Å²	71	4%	0.037	34%	0.342	C	S	.	.	H	α-helix	trans	-66.1	-44.3	177.4	-81.8	-130.5	0	0	0	111.4	A262 A264 L306 R307 K312 R313 C314 F336	A262-H310 PolarHBondContact O-CE1 2.9Å; A264-H310 PolarHBondContact O-CE1 3.1Å; L306-H310 PolarHBondContact O-CD2 3.32Å; L306-H310 VanDerWaalsContact O-CD2 3.3Å; L306-H310 PolarHBondContact O-N 3.19Å; R307-H310 PolarHBondContact O-N 3.35Å; H310-K312 PolarHBondContact O-N 3.4Å; H310-R313 PolarHBondContact O-N 2.95Å; H310-C314 WeakPolarHBondContact O-CB 3.4Å; H310-C314 PolarHBondContact O-N 3.45Å; H310-C314 PolarHBondContact O-SG 3.49Å; H310-F336 HydrophobicContact CB-CE1 3.63Å; H310-F336 HydrophobicContact CB-CZ 3.65Å
311	T	94.2	Very high	90.9	Very high	35 Å²	35	72.2 Å²	72.2	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-57.1	-49.3	175.6	-63.3	0	0	0	0	110.8	R307 H308 R313 C314 M315 F336	R307-T311 WeakPolarHBondContact O-CB 3.46Å; R307-T311 PolarHBondContact O-N 2.93Å; R307-T311 PolarHBondContact O-OG1 3.26Å; H308-T311 PolarHBondContact O-N 2.66Å; T311-R313 PolarHBondContact O-N 2.98Å; T311-C314 PolarHBondContact O-N 2.93Å; T311-M315 HydrophobicContact CG2-CE 3.66Å; T311-M315 HydrophobicContact CG2-CG 4.43Å; T311-M315 HydrophobicContact CG2-SD 4.12Å; T311-M315 WeakPolarHBondContact O-CG 3.47Å; T311-M315 PolarHBondContact O-N 2.92Å; T311-F336 VanDerWaalsContact OG1-CE2 3.28Å; T311-F336 WeakPolarHBondContact OG1-CE2 3.3Å; T311-F336 WeakPolarHBondContact OG1-CZ 3.22Å
312	K	94	Very high	91.7	Very high	125 Å²	125	62.6 Å²	62.6	54%	0.543	30%	0.298	S	S	.	.	H	α-helix	trans	-58	-52.2	178.5	-176.6	174.5	-179.8	175.8	0	111.6	H308 H310 C314 M315 D316	H308-K312 WeakPolarHBondContact O-CB 3.4Å; H308-K312 PolarHBondContact O-N 3.05Å; H310-K312 PolarHBondContact O-N 3.4Å; K312-C314 VanDerWaalsContact C-N 3.27Å; K312-C314 PolarHBondContact O-N 3.49Å; K312-M315 WeakPolarHBondContact O-CB 3.28Å; K312-M315 PolarHBondContact O-N 3.36Å; K312-M315 VanDerWaalsContact O-N 3.1Å; K312-D316 PolarHBondContact O-N 2.95Å
313	R	93.5	Very high	92.3	Very high	88 Å²	88	63.8 Å²	63.8	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-37.9	178.7	-72.9	180	-179.2	130.8	-3.4	113.2	Q309 H310 T311 F317	Q309-R313 VanDerWaalsContact CD-CZ 3.41Å; Q309-R313 VanDerWaalsContact CD-NH2 3.29Å; Q309-R313 WeakPolarHBondContact O-CG 3.5Å; Q309-R313 PolarHBondContact O-N 3.21Å; Q309-R313 VanDerWaalsContact O-N 3.07Å; H310-R313 PolarHBondContact O-N 2.95Å; T311-R313 PolarHBondContact O-N 2.98Å; R313-F317 WeakPolarHBondContact O-CB 3.29Å; R313-F317 PolarHBondContact O-N 2.91Å; R313-F317 VanDerWaalsContact O-N 3.1Å
314	C	95.1	Very high	92.7	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-71.4	-37.4	177.8	-66.8	0	0	0	0	111.6	I288 H310 T311 K312 F317 L318 I334	I288-C314 HydrophobicContact CD1-CB 3.95Å; H310-C314 WeakPolarHBondContact O-CB 3.4Å; H310-C314 PolarHBondContact O-N 3.45Å; H310-C314 PolarHBondContact O-SG 3.49Å; T311-C314 PolarHBondContact O-N 2.93Å; K312-C314 VanDerWaalsContact C-N 3.27Å; K312-C314 PolarHBondContact O-N 3.49Å; C314-F317 PolarHBondContact O-N 3.16Å; C314-L318 WeakPolarHBondContact O-CG 3.35Å; C314-L318 PolarHBondContact O-N 3.37Å; C314-I334 HydrophobicContact CB-CD1 3.49Å; C314-I334 VanDerWaalsContact CB-CD1 3.49Å; C314-I334 HydrophobicContact CB-CG1 3.82Å; C314-I334 HydrophobicContact CB-CG2 3.9Å
315	M	94.6	Very high	92.9	Very high	35 Å²	35	58 Å²	58	17%	0.172	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-50.8	173.8	-75.9	-175.9	178	0	0	111.4	T311 K312 F317 L318 V319 A330 K331 I334	T311-M315 HydrophobicContact CG2-CE 3.66Å; T311-M315 HydrophobicContact CG2-CG 4.43Å; T311-M315 HydrophobicContact CG2-SD 4.12Å; T311-M315 WeakPolarHBondContact O-CG 3.47Å; T311-M315 PolarHBondContact O-N 2.92Å; K312-M315 WeakPolarHBondContact O-CB 3.28Å; K312-M315 PolarHBondContact O-N 3.36Å; K312-M315 VanDerWaalsContact O-N 3.1Å; M315-F317 PolarHBondContact O-N 3.45Å; M315-L318 PolarHBondContact O-N 3.35Å; M315-L318 VanDerWaalsContact O-N 3.11Å; M315-V319 WeakPolarHBondContact O-CB 3.43Å; M315-V319 WeakPolarHBondContact O-CG2 3.35Å; M315-V319 PolarHBondContact O-N 3.35Å; M315-A330 HydrophobicContact CG-CB 4.38Å; M315-K331 HydrophobicContact CE-CB 3.96Å; M315-K331 HydrophobicContact CE-CD 3.91Å; M315-K331 HydrophobicContact CE-CG 3.48Å; M315-K331 VanDerWaalsContact CE-CG 3.48Å; M315-I334 HydrophobicContact CB-CD1 4.44Å; M315-I334 HydrophobicContact CG-CD1 3.62Å
316	D	94.4	Very high	93.2	Very high	48 Å²	48	56 Å²	56	26%	0.257	27%	0.265	S	S	.	.	I	π-helix	trans	-54.9	-41	177.1	-59.3	-10.6	0	0	0	109.9	K312 E320 E321	K312-D316 PolarHBondContact O-N 2.95Å; D316-E320 WeakPolarHBondContact O-CA 3.38Å; D316-E320 VanDerWaalsContact O-CB 3.24Å; D316-E320 WeakPolarHBondContact O-CB 3.41Å; D316-E320 PolarHBondContact O-N 3.28Å; D316-E321 PolarHBondContact O-N 2.93Å
317	F	95	Very high	93.3	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-65.1	-46.4	176.7	178.9	-119.2	0	0	0	113.8	L258 L266 K271 F274 I288 R313 C314 M315 E321 L322	L258-F317 HydrophobicContact CD2-CE1 4.44Å; L266-F317 HydrophobicContact CD2-CB 3.88Å; L266-F317 HydrophobicContact CD2-CD1 3.63Å; L266-F317 HydrophobicContact CD2-CD2 4.19Å; L266-F317 HydrophobicContact CD2-CE1 4.17Å; L266-F317 HydrophobicContact CD2-CG 3.62Å; K271-F317 HydrophobicContact CB-CD2 4.37Å; K271-F317 HydrophobicContact CB-CE2 3.74Å; K271-F317 HydrophobicContact CB-CZ 4.28Å; K271-F317 HydrophobicContact CD-CD2 4.14Å; K271-F317 HydrophobicContact CD-CE2 4.34Å; K271-F317 HydrophobicContact CG-CD2 3.82Å; K271-F317 HydrophobicContact CG-CE2 3.63Å; K271-F317 HydrophobicContact CG-CZ 4.2Å; F274-F317 HydrophobicContact CB-CE1 4.38Å; F274-F317 HydrophobicContact CB-CZ 3.81Å; I288-F317 HydrophobicContact CD1-CD1 3.96Å; R313-F317 WeakPolarHBondContact O-CB 3.29Å; R313-F317 PolarHBondContact O-N 2.91Å; R313-F317 VanDerWaalsContact O-N 3.1Å; C314-F317 PolarHBondContact O-N 3.16Å; M315-F317 PolarHBondContact O-N 3.45Å; F317-E321 HydrophobicContact CD2-CB 4.03Å; F317-E321 HydrophobicContact CD2-CG 4.48Å; F317-L322 HydrophobicContact CD1-CD1 4.17Å; F317-L322 HydrophobicContact CD2-CG 4.2Å; F317-L322 HydrophobicContact CE1-CD1 3.55Å; F317-L322 HydrophobicContact CE1-CG 4.15Å; F317-L322 HydrophobicContact CE2-CD1 4.03Å; F317-L322 HydrophobicContact CE2-CD2 3.99Å; F317-L322 HydrophobicContact CE2-CG 3.72Å; F317-L322 HydrophobicContact CZ-CD1 3.48Å; F317-L322 VanDerWaalsContact CZ-CD1 3.48Å; F317-L322 HydrophobicContact CZ-CD2 4.04Å; F317-L322 HydrophobicContact CZ-CG 3.71Å; F317-L322 WeakPolarHBondContact O-CB 3.47Å; F317-L322 WeakPolarHBondContact O-CG 3.47Å; F317-L322 PolarHBondContact O-N 3.41Å
318	L	95.3	Very high	93.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.299	C	S	.	.	I	π-helix	trans	-73.3	-39.2	-178.4	-68.6	179.2	0	0	0	112.8	V286 I288 C314 M315 L322 Q323 V324 A330 R333 I334	V286-L318 HydrophobicContact CB-CD2 3.95Å; V286-L318 HydrophobicContact CG1-CD2 4.02Å; I288-L318 HydrophobicContact CD1-CD1 4.02Å; I288-L318 HydrophobicContact CD1-CD2 3.94Å; I288-L318 HydrophobicContact CD1-CG 3.82Å; I288-L318 HydrophobicContact CG1-CD1 4.41Å; I288-L318 HydrophobicContact CG1-CD2 4.38Å; C314-L318 WeakPolarHBondContact O-CG 3.35Å; C314-L318 PolarHBondContact O-N 3.37Å; M315-L318 PolarHBondContact O-N 3.35Å; M315-L318 VanDerWaalsContact O-N 3.11Å; L318-L322 HydrophobicContact CD2-CD1 4.25Å; L318-Q323 PolarHBondContact O-N 2.94Å; L318-V324 HydrophobicContact CD2-CG2 4.29Å; L318-V324 PolarHBondContact O-N 3.32Å; L318-V324 VanDerWaalsContact O-N 3.17Å; L318-A330 HydrophobicContact CD1-CB 4.44Å; L318-R333 HydrophobicContact CD1-CB 3.82Å; L318-R333 HydrophobicContact CD1-CG 4.47Å; L318-I334 HydrophobicContact CD1-CD1 4.21Å; L318-I334 HydrophobicContact CD1-CG1 3.99Å
319	V	95.4	Very high	93.1	Very high	34 Å²	34	58 Å²	58	21%	0.206	28%	0.284	C	S	.	.	I	π-helix	trans	-92	-50.4	-171.7	-178.1	0	0	0	0	111.6	M315 Q323 E327 A330	M315-V319 WeakPolarHBondContact O-CB 3.43Å; M315-V319 WeakPolarHBondContact O-CG2 3.35Å; M315-V319 PolarHBondContact O-N 3.35Å; V319-Q323 VanDerWaalsContact O-CA 3.27Å; V319-Q323 WeakPolarHBondContact O-CA 3.48Å; V319-Q323 WeakPolarHBondContact O-CG 3.29Å; V319-Q323 PolarHBondContact O-N 3.48Å; V319-E327 HydrophobicContact CG1-CG 4.28Å; V319-E327 HydrophobicContact CG2-CG 4.45Å; V319-A330 HydrophobicContact CG2-CB 3.68Å
320	E	93.7	Very high	93.2	Very high	132 Å²	132	53.8 Å²	53.8	62%	0.617	26%	0.264	S	S	*	.	I	π-helix	trans	-87.7	-47.7	-173.7	-53.1	-174.1	159.4	0	0	112	D316 Q323	D316-E320 WeakPolarHBondContact O-CA 3.38Å; D316-E320 VanDerWaalsContact O-CB 3.24Å; D316-E320 WeakPolarHBondContact O-CB 3.41Å; D316-E320 PolarHBondContact O-N 3.28Å; E320-Q323 WeakPolarHBondContact O-CG 3.41Å
321	E	93.5	Very high	93.1	Very high	69 Å²	69	59.4 Å²	59.4	32%	0.322	29%	0.289	S	S	.	.	I	π-helix	trans	-80.4	-55.3	-176.7	-61.1	-177.1	-133.4	0	0	111.9	K271 K278 D316 F317	K271-E321 IonicContact NZ-OE1 2.58Å; K271-E321 PolarHBondContact NZ-OE1 2.65Å; K271-E321 IonicContact NZ-OE2 2.71Å; K278-E321 PolarHBondContact NZ-O 2.91Å; D316-E321 PolarHBondContact O-N 2.93Å; F317-E321 HydrophobicContact CD2-CB 4.03Å; F317-E321 HydrophobicContact CD2-CG 4.48Å
322	L	92.8	Very high	93.1	Very high	1 Å²	1	61 Å²	61	1%	0.005	30%	0.296	C	S	.	.	S	Bend	trans	-82.6	-26.3	-179	-67	-174	0	0	0	112.9	F274 Q275 K278 F317 L318 V324	F274-L322 HydrophobicContact CB-CD1 3.95Å; F274-L322 HydrophobicContact CB-CD2 4.22Å; Q275-L322 HydrophobicContact CG-CD2 4Å; K278-L322 HydrophobicContact CB-CD2 4.43Å; K278-L322 HydrophobicContact CD-CD2 4.43Å; K278-L322 WeakPolarHBondContact CD-O 3.06Å; K278-L322 WeakPolarHBondContact CE-O 3.41Å; K278-L322 VanDerWaalsContact NZ-C 3.34Å; K278-L322 PolarHBondContact NZ-O 3.48Å; F317-L322 HydrophobicContact CD1-CD1 4.17Å; F317-L322 HydrophobicContact CD2-CG 4.2Å; F317-L322 HydrophobicContact CE1-CD1 3.55Å; F317-L322 HydrophobicContact CE1-CG 4.15Å; F317-L322 HydrophobicContact CE2-CD1 4.03Å; F317-L322 HydrophobicContact CE2-CD2 3.99Å; F317-L322 HydrophobicContact CE2-CG 3.72Å; F317-L322 HydrophobicContact CZ-CD1 3.48Å; F317-L322 VanDerWaalsContact CZ-CD1 3.48Å; F317-L322 HydrophobicContact CZ-CD2 4.04Å; F317-L322 HydrophobicContact CZ-CG 3.71Å; F317-L322 WeakPolarHBondContact O-CB 3.47Å; F317-L322 WeakPolarHBondContact O-CG 3.47Å; F317-L322 PolarHBondContact O-N 3.41Å; L318-L322 HydrophobicContact CD2-CD1 4.25Å; L322-V324 HydrophobicContact CB-CG1 4Å; L322-V324 HydrophobicContact CB-CG2 4.02Å; L322-V324 WeakPolarHBondContact O-CG1 3.26Å; L322-V324 PolarHBondContact O-N 3.48Å; L322-V324 VanDerWaalsContact O-N 3.16Å
323	Q	93.7	Very high	93.1	Very high	138 Å²	138	56.5 Å²	56.5	65%	0.645	28%	0.276	S	S	*	.			trans	50.7	38.2	179.6	-53.4	172.9	-42.3	0	0	112.9	L318 V319 E320	L318-Q323 PolarHBondContact O-N 2.94Å; V319-Q323 VanDerWaalsContact O-CA 3.27Å; V319-Q323 WeakPolarHBondContact O-CA 3.48Å; V319-Q323 WeakPolarHBondContact O-CG 3.29Å; V319-Q323 PolarHBondContact O-N 3.48Å; E320-Q323 WeakPolarHBondContact O-CG 3.41Å
324	V	91.8	Very high	93.3	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	26%	0.262	C	S	.	.			trans	-96.4	-21.2	-176.8	-68.2	0	0	0	0	112.8	K283 P284 L318 L322	K283-V324 WeakPolarHBondContact CE-O 3.43Å; K283-V324 WeakPolarHBondContact CG-O 3.34Å; P284-V324 HydrophobicContact CG-CG1 3.93Å; L318-V324 HydrophobicContact CD2-CG2 4.29Å; L318-V324 PolarHBondContact O-N 3.32Å; L318-V324 VanDerWaalsContact O-N 3.17Å; L322-V324 HydrophobicContact CB-CG1 4Å; L322-V324 HydrophobicContact CB-CG2 4.02Å; L322-V324 WeakPolarHBondContact O-CG1 3.26Å; L322-V324 PolarHBondContact O-N 3.48Å; L322-V324 VanDerWaalsContact O-N 3.16Å
325	C	90.8	Very high	93.4	Very high	18 Å²	18	52.8 Å²	52.8	12%	0.122	26%	0.262	C	S	.	.	S	Bend	trans	-148.1	164.8	179.5	65.1	0	0	0	0	111.1	E329	C325-E329 HydrophobicContact CB-CB 3.79Å; C325-E329 VanDerWaalsContact CB-OE2 3.23Å; C325-E329 WeakPolarHBondContact CB-OE2 3.45Å
326	D	92.5	Very high	93.4	Very high	85 Å²	85	51.3 Å²	51.3	46%	0.455	26%	0.255	S	S	.	.			trans	-82.4	173.9	171.7	66.9	34.8	0	0	0	111.8	V328 E329 A330	D326-V328 PolarHBondContact O-N 3Å; D326-V328 WeakPolarHBondContact OD1-CA 3.5Å; D326-V328 WeakPolarHBondContact OD1-CB 3.19Å; D326-V328 PolarHBondContact OD1-N 3.46Å; D326-E329 PolarHBondContact O-N 3.13Å; D326-E329 WeakPolarHBondContact OD1-CB 3.42Å; D326-E329 WeakPolarHBondContact OD1-CG 3.25Å; D326-E329 PolarHBondContact OD1-N 2.92Å; D326-A330 VanDerWaalsContact O-CB 3.27Å; D326-A330 WeakPolarHBondContact O-CB 3.46Å; D326-A330 PolarHBondContact O-N 2.86Å
327	E	91.2	Very high	93.5	Very high	131 Å²	131	49 Å²	49	61%	0.612	24%	0.242	S	C	*	.	H	α-helix	trans	-61.2	-31.8	180	-72.5	-171.3	-175.4	0	0	113.3	V319 K331	V319-E327 HydrophobicContact CG1-CG 4.28Å; V319-E327 HydrophobicContact CG2-CG 4.45Å; E327-K331 WeakPolarHBondContact O-CG 3.49Å; E327-K331 PolarHBondContact O-N 3.16Å
328	V	90.4	Very high	93.5	Very high	103 Å²	103	49.1 Å²	49.1	62%	0.624	24%	0.243	S	C	*	.	H	α-helix	trans	-74.2	-47.2	-177.1	179	0	0	0	0	109.8	D326 K331	D326-V328 PolarHBondContact O-N 3Å; D326-V328 WeakPolarHBondContact OD1-CA 3.5Å; D326-V328 WeakPolarHBondContact OD1-CB 3.19Å; D326-V328 PolarHBondContact OD1-N 3.46Å; V328-K331 PolarHBondContact O-N 3.29Å
329	E	89.9	Confident	93.5	Very high	67 Å²	67	49.1 Å²	49.1	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-59.5	-46.5	172.6	-73.8	-175.1	159.8	0	0	110.4	C325 D326 K331 N332 R333	C325-E329 HydrophobicContact CB-CB 3.79Å; C325-E329 VanDerWaalsContact CB-OE2 3.23Å; C325-E329 WeakPolarHBondContact CB-OE2 3.45Å; D326-E329 PolarHBondContact O-N 3.13Å; D326-E329 WeakPolarHBondContact OD1-CB 3.42Å; D326-E329 WeakPolarHBondContact OD1-CG 3.25Å; D326-E329 PolarHBondContact OD1-N 2.92Å; E329-K331 PolarHBondContact O-N 3.2Å; E329-N332 CarbonylContact O-C 3.56Å; E329-N332 WeakPolarHBondContact O-CA 3.37Å; E329-N332 PolarHBondContact O-N 3.01Å; E329-R333 WeakPolarHBondContact O-CG 3.37Å; E329-R333 PolarHBondContact O-N 3.47Å
330	A	92.2	Very high	93.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-56	-36.6	-179.2	0	0	0	0	0	112.8	M315 L318 V319 D326 N332 R333 I334	M315-A330 HydrophobicContact CG-CB 4.38Å; L318-A330 HydrophobicContact CD1-CB 4.44Å; V319-A330 HydrophobicContact CG2-CB 3.68Å; D326-A330 VanDerWaalsContact O-CB 3.27Å; D326-A330 WeakPolarHBondContact O-CB 3.46Å; D326-A330 PolarHBondContact O-N 2.86Å; A330-N332 PolarHBondContact O-N 3.43Å; A330-R333 PolarHBondContact O-N 2.89Å; A330-I334 WeakPolarHBondContact O-CD1 3.13Å; A330-I334 PolarHBondContact O-N 3.31Å
331	K	91.1	Very high	93.2	Very high	126 Å²	126	49.3 Å²	49.3	55%	0.548	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-33.6	176.1	-44.7	-146.9	169.6	160.9	0	112.3	M315 E327 V328 E329 R333	M315-K331 HydrophobicContact CE-CB 3.96Å; M315-K331 HydrophobicContact CE-CD 3.91Å; M315-K331 HydrophobicContact CE-CG 3.48Å; M315-K331 VanDerWaalsContact CE-CG 3.48Å; E327-K331 WeakPolarHBondContact O-CG 3.49Å; E327-K331 PolarHBondContact O-N 3.16Å; V328-K331 PolarHBondContact O-N 3.29Å; E329-K331 PolarHBondContact O-N 3.2Å; K331-R333 VanDerWaalsContact C-N 3.31Å
332	N	93.7	Very high	93.3	Very high	69 Å²	69	46.1 Å²	46.1	37%	0.369	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	8.7	178.8	-64.3	-37.4	0	0	0	113	F287 E329 A330 F335 Q377	F287-N332 WeakPolarHBondContact CE1-O 3.46Å; E329-N332 CarbonylContact O-C 3.56Å; E329-N332 WeakPolarHBondContact O-CA 3.37Å; E329-N332 PolarHBondContact O-N 3.01Å; A330-N332 PolarHBondContact O-N 3.43Å; N332-F335 VanDerWaalsContact O-CE2 3.3Å; N332-F335 WeakPolarHBondContact O-CE2 3.44Å; N332-F335 VanDerWaalsContact O-CZ 3.26Å; N332-F335 WeakPolarHBondContact O-CZ 3.5Å; N332-Q377 HydrophobicContact CB-CG 4.38Å
333	R	95.5	Very high	93.2	Very high	30 Å²	30	46.1 Å²	46.1	11%	0.113	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-14.7	175.7	-60.8	-56.3	-178.7	-178.4	4.4	113.8	F287 I288 L318 E329 A330 K331 C381	F287-R333 CarbonylContact C-O 3.46Å; F287-R333 WeakPolarHBondContact CA-O 3.26Å; F287-R333 HydrophobicContact CD1-CB 4.37Å; I288-R333 PolarHBondContact N-O 3.31Å; L318-R333 HydrophobicContact CD1-CB 3.82Å; L318-R333 HydrophobicContact CD1-CG 4.47Å; E329-R333 WeakPolarHBondContact O-CG 3.37Å; E329-R333 PolarHBondContact O-N 3.47Å; A330-R333 PolarHBondContact O-N 2.89Å; K331-R333 VanDerWaalsContact C-N 3.31Å; R333-C381 VanDerWaalsContact CZ-SG 3.55Å; R333-C381 PolarHBondContact NH1-SG 3.45Å; R333-C381 PolarHBondContact NH2-SG 2.82Å
334	I	96.3	Very high	93.1	Very high	10 Å²	10	40.2 Å²	40.2	5%	0.051	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.8	-170.9	-57.4	159.4	0	0	0	109.2	I288 C314 M315 L318 A330 F336	I288-I334 HydrophobicContact CB-CG1 4.43Å; I288-I334 WeakPolarHBondContact O-CA 3.4Å; C314-I334 HydrophobicContact CB-CD1 3.49Å; C314-I334 VanDerWaalsContact CB-CD1 3.49Å; C314-I334 HydrophobicContact CB-CG1 3.82Å; C314-I334 HydrophobicContact CB-CG2 3.9Å; M315-I334 HydrophobicContact CB-CD1 4.44Å; M315-I334 HydrophobicContact CG-CD1 3.62Å; L318-I334 HydrophobicContact CD1-CD1 4.21Å; L318-I334 HydrophobicContact CD1-CG1 3.99Å; A330-I334 WeakPolarHBondContact O-CD1 3.13Å; A330-I334 PolarHBondContact O-N 3.31Å; I334-F336 HydrophobicContact CG2-CE2 4.25Å
335	F	97.2	Very high	93	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.5	-175.9	-58.5	-91.2	0	0	0	111.9	F287 I288 L289 N290 N332 V337 E370 N373 F374 Q377	F287-F335 HydrophobicContact CD1-CD2 4.32Å; F287-F335 AromaticContact CD1-CE2 3.73Å; F287-F335 HydrophobicContact CD1-CE2 3.73Å; F287-F335 AromaticContact CE1-CE2 3.87Å; F287-F335 HydrophobicContact CE1-CE2 3.87Å; I288-F335 PolarHBondContact O-N 2.92Å; L289-F335 HydrophobicContact CD2-CB 3.82Å; L289-F335 HydrophobicContact CD2-CD2 4.16Å; L289-F335 HydrophobicContact CD2-CG 4.36Å; N290-F335 PolarHBondContact N-O 3.38Å; N332-F335 VanDerWaalsContact O-CE2 3.3Å; N332-F335 WeakPolarHBondContact O-CE2 3.44Å; N332-F335 VanDerWaalsContact O-CZ 3.26Å; N332-F335 WeakPolarHBondContact O-CZ 3.5Å; F335-V337 HydrophobicContact CB-CG1 4.13Å; F335-E370 HydrophobicContact CB-CG 4.13Å; F335-E370 HydrophobicContact CD1-CG 4.12Å; F335-N373 HydrophobicContact CE1-CB 4.32Å; F335-F374 HydrophobicContact CB-CB 4.25Å; F335-F374 HydrophobicContact CD1-CB 3.78Å; F335-F374 HydrophobicContact CD2-CB 3.81Å; F335-F374 AromaticContact CD2-CD2 3.9Å; F335-F374 HydrophobicContact CD2-CD2 3.9Å; F335-F374 HydrophobicContact CD2-CG 4.27Å; F335-F374 HydrophobicContact CE1-CB 4.03Å; F335-F374 HydrophobicContact CE2-CB 4.07Å; F335-F374 HydrophobicContact CE2-CD2 4.03Å; F335-F374 HydrophobicContact CG-CB 3.66Å; F335-F374 HydrophobicContact CZ-CB 4.18Å; F335-Q377 HydrophobicContact CZ-CB 4.09Å; F335-Q377 HydrophobicContact CZ-CG 3.99Å
336	F	95.5	Very high	93	Very high	5 Å²	5	44 Å²	44	2%	0.022	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	105.4	179.2	-68.7	-97.1	0	0	0	110.7	N290 W293 R307 H310 T311 I334 E370	N290-F336 HydrophobicContact CB-CD1 3.67Å; N290-F336 HydrophobicContact CB-CE1 3.9Å; N290-F336 HydrophobicContact CB-CG 4.24Å; W293-F336 HydrophobicContact CB-CB 4.43Å; W293-F336 HydrophobicContact CD2-CB 4.08Å; W293-F336 AromaticContact CD2-CD1 3.7Å; W293-F336 HydrophobicContact CD2-CD1 3.7Å; W293-F336 HydrophobicContact CD2-CG 4.33Å; W293-F336 AromaticContact CE2-CD1 3.79Å; W293-F336 AromaticContact CE3-CD1 3.71Å; W293-F336 HydrophobicContact CE3-CD1 3.71Å; W293-F336 HydrophobicContact CE3-CE1 4.37Å; W293-F336 HydrophobicContact CG-CB 3.88Å; W293-F336 HydrophobicContact CG-CD1 4.36Å; W293-F336 AromaticContact CH2-CD1 3.87Å; W293-F336 HydrophobicContact CH2-CD1 3.87Å; W293-F336 AromaticContact CH2-CE1 3.97Å; W293-F336 HydrophobicContact CH2-CE1 3.97Å; W293-F336 AromaticContact CZ2-CD1 3.89Å; W293-F336 HydrophobicContact CZ2-CD1 3.89Å; W293-F336 HydrophobicContact CZ2-CE1 4.33Å; W293-F336 AromaticContact CZ3-CD1 3.78Å; W293-F336 HydrophobicContact CZ3-CD1 3.78Å; W293-F336 AromaticContact CZ3-CE1 3.99Å; W293-F336 HydrophobicContact CZ3-CE1 3.99Å; R307-F336 HydrophobicContact CG-CD1 4.25Å; R307-F336 HydrophobicContact CG-CD2 3.97Å; R307-F336 HydrophobicContact CG-CE1 4.01Å; R307-F336 HydrophobicContact CG-CE2 3.73Å; R307-F336 HydrophobicContact CG-CG 4.22Å; R307-F336 HydrophobicContact CG-CZ 3.74Å; H310-F336 HydrophobicContact CB-CE1 3.63Å; H310-F336 HydrophobicContact CB-CZ 3.65Å; T311-F336 VanDerWaalsContact OG1-CE2 3.28Å; T311-F336 WeakPolarHBondContact OG1-CE2 3.3Å; T311-F336 WeakPolarHBondContact OG1-CZ 3.22Å; I334-F336 HydrophobicContact CG2-CE2 4.25Å; F336-E370 PolarHBondContact N-OE1 2.99Å; F336-E370 WeakPolarHBondContact O-CG 3.32Å
337	V	95.8	Very high	92.8	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.184	C	C	.	.			trans	-131.3	161.2	-163.3	-61.4	0	0	0	0	113.6	L289 N290 N291 R292 W293 F335 E370 F371	L289-V337 HydrophobicContact CB-CG2 4.25Å; L289-V337 HydrophobicContact CD2-CG2 4.5Å; N290-V337 PolarHBondContact O-N 3.4Å; N291-V337 CarbonylContact C-O 3.48Å; N291-V337 WeakPolarHBondContact CA-O 3.4Å; N291-V337 HydrophobicContact CB-CG2 4.38Å; N291-V337 PolarHBondContact OD1-O 2.89Å; R292-V337 PolarHBondContact N-O 2.95Å; R292-V337 VanDerWaalsContact N-O 3.13Å; W293-V337 WeakPolarHBondContact CB-O 3.35Å; W293-V337 PolarHBondContact N-O 2.86Å; F335-V337 HydrophobicContact CB-CG1 4.13Å; V337-E370 HydrophobicContact CG1-CG 4.25Å; V337-F371 HydrophobicContact CB-CD2 3.88Å; V337-F371 HydrophobicContact CG1-CB 4.09Å; V337-F371 HydrophobicContact CG1-CD2 3.93Å; V337-F371 HydrophobicContact CG1-CG 4.43Å; V337-F371 HydrophobicContact CG2-CD2 4.22Å
338	S	94.9	Very high	92.6	Very high	1 Å²	1	36 Å²	36	1%	0.007	17%	0.165	C	C	.	.			trans	-119.9	95.4	161.8	-174.5	0	0	0	0	110.4	D294 R340 E341 V342	D294-S338 WeakPolarHBondContact OD1-CB 3.49Å; D294-S338 PolarHBondContact OD1-OG 3.47Å; S338-R340 PolarHBondContact O-N 3.16Å; S338-E341 WeakPolarHBondContact CB-OE2 3.4Å; S338-E341 PolarHBondContact O-N 3.1Å; S338-E341 WeakPolarHBondContact OG-CG 3.45Å; S338-E341 PolarHBondContact OG-N 2.88Å; S338-V342 WeakPolarHBondContact O-CG2 3.38Å; S338-V342 PolarHBondContact O-N 3.26Å; S338-V342 VanDerWaalsContact O-N 3.13Å
339	A	95	Very high	92.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.5	-30.3	178.8	0	0	0	0	0	112.5	T145 V146 N291 L343 F371	T145-A339 HydrophobicContact CG2-CB 3.91Å; V146-A339 HydrophobicContact CB-CB 4.36Å; V146-A339 HydrophobicContact CG2-CB 3.6Å; N291-A339 WeakPolarHBondContact OD1-CB 3.4Å; N291-A339 PolarHBondContact OD1-N 3.35Å; A339-L343 VanDerWaalsContact O-CB 3.26Å; A339-L343 WeakPolarHBondContact O-CB 3.38Å; A339-L343 PolarHBondContact O-N 2.84Å; A339-F371 HydrophobicContact CB-CE2 4.39Å
340	R	92.1	Very high	92.1	Very high	149 Å²	149	38.8 Å²	38.8	56%	0.562	16%	0.164	S	C	*	.	H	α-helix	trans	-68.3	-47.5	178.9	-178.8	179.5	171.3	-178.4	-3.8	111.4	T145 S338 C344	T145-R340 HydrophobicContact CG2-CB 4.43Å; S338-R340 PolarHBondContact O-N 3.16Å; R340-C344 WeakPolarHBondContact O-CB 3.42Å; R340-C344 PolarHBondContact O-N 3.39Å; R340-C344 PolarHBondContact O-SG 3.39Å
341	E	92.1	Very high	91.6	Very high	21 Å²	21	42 Å²	42	10%	0.098	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-46.9	176.8	-71.5	-178.9	148.6	0	0	110.9	S338 L343 C344 R345 M358 R367	S338-E341 WeakPolarHBondContact CB-OE2 3.4Å; S338-E341 PolarHBondContact O-N 3.1Å; S338-E341 WeakPolarHBondContact OG-CG 3.45Å; S338-E341 PolarHBondContact OG-N 2.88Å; E341-L343 PolarHBondContact O-N 3.4Å; E341-C344 PolarHBondContact O-N 3.31Å; E341-R345 WeakPolarHBondContact O-CB 3.32Å; E341-R345 PolarHBondContact O-N 3.35Å; E341-M358 HydrophobicContact CG-CE 4.42Å; E341-R367 VanDerWaalsContact CD-NH2 3.3Å; E341-R367 IonicContact OE1-CZ 2.67Å; E341-R367 IonicContact OE1-NE 2.66Å; E341-R367 IonicContact OE1-NH2 3.74Å; E341-R367 PolarHBondContact OE1-NH2 2.9Å; E341-R367 IonicContact OE2-CZ 3.74Å; E341-R367 VanDerWaalsContact OE2-CZ 3.31Å; E341-R367 IonicContact OE2-NE 3.98Å; E341-R367 PolarHBondContact OE2-NE 3.44Å; E341-R367 IonicContact OE2-NH2 3.51Å; E341-R367 PolarHBondContact OE2-NH2 3.07Å; E341-R367 VanDerWaalsContact OE2-NH2 3.07Å
342	V	94	Very high	90.9	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-48.1	179.3	176.1	0	0	0	0	111.3	A149 S338 C344 R345 R346 L368 F371	A149-V342 HydrophobicContact CB-CB 4.38Å; A149-V342 HydrophobicContact CB-CG1 4.06Å; S338-V342 WeakPolarHBondContact O-CG2 3.38Å; S338-V342 PolarHBondContact O-N 3.26Å; S338-V342 VanDerWaalsContact O-N 3.13Å; V342-C344 PolarHBondContact O-N 3.19Å; V342-R345 PolarHBondContact O-N 3.3Å; V342-R346 HydrophobicContact CG1-CG 4.46Å; V342-R346 VanDerWaalsContact CG1-NE 3.34Å; V342-R346 WeakPolarHBondContact O-CB 3.44Å; V342-R346 VanDerWaalsContact O-CG 3.29Å; V342-R346 WeakPolarHBondContact O-CG 3.3Å; V342-R346 PolarHBondContact O-N 3.25Å; V342-L368 HydrophobicContact CB-CD1 4.41Å; V342-L368 HydrophobicContact CG1-CD1 4.09Å; V342-L368 HydrophobicContact CG2-CD1 3.92Å; V342-F371 HydrophobicContact CB-CD2 4.4Å; V342-F371 HydrophobicContact CB-CG 4.34Å; V342-F371 HydrophobicContact CG1-CD1 3.8Å; V342-F371 HydrophobicContact CG1-CD2 4.42Å; V342-F371 HydrophobicContact CG1-CE1 4.02Å; V342-F371 HydrophobicContact CG1-CG 4.02Å; V342-F371 HydrophobicContact CG1-CZ 4.44Å; V342-F371 HydrophobicContact CG2-CB 3.74Å; V342-F371 HydrophobicContact CG2-CD1 4.39Å; V342-F371 HydrophobicContact CG2-CD2 3.94Å; V342-F371 HydrophobicContact CG2-CG 3.77Å
343	L	92.5	Very high	89.9	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-48.9	176.6	176.7	58.3	0	0	0	111.3	T145 N148 A149 Y158 A339 E341 R345 R346 L347	T145-L343 HydrophobicContact CG2-CD2 4.15Å; N148-L343 HydrophobicContact CB-CD1 3.99Å; N148-L343 HydrophobicContact CB-CD2 3.85Å; A149-L343 HydrophobicContact CB-CB 4.12Å; Y158-L343 HydrophobicContact CD2-CD2 4.14Å; Y158-L343 HydrophobicContact CE2-CD2 4.1Å; Y158-L343 HydrophobicContact CG-CD2 4.5Å; A339-L343 VanDerWaalsContact O-CB 3.26Å; A339-L343 WeakPolarHBondContact O-CB 3.38Å; A339-L343 PolarHBondContact O-N 2.84Å; E341-L343 PolarHBondContact O-N 3.4Å; L343-R345 VanDerWaalsContact C-N 3.34Å; L343-R345 PolarHBondContact O-N 3.31Å; L343-R346 PolarHBondContact O-N 3.03Å; L343-L347 HydrophobicContact CD1-CD1 3.77Å; L343-L347 HydrophobicContact CD1-CD2 4.48Å; L343-L347 HydrophobicContact CD1-CG 3.94Å; L343-L347 HydrophobicContact CG-CD1 3.84Å; L343-L347 HydrophobicContact CG-CG 4.43Å; L343-L347 WeakPolarHBondContact O-CB 3.02Å; L343-L347 VanDerWaalsContact O-CG 3.23Å; L343-L347 WeakPolarHBondContact O-CG 3.12Å; L343-L347 PolarHBondContact O-N 3.47Å
344	C	90.6	Very high	88.5	Confident	13 Å²	13	40 Å²	40	9%	0.088	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-45.6	-180	-68.6	0	0	0	0	111.2	R340 E341 V342 R346 L347 Q348	R340-C344 WeakPolarHBondContact O-CB 3.42Å; R340-C344 PolarHBondContact O-N 3.39Å; R340-C344 PolarHBondContact O-SG 3.39Å; E341-C344 PolarHBondContact O-N 3.31Å; V342-C344 PolarHBondContact O-N 3.19Å; C344-R346 PolarHBondContact O-N 3.45Å; C344-L347 PolarHBondContact O-N 3.16Å; C344-Q348 VanDerWaalsContact O-CG 3.29Å; C344-Q348 WeakPolarHBondContact O-CG 3.32Å; C344-Q348 PolarHBondContact O-N 2.99Å
345	R	89.3	Confident	86.8	Confident	99 Å²	99	44.9 Å²	44.9	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-61	-43.6	178.2	-174.3	65.9	171.2	112.9	-2.9	112.2	E341 V342 L343 Q348 R349 L368	E341-R345 WeakPolarHBondContact O-CB 3.32Å; E341-R345 PolarHBondContact O-N 3.35Å; V342-R345 PolarHBondContact O-N 3.3Å; L343-R345 VanDerWaalsContact C-N 3.34Å; L343-R345 PolarHBondContact O-N 3.31Å; R345-Q348 PolarHBondContact O-N 2.9Å; R345-R349 WeakPolarHBondContact O-CG 3.2Å; R345-R349 PolarHBondContact O-N 3.43Å; R345-L368 HydrophobicContact CG-CD2 4.28Å
346	R	90.9	Very high	85	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-40.2	178.7	-72.7	172	178.6	-170.1	-3.3	112	A149 H152 V342 L343 C344 R349 K350 E375	A149-R346 WeakPolarHBondContact O-CD 3.25Å; A149-R346 PolarHBondContact O-NH1 3.38Å; H152-R346 HydrophobicContact CB-CB 4.47Å; H152-R346 PolarHBondContact CD2-NH1 3.12Å; H152-R346 VanDerWaalsContact NE2-CZ 3.27Å; H152-R346 PolarHBondContact NE2-NE 3.43Å; H152-R346 PolarHBondContact NE2-NH1 3.03Å; H152-R346 VanDerWaalsContact NE2-NH1 3.18Å; V342-R346 HydrophobicContact CG1-CG 4.46Å; V342-R346 VanDerWaalsContact CG1-NE 3.34Å; V342-R346 WeakPolarHBondContact O-CB 3.44Å; V342-R346 VanDerWaalsContact O-CG 3.29Å; V342-R346 WeakPolarHBondContact O-CG 3.3Å; V342-R346 PolarHBondContact O-N 3.25Å; L343-R346 PolarHBondContact O-N 3.03Å; C344-R346 PolarHBondContact O-N 3.45Å; R346-R349 PolarHBondContact O-N 2.84Å; R346-K350 PolarHBondContact O-N 3.2Å; R346-E375 IonicContact CZ-OE1 3.71Å; R346-E375 IonicContact CZ-OE2 3.92Å; R346-E375 IonicContact NH1-OE1 2.68Å; R346-E375 PolarHBondContact NH1-OE1 2.91Å; R346-E375 IonicContact NH1-OE2 3.56Å; R346-E375 IonicContact NH2-OE1 2.9Å; R346-E375 PolarHBondContact NH2-OE1 3.45Å; R346-E375 IonicContact NH2-OE2 2.85Å; R346-E375 PolarHBondContact NH2-OE2 3.02Å
347	L	89	Confident	83.5	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-37.1	175.6	-68.2	169.8	0	0	0	112.6	K154 L343 C344 K350 G351 I352 A353	K154-L347 HydrophobicContact CD-CD1 4.14Å; K154-L347 HydrophobicContact CG-CD1 3.81Å; K154-L347 HydrophobicContact CG-CD2 4.13Å; L343-L347 HydrophobicContact CD1-CD1 3.77Å; L343-L347 HydrophobicContact CD1-CD2 4.48Å; L343-L347 HydrophobicContact CD1-CG 3.94Å; L343-L347 HydrophobicContact CG-CD1 3.84Å; L343-L347 HydrophobicContact CG-CG 4.43Å; L343-L347 WeakPolarHBondContact O-CB 3.02Å; L343-L347 VanDerWaalsContact O-CG 3.23Å; L343-L347 WeakPolarHBondContact O-CG 3.12Å; L343-L347 PolarHBondContact O-N 3.47Å; C344-L347 PolarHBondContact O-N 3.16Å; L347-K350 PolarHBondContact O-N 3.46Å; L347-G351 PolarHBondContact O-N 3.4Å; L347-I352 HydrophobicContact CD2-CB 4.39Å; L347-I352 HydrophobicContact CD2-CD1 4.09Å; L347-I352 HydrophobicContact CD2-CG2 4.37Å; L347-I352 PolarHBondContact O-N 3.14Å; L347-A353 HydrophobicContact CB-CB 3.9Å; L347-A353 PolarHBondContact O-N 2.96Å
348	Q	86.9	Confident	82.1	Confident	48 Å²	48	55.2 Å²	55.2	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-45.4	171.9	-74.6	172.3	-10.6	0	0	111.2	C344 R345 K350 G351 A353 S354 P355	C344-Q348 VanDerWaalsContact O-CG 3.29Å; C344-Q348 WeakPolarHBondContact O-CG 3.32Å; C344-Q348 PolarHBondContact O-N 2.99Å; R345-Q348 PolarHBondContact O-N 2.9Å; Q348-K350 PolarHBondContact O-N 3.25Å; Q348-G351 PolarHBondContact O-N 3.12Å; Q348-A353 HydrophobicContact CG-CB 4.16Å; Q348-S354 PolarHBondContact NE2-O 3.23Å; Q348-P355 PolarHBondContact NE2-O 2.91Å
349	R	85.7	Confident	80.6	Confident	135 Å²	135	60 Å²	60	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-32.1	175.5	-74.4	-179.9	179.2	168.5	1.5	112.6	R345 R346 G351	R345-R349 WeakPolarHBondContact O-CG 3.2Å; R345-R349 PolarHBondContact O-N 3.43Å; R346-R349 PolarHBondContact O-N 2.84Å; R349-G351 VanDerWaalsContact C-N 3.31Å
350	K	83.9	Confident	79.2	Confident	93 Å²	93	66.7 Å²	66.7	40%	0.404	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-2.7	173.2	-75.9	-170.9	172.3	-178.9	0	114.3	H152 D220 R346 L347 Q348 I352	H152-K350 WeakPolarHBondContact O-CD 3.4Å; H152-K350 WeakPolarHBondContact O-CE 3.46Å; H152-K350 PolarHBondContact O-NZ 3.08Å; D220-K350 PolarHBondContact O-NZ 3.44Å; D220-K350 VanDerWaalsContact O-NZ 3.16Å; R346-K350 PolarHBondContact O-N 3.2Å; L347-K350 PolarHBondContact O-N 3.46Å; Q348-K350 PolarHBondContact O-N 3.25Å; K350-I352 VanDerWaalsContact C-N 3.27Å; K350-I352 HydrophobicContact CB-CD1 3.92Å; K350-I352 HydrophobicContact CB-CG1 4.07Å; K350-I352 HydrophobicContact CD-CD1 4.23Å; K350-I352 PolarHBondContact O-N 3.26Å
351	G	80.9	Confident	78.4	Confident	67 Å²	67	62.4 Å²	62.4	69%	0.691	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	13	-177.8	0	0	0	0	0	115.1	L347 Q348 R349	L347-G351 PolarHBondContact O-N 3.4Å; Q348-G351 PolarHBondContact O-N 3.12Å; R349-G351 VanDerWaalsContact C-N 3.31Å
352	I	78.1	Confident	77.7	Confident	107 Å²	107	68.9 Å²	68.9	55%	0.549	39%	0.389	S	S	.	.	S	Bend	trans	-86	-30.1	-177.5	-60.6	170.3	0	0	0	111.4	L347 K350	L347-I352 HydrophobicContact CD2-CB 4.39Å; L347-I352 HydrophobicContact CD2-CD1 4.09Å; L347-I352 HydrophobicContact CD2-CG2 4.37Å; L347-I352 PolarHBondContact O-N 3.14Å; K350-I352 VanDerWaalsContact C-N 3.27Å; K350-I352 HydrophobicContact CB-CD1 3.92Å; K350-I352 HydrophobicContact CB-CG1 4.07Å; K350-I352 HydrophobicContact CD-CD1 4.23Å; K350-I352 PolarHBondContact O-N 3.26Å
353	A	72.4	Confident	77.3	Confident	15 Å²	15	70.1 Å²	70.1	12%	0.124	40%	0.402	C	S	.	.	S	Bend	trans	-118.5	143	-175.9	0	0	0	0	0	111.6	L347 Q348 L357	L347-A353 HydrophobicContact CB-CB 3.9Å; L347-A353 PolarHBondContact O-N 2.96Å; Q348-A353 HydrophobicContact CG-CB 4.16Å; A353-L357 HydrophobicContact CB-CD1 4.32Å
354	S	65.5	Low	77	Confident	60 Å²	60	71 Å²	71	42%	0.42	41%	0.409	S	S	.	.			trans	-61.9	142.3	175.8	-177.9	0	0	0	0	111.3	Q348 S356 L357	Q348-S354 PolarHBondContact NE2-O 3.23Å; S354-S356 PolarHBondContact O-N 2.85Å; S354-S356 PolarHBondContact OG-N 3.21Å; S354-S356 PolarHBondContact OG-OG 3.5Å; S354-L357 PolarHBondContact O-N 2.88Å
355	P	60.9	Low	77	Confident	114 Å²	114	75.3 Å²	75.3	74%	0.74	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-54.2	-24.6	173.3	-24.5	32.9	0	0	0	113.7	Q348 L357	Q348-P355 PolarHBondContact NE2-O 2.91Å; P355-L357 VanDerWaalsContact C-N 3.32Å; P355-L357 PolarHBondContact O-N 3.43Å
356	S	59.6	Low	77.1	Confident	100 Å²	100	76.8 Å²	76.8	70%	0.699	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-80	1.1	-178.3	60.3	0	0	0	0	115.7	S354 M358	S354-S356 PolarHBondContact O-N 2.85Å; S354-S356 PolarHBondContact OG-N 3.21Å; S354-S356 PolarHBondContact OG-OG 3.5Å; S356-M358 VanDerWaalsContact C-N 3.3Å; S356-M358 PolarHBondContact O-N 3.38Å
357	L	63.8	Low	77.2	Confident	87 Å²	87	76.9 Å²	76.9	46%	0.455	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-65	-29	-170.6	-127.2	93	0	0	0	114.5	A353 S354 P355	A353-L357 HydrophobicContact CB-CD1 4.32Å; S354-L357 PolarHBondContact O-N 2.88Å; P355-L357 VanDerWaalsContact C-N 3.32Å; P355-L357 PolarHBondContact O-N 3.43Å
358	M	65.4	Low	77.4	Confident	38 Å²	38	77.2 Å²	77.2	19%	0.187	44%	0.441	C	S	.	.	S	Bend	trans	-150.9	131	178.7	-82.7	-75.7	-73.6	0	0	109.5	E341 S356	E341-M358 HydrophobicContact CG-CE 4.42Å; S356-M358 VanDerWaalsContact C-N 3.3Å; S356-M358 PolarHBondContact O-N 3.38Å
359	P	63.7	Low	77.8	Confident	102 Å²	102	80.5 Å²	80.5	66%	0.662	46%	0.456	S	S	*	.			trans	-59.6	136.8	167	-16.7	29.2	0	0	0	109.9	M361	P359-M361 WeakPolarHBondContact O-CG 3.37Å; P359-M361 PolarHBondContact O-N 3.36Å
360	V	67.1	Low	78.3	Confident	140 Å²	140	76 Å²	76	85%	0.848	44%	0.441	S	S	*	.			trans	-65.2	109.3	172.4	-179.5	0	0	0	0	107.6	A364	V360-A364 HydrophobicContact CG1-CB 4.45Å
361	M	74.3	Confident	79	Confident	58 Å²	58	71.6 Å²	71.6	29%	0.286	42%	0.422	S	S	.	.			trans	-85.3	154.5	179.1	-50.6	-155.8	92.6	0	0	110.1	M298 P359 G363 A364	M298-M361 HydrophobicContact CE-CE 3.39Å; M298-M361 HydrophobicContact CE-SD 4.44Å; M298-M361 HydrophobicContact CG-CE 4.36Å; M298-M361 HydrophobicContact SD-CE 3.28Å; M298-M361 WeakPolarHBondContact SD-CE 3.38Å; M298-M361 HydrophobicContact SD-SD 3.57Å; P359-M361 WeakPolarHBondContact O-CG 3.37Å; P359-M361 PolarHBondContact O-N 3.36Å; M361-G363 PolarHBondContact O-N 3.33Å; M361-A364 VanDerWaalsContact O-CB 3.23Å; M361-A364 WeakPolarHBondContact O-CB 3.16Å; M361-A364 PolarHBondContact O-N 2.91Å; M361-A364 VanDerWaalsContact O-N 3.14Å
362	N	78.2	Confident	79.7	Confident	158 Å²	158	71.7 Å²	71.7	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	136.7	175.7	-72.9	-15	0	0	0	110.6	A364 R367	N362-A364 VanDerWaalsContact C-N 3.29Å; N362-A364 PolarHBondContact O-N 3.41Å; N362-R367 PolarHBondContact O-NH1 3.12Å; N362-R367 PolarHBondContact O-NH2 3.35Å
363	G	84.3	Confident	80.5	Confident	27 Å²	27	68.9 Å²	68.9	28%	0.278	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	6.7	-177.5	0	0	0	0	0	115.7	M361 E365 E366 R367	M361-G363 PolarHBondContact O-N 3.33Å; G363-E365 VanDerWaalsContact C-N 3.28Å; G363-E365 PolarHBondContact O-N 3.2Å; G363-E366 PolarHBondContact O-N 2.91Å; G363-R367 VanDerWaalsContact C-NH1 3.34Å; G363-R367 PolarHBondContact O-N 3.48Å; G363-R367 VanDerWaalsContact O-N 3.12Å; G363-R367 PolarHBondContact O-NH1 3.09Å
364	A	86.9	Confident	81.7	Confident	20 Å²	20	68.1 Å²	68.1	17%	0.165	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-33.6	178.2	0	0	0	0	0	112.9	V360 M361 N362 L368	V360-A364 HydrophobicContact CG1-CB 4.45Å; M361-A364 VanDerWaalsContact O-CB 3.23Å; M361-A364 WeakPolarHBondContact O-CB 3.16Å; M361-A364 PolarHBondContact O-N 2.91Å; M361-A364 VanDerWaalsContact O-N 3.14Å; N362-A364 VanDerWaalsContact C-N 3.29Å; N362-A364 PolarHBondContact O-N 3.41Å; A364-L368 WeakPolarHBondContact O-CB 3.26Å; A364-L368 PolarHBondContact O-N 3.37Å
365	E	90	Very high	83.2	Confident	104 Å²	104	66.7 Å²	66.7	49%	0.486	37%	0.371	S	S	.	.	H	α-helix	trans	-69.6	-42.5	176.9	-160.4	66.2	-158.2	0	0	111.4	G363 R367 L368 E369	G363-E365 VanDerWaalsContact C-N 3.28Å; G363-E365 PolarHBondContact O-N 3.2Å; E365-R367 VanDerWaalsContact C-N 3.31Å; E365-R367 PolarHBondContact O-N 3.45Å; E365-L368 WeakPolarHBondContact O-CB 3.19Å; E365-L368 PolarHBondContact O-N 2.95Å; E365-L368 VanDerWaalsContact O-N 3.1Å; E365-E369 WeakPolarHBondContact O-CG 3.5Å; E365-E369 PolarHBondContact O-N 2.97Å
366	E	91.7	Very high	84.8	Confident	131 Å²	131	68 Å²	68	61%	0.612	36%	0.361	S	S	*	.	H	α-helix	trans	-60.6	-39.8	175.3	-64	175.4	-170.1	0	0	111.9	G363 L368 E369 E370	G363-E366 PolarHBondContact O-N 2.91Å; E366-L368 VanDerWaalsContact C-N 3.35Å; E366-E369 PolarHBondContact O-N 2.66Å; E366-E370 WeakPolarHBondContact O-CB 3.4Å; E366-E370 PolarHBondContact O-N 2.92Å
367	R	92.7	Very high	86.5	Confident	9 Å²	9	65.5 Å²	65.5	3%	0.034	34%	0.339	C	S	.	.	H	α-helix	trans	-69.1	-32.6	175.7	-69.4	-173.5	-64	-87.8	6.3	112.5	E341 N362 G363 E365 F371	E341-R367 VanDerWaalsContact CD-NH2 3.3Å; E341-R367 IonicContact OE1-CZ 2.67Å; E341-R367 IonicContact OE1-NE 2.66Å; E341-R367 IonicContact OE1-NH2 3.74Å; E341-R367 PolarHBondContact OE1-NH2 2.9Å; E341-R367 IonicContact OE2-CZ 3.74Å; E341-R367 VanDerWaalsContact OE2-CZ 3.31Å; E341-R367 IonicContact OE2-NE 3.98Å; E341-R367 PolarHBondContact OE2-NE 3.44Å; E341-R367 IonicContact OE2-NH2 3.51Å; E341-R367 PolarHBondContact OE2-NH2 3.07Å; E341-R367 VanDerWaalsContact OE2-NH2 3.07Å; N362-R367 PolarHBondContact O-NH1 3.12Å; N362-R367 PolarHBondContact O-NH2 3.35Å; G363-R367 VanDerWaalsContact C-NH1 3.34Å; G363-R367 PolarHBondContact O-N 3.48Å; G363-R367 VanDerWaalsContact O-N 3.12Å; G363-R367 PolarHBondContact O-NH1 3.09Å; E365-R367 VanDerWaalsContact C-N 3.31Å; E365-R367 PolarHBondContact O-N 3.45Å; R367-F371 PolarHBondContact O-N 3.12Å; R367-F371 VanDerWaalsContact O-N 3.07Å
368	L	93.8	Very high	88.1	Confident	8 Å²	8	61.4 Å²	61.4	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-67.6	-46.5	172.6	177.8	62.5	0	0	0	110.6	V342 R345 A364 E365 E366 E370 F371 E372	V342-L368 HydrophobicContact CB-CD1 4.41Å; V342-L368 HydrophobicContact CG1-CD1 4.09Å; V342-L368 HydrophobicContact CG2-CD1 3.92Å; R345-L368 HydrophobicContact CG-CD2 4.28Å; A364-L368 WeakPolarHBondContact O-CB 3.26Å; A364-L368 PolarHBondContact O-N 3.37Å; E365-L368 WeakPolarHBondContact O-CB 3.19Å; E365-L368 PolarHBondContact O-N 2.95Å; E365-L368 VanDerWaalsContact O-N 3.1Å; E366-L368 VanDerWaalsContact C-N 3.35Å; L368-E370 VanDerWaalsContact C-N 3.33Å; L368-E370 PolarHBondContact O-N 3.47Å; L368-F371 PolarHBondContact O-N 2.78Å; L368-F371 VanDerWaalsContact O-N 3.17Å; L368-E372 HydrophobicContact CD1-CG 4.45Å; L368-E372 WeakPolarHBondContact O-CG 3.41Å; L368-E372 PolarHBondContact O-N 2.84Å
369	E	95.7	Very high	89.5	Confident	117 Å²	117	60.6 Å²	60.6	55%	0.547	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-41.9	175.4	-73	-178.8	-177.2	0	0	111.7	E365 E366 F371 E372 N373	E365-E369 WeakPolarHBondContact O-CG 3.5Å; E365-E369 PolarHBondContact O-N 2.97Å; E366-E369 PolarHBondContact O-N 2.66Å; E369-F371 PolarHBondContact O-N 3.23Å; E369-E372 PolarHBondContact O-N 3.37Å; E369-N373 WeakPolarHBondContact O-CB 3.35Å; E369-N373 PolarHBondContact O-N 2.73Å
370	E	95.7	Very high	90.9	Very high	41 Å²	41	59.5 Å²	59.5	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-41.8	174.9	-171.6	95.1	159.8	0	0	111.4	R307 F335 F336 V337 E366 L368 N373 F374	R307-E370 VanDerWaalsContact NH2-CD 3.31Å; R307-E370 IonicContact NH2-OE1 3.84Å; R307-E370 PolarHBondContact NH2-OE1 3.37Å; R307-E370 IonicContact NH2-OE2 2.73Å; R307-E370 PolarHBondContact NH2-OE2 2.92Å; F335-E370 HydrophobicContact CB-CG 4.13Å; F335-E370 HydrophobicContact CD1-CG 4.12Å; F336-E370 PolarHBondContact N-OE1 2.99Å; F336-E370 WeakPolarHBondContact O-CG 3.32Å; V337-E370 HydrophobicContact CG1-CG 4.25Å; E366-E370 WeakPolarHBondContact O-CB 3.4Å; E366-E370 PolarHBondContact O-N 2.92Å; L368-E370 VanDerWaalsContact C-N 3.33Å; L368-E370 PolarHBondContact O-N 3.47Å; E370-N373 PolarHBondContact O-N 3.34Å; E370-F374 PolarHBondContact O-N 3.46Å
371	F	97.4	Very high	92.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-41.2	176.6	-164.5	-77.7	0	0	0	111.8	V146 A149 M150 V337 A339 V342 R367 L368 E369 N373 F374 E375	V146-F371 HydrophobicContact CG1-CZ 4.41Å; A149-F371 HydrophobicContact CB-CE1 4.27Å; A149-F371 HydrophobicContact CB-CE2 4.27Å; A149-F371 HydrophobicContact CB-CZ 3.7Å; M150-F371 HydrophobicContact CG-CE1 4.02Å; M150-F371 HydrophobicContact CG-CZ 3.89Å; V337-F371 HydrophobicContact CB-CD2 3.88Å; V337-F371 HydrophobicContact CG1-CB 4.09Å; V337-F371 HydrophobicContact CG1-CD2 3.93Å; V337-F371 HydrophobicContact CG1-CG 4.43Å; V337-F371 HydrophobicContact CG2-CD2 4.22Å; A339-F371 HydrophobicContact CB-CE2 4.39Å; V342-F371 HydrophobicContact CB-CD2 4.4Å; V342-F371 HydrophobicContact CB-CG 4.34Å; V342-F371 HydrophobicContact CG1-CD1 3.8Å; V342-F371 HydrophobicContact CG1-CD2 4.42Å; V342-F371 HydrophobicContact CG1-CE1 4.02Å; V342-F371 HydrophobicContact CG1-CG 4.02Å; V342-F371 HydrophobicContact CG1-CZ 4.44Å; V342-F371 HydrophobicContact CG2-CB 3.74Å; V342-F371 HydrophobicContact CG2-CD1 4.39Å; V342-F371 HydrophobicContact CG2-CD2 3.94Å; V342-F371 HydrophobicContact CG2-CG 3.77Å; R367-F371 PolarHBondContact O-N 3.12Å; R367-F371 VanDerWaalsContact O-N 3.07Å; L368-F371 PolarHBondContact O-N 2.78Å; L368-F371 VanDerWaalsContact O-N 3.17Å; E369-F371 PolarHBondContact O-N 3.23Å; F371-N373 VanDerWaalsContact C-N 3.3Å; F371-N373 PolarHBondContact O-N 3.08Å; F371-F374 HydrophobicContact CE1-CD1 4.45Å; F371-F374 WeakPolarHBondContact O-CB 3.26Å; F371-F374 PolarHBondContact O-N 3.07Å; F371-E375 HydrophobicContact CD1-CG 4.06Å; F371-E375 HydrophobicContact CE1-CG 3.93Å; F371-E375 WeakPolarHBondContact CE1-OE1 3.45Å; F371-E375 PolarHBondContact O-N 3.43Å
372	E	95.8	Very high	93.3	Very high	70 Å²	70	50.6 Å²	50.6	33%	0.327	25%	0.251	S	S	.	.	H	α-helix	trans	-65.8	-34.2	175.1	-70.4	-179.4	172.6	0	0	111.5	L368 E369 E375 R376	L368-E372 HydrophobicContact CD1-CG 4.45Å; L368-E372 WeakPolarHBondContact O-CG 3.41Å; L368-E372 PolarHBondContact O-N 2.84Å; E369-E372 PolarHBondContact O-N 3.37Å; E372-E375 PolarHBondContact O-N 3.28Å; E372-R376 PolarHBondContact O-N 3.1Å
373	N	96.3	Very high	94	Very high	47 Å²	47	43.1 Å²	43.1	25%	0.251	21%	0.211	S	C	.	.	H	α-helix	trans	-67.6	-41.1	172.7	-169.1	41.5	0	0	0	112	F335 E369 E370 F371 E375 R376 Q377	F335-N373 HydrophobicContact CE1-CB 4.32Å; E369-N373 WeakPolarHBondContact O-CB 3.35Å; E369-N373 PolarHBondContact O-N 2.73Å; E370-N373 PolarHBondContact O-N 3.34Å; F371-N373 VanDerWaalsContact C-N 3.3Å; F371-N373 PolarHBondContact O-N 3.08Å; N373-E375 PolarHBondContact O-N 2.96Å; N373-R376 PolarHBondContact O-N 3.09Å; N373-R376 PolarHBondContact OD1-NH1 3.39Å; N373-Q377 WeakPolarHBondContact O-CG 3.4Å; N373-Q377 PolarHBondContact O-N 2.8Å
374	F	96.9	Very high	94.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-54.7	-51.3	170	155.5	-111.1	0	0	0	111	M150 V257 F287 L289 F335 E370 F371 R376 Q377 F378	M150-F374 HydrophobicContact CE-CE1 4.13Å; M150-F374 HydrophobicContact CE-CZ 4.25Å; M150-F374 HydrophobicContact CG-CE1 4.32Å; M150-F374 HydrophobicContact SD-CE1 3.74Å; M150-F374 HydrophobicContact SD-CZ 4.04Å; V257-F374 HydrophobicContact CG1-CZ 4.44Å; V257-F374 HydrophobicContact CG2-CZ 4.39Å; F287-F374 HydrophobicContact CB-CE2 4.23Å; F287-F374 AromaticContact CD1-CD2 3.96Å; F287-F374 HydrophobicContact CD1-CD2 3.96Å; F287-F374 HydrophobicContact CD1-CE2 4.01Å; F287-F374 HydrophobicContact CE1-CD2 4.36Å; F287-F374 HydrophobicContact CG-CE2 4.12Å; L289-F374 HydrophobicContact CD1-CD1 4.34Å; L289-F374 HydrophobicContact CD1-CE1 3.92Å; L289-F374 HydrophobicContact CD1-CE2 4.29Å; L289-F374 HydrophobicContact CD1-CZ 3.89Å; L289-F374 HydrophobicContact CD2-CB 4.3Å; L289-F374 HydrophobicContact CD2-CD1 4.1Å; L289-F374 HydrophobicContact CD2-CD2 3.64Å; L289-F374 HydrophobicContact CD2-CE1 4.37Å; L289-F374 HydrophobicContact CD2-CE2 3.93Å; L289-F374 HydrophobicContact CD2-CG 3.72Å; L289-F374 HydrophobicContact CD2-CZ 4.3Å; L289-F374 HydrophobicContact CG-CE2 4.36Å; L289-F374 HydrophobicContact CG-CZ 4.46Å; F335-F374 HydrophobicContact CB-CB 4.25Å; F335-F374 HydrophobicContact CD1-CB 3.78Å; F335-F374 HydrophobicContact CD2-CB 3.81Å; F335-F374 AromaticContact CD2-CD2 3.9Å; F335-F374 HydrophobicContact CD2-CD2 3.9Å; F335-F374 HydrophobicContact CD2-CG 4.27Å; F335-F374 HydrophobicContact CE1-CB 4.03Å; F335-F374 HydrophobicContact CE2-CB 4.07Å; F335-F374 HydrophobicContact CE2-CD2 4.03Å; F335-F374 HydrophobicContact CG-CB 3.66Å; F335-F374 HydrophobicContact CZ-CB 4.18Å; E370-F374 PolarHBondContact O-N 3.46Å; F371-F374 HydrophobicContact CE1-CD1 4.45Å; F371-F374 WeakPolarHBondContact O-CB 3.26Å; F371-F374 PolarHBondContact O-N 3.07Å; F374-R376 VanDerWaalsContact C-N 3.29Å; F374-R376 PolarHBondContact O-N 3.44Å; F374-Q377 PolarHBondContact O-N 2.94Å; F374-F378 HydrophobicContact CD2-CB 4.39Å; F374-F378 HydrophobicContact CE2-CB 4Å; F374-F378 HydrophobicContact CZ-CB 4.27Å; F374-F378 HydrophobicContact CZ-CG 4.48Å; F374-F378 VanDerWaalsContact O-CB 3.25Å; F374-F378 WeakPolarHBondContact O-CB 3.32Å; F374-F378 PolarHBondContact O-N 3Å
375	E	96.3	Very high	94.8	Very high	29 Å²	29	45.6 Å²	45.6	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-41.4	179.8	-74.9	-180	145.3	0	0	111.8	R346 F371 E372 N373 F378 E379	R346-E375 IonicContact CZ-OE1 3.71Å; R346-E375 IonicContact CZ-OE2 3.92Å; R346-E375 IonicContact NH1-OE1 2.68Å; R346-E375 PolarHBondContact NH1-OE1 2.91Å; R346-E375 IonicContact NH1-OE2 3.56Å; R346-E375 IonicContact NH2-OE1 2.9Å; R346-E375 PolarHBondContact NH2-OE1 3.45Å; R346-E375 IonicContact NH2-OE2 2.85Å; R346-E375 PolarHBondContact NH2-OE2 3.02Å; F371-E375 HydrophobicContact CD1-CG 4.06Å; F371-E375 HydrophobicContact CE1-CG 3.93Å; F371-E375 WeakPolarHBondContact CE1-OE1 3.45Å; F371-E375 PolarHBondContact O-N 3.43Å; E372-E375 PolarHBondContact O-N 3.28Å; N373-E375 PolarHBondContact O-N 2.96Å; E375-F378 WeakPolarHBondContact O-CB 3.49Å; E375-F378 PolarHBondContact O-N 3.4Å; E375-E379 WeakPolarHBondContact O-CB 3.33Å; E375-E379 WeakPolarHBondContact O-CG 3.25Å; E375-E379 PolarHBondContact O-N 3.39Å
376	R	95.3	Very high	95	Very high	141 Å²	141	40.7 Å²	40.7	53%	0.532	19%	0.189	S	C	.	.	H	α-helix	trans	-60.8	-46.8	176.7	-169.6	-174.1	-59	124.1	0.4	112.2	E372 N373 F374 L380	E372-R376 PolarHBondContact O-N 3.1Å; N373-R376 PolarHBondContact O-N 3.09Å; N373-R376 PolarHBondContact OD1-NH1 3.39Å; F374-R376 VanDerWaalsContact C-N 3.29Å; F374-R376 PolarHBondContact O-N 3.44Å; R376-L380 WeakPolarHBondContact O-CG 3.38Å; R376-L380 PolarHBondContact O-N 3.06Å
377	Q	95.7	Very high	95.1	Very high	48 Å²	48	34.4 Å²	34.4	22%	0.224	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-37.2	178.3	-65.2	-58.2	-31.1	0	0	111.8	F287 N332 F335 N373 F374 C381	F287-Q377 HydrophobicContact CE1-CB 3.99Å; F287-Q377 HydrophobicContact CZ-CB 4.28Å; N332-Q377 HydrophobicContact CB-CG 4.38Å; F335-Q377 HydrophobicContact CZ-CB 4.09Å; F335-Q377 HydrophobicContact CZ-CG 3.99Å; N373-Q377 WeakPolarHBondContact O-CG 3.4Å; N373-Q377 PolarHBondContact O-N 2.8Å; F374-Q377 PolarHBondContact O-N 2.94Å; Q377-C381 WeakPolarHBondContact O-CB 3.46Å; Q377-C381 PolarHBondContact O-N 3.45Å
378	F	96.3	Very high	95.1	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-59.9	-52.5	173.7	166	-100.5	0	0	0	111.4	V133 M150 L223 V228 V255 F287 F374 E375 L380 C381 I382	V133-F378 HydrophobicContact CB-CE2 3.79Å; V133-F378 HydrophobicContact CB-CZ 3.95Å; V133-F378 HydrophobicContact CG1-CE2 4.13Å; V133-F378 HydrophobicContact CG1-CZ 3.81Å; V133-F378 HydrophobicContact CG2-CE2 3.67Å; V133-F378 HydrophobicContact CG2-CZ 4.22Å; M150-F378 HydrophobicContact CE-CD1 3.63Å; M150-F378 HydrophobicContact CE-CE1 3.56Å; M150-F378 HydrophobicContact CE-CG 4.2Å; M150-F378 HydrophobicContact CE-CZ 4.07Å; L223-F378 HydrophobicContact CD2-CE1 4.43Å; V228-F378 HydrophobicContact CG1-CZ 4.31Å; V255-F378 HydrophobicContact CB-CE2 4.24Å; V255-F378 HydrophobicContact CG1-CD2 4.05Å; V255-F378 HydrophobicContact CG1-CE2 4.05Å; F287-F378 HydrophobicContact CE2-CB 4.5Å; F287-F378 HydrophobicContact CE2-CD2 4.47Å; F287-F378 HydrophobicContact CZ-CB 4.26Å; F374-F378 HydrophobicContact CD2-CB 4.39Å; F374-F378 HydrophobicContact CE2-CB 4Å; F374-F378 HydrophobicContact CZ-CB 4.27Å; F374-F378 HydrophobicContact CZ-CG 4.48Å; F374-F378 VanDerWaalsContact O-CB 3.25Å; F374-F378 WeakPolarHBondContact O-CB 3.32Å; F374-F378 PolarHBondContact O-N 3Å; E375-F378 WeakPolarHBondContact O-CB 3.49Å; E375-F378 PolarHBondContact O-N 3.4Å; F378-L380 VanDerWaalsContact C-N 3.31Å; F378-L380 PolarHBondContact O-N 3.38Å; F378-C381 PolarHBondContact O-N 3.25Å; F378-C381 VanDerWaalsContact O-N 3.14Å; F378-I382 HydrophobicContact CE1-CG2 4.21Å; F378-I382 HydrophobicContact CE2-CB 4.19Å; F378-I382 HydrophobicContact CE2-CD1 3.8Å; F378-I382 HydrophobicContact CE2-CG2 4.42Å; F378-I382 HydrophobicContact CZ-CB 4.29Å; F378-I382 HydrophobicContact CZ-CD1 3.54Å; F378-I382 HydrophobicContact CZ-CG2 4.11Å; F378-I382 VanDerWaalsContact O-CG2 3.32Å; F378-I382 WeakPolarHBondContact O-CG2 3.38Å; F378-I382 PolarHBondContact O-N 2.91Å
379	E	95.6	Very high	94.9	Very high	21 Å²	21	39.6 Å²	39.6	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-59.1	-40.8	-179.5	-74.1	-166.5	175.2	0	0	112	P42 L43 R222 E375 S383	P42-E379 HydrophobicContact CB-CB 4.31Å; P42-E379 HydrophobicContact CG-CB 4.33Å; L43-E379 HydrophobicContact CD1-CG 3.85Å; L43-E379 HydrophobicContact CD2-CB 4.06Å; L43-E379 HydrophobicContact CD2-CG 4.05Å; L43-E379 HydrophobicContact CG-CB 4.09Å; L43-E379 HydrophobicContact CG-CG 3.83Å; R222-E379 IonicContact CZ-OE1 3.2Å; R222-E379 IonicContact CZ-OE2 3.69Å; R222-E379 IonicContact NE-OE1 3.31Å; R222-E379 PolarHBondContact NE-OE1 3.16Å; R222-E379 IonicContact NE-OE2 2.75Å; R222-E379 IonicContact NH2-OE1 2.94Å; R222-E379 PolarHBondContact NH2-OE1 3.05Å; R222-E379 IonicContact NH2-OE2 3.07Å; R222-E379 PolarHBondContact NH2-OE2 3.47Å; E375-E379 WeakPolarHBondContact O-CB 3.33Å; E375-E379 WeakPolarHBondContact O-CG 3.25Å; E375-E379 PolarHBondContact O-N 3.39Å; E379-S383 WeakPolarHBondContact O-CB 3.2Å; E379-S383 PolarHBondContact O-N 3.13Å; E379-S383 PolarHBondContact O-OG 3.37Å
380	L	93.8	Very high	94.7	Very high	79 Å²	79	35.1 Å²	35.1	41%	0.414	17%	0.17	S	C	.	.	H	α-helix	trans	-65.1	-43.3	175.6	-74.6	167.6	0	0	0	112.3	P42 R376 F378 S383 K384	P42-L380 HydrophobicContact CB-CD2 3.97Å; P42-L380 HydrophobicContact CB-CG 4.41Å; P42-L380 HydrophobicContact CG-CD2 3.55Å; P42-L380 HydrophobicContact CG-CG 3.93Å; R376-L380 WeakPolarHBondContact O-CG 3.38Å; R376-L380 PolarHBondContact O-N 3.06Å; F378-L380 VanDerWaalsContact C-N 3.31Å; F378-L380 PolarHBondContact O-N 3.38Å; L380-S383 PolarHBondContact O-OG 2.9Å; L380-K384 VanDerWaalsContact O-CB 3.28Å; L380-K384 WeakPolarHBondContact O-CB 3.3Å; L380-K384 PolarHBondContact O-N 3.19Å
381	C	94.4	Very high	94.7	Very high	11 Å²	11	33.2 Å²	33.2	7%	0.074	16%	0.161	C	C	.	.	H	α-helix	trans	-70.9	-46.8	-177.5	-177.7	0	0	0	0	112.4	N285 F287 R333 Q377 F378 K384 S385	N285-C381 VanDerWaalsContact CG-SG 3.6Å; F287-C381 HydrophobicContact CE2-CB 3.99Å; F287-C381 HydrophobicContact CZ-CB 4.04Å; R333-C381 VanDerWaalsContact CZ-SG 3.55Å; R333-C381 PolarHBondContact NH1-SG 3.45Å; R333-C381 PolarHBondContact NH2-SG 2.82Å; Q377-C381 WeakPolarHBondContact O-CB 3.46Å; Q377-C381 PolarHBondContact O-N 3.45Å; F378-C381 PolarHBondContact O-N 3.25Å; F378-C381 VanDerWaalsContact O-N 3.14Å; C381-K384 PolarHBondContact O-N 2.98Å; C381-S385 VanDerWaalsContact O-CB 3.3Å; C381-S385 WeakPolarHBondContact O-CB 3.42Å; C381-S385 PolarHBondContact O-N 3.38Å
382	I	95.7	Very high	94.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-40.3	-174.9	-163.8	172.2	0	0	0	110.9	L43 M131 V133 V228 D254 V255 F378 S385 A386	L43-I382 HydrophobicContact CD2-CG2 3.68Å; M131-I382 HydrophobicContact CB-CD1 3.87Å; M131-I382 HydrophobicContact CB-CG1 3.96Å; M131-I382 HydrophobicContact CG-CG1 4.24Å; M131-I382 HydrophobicContact SD-CG1 4.48Å; M131-I382 HydrophobicContact SD-CG2 4.09Å; V133-I382 HydrophobicContact CB-CD1 4.04Å; V133-I382 HydrophobicContact CG1-CD1 4.47Å; V228-I382 HydrophobicContact CG1-CD1 4.16Å; D254-I382 HydrophobicContact CB-CG1 3.9Å; V255-I382 HydrophobicContact CB-CG1 4.44Å; V255-I382 HydrophobicContact CG2-CB 3.73Å; V255-I382 HydrophobicContact CG2-CG1 3.9Å; F378-I382 HydrophobicContact CE1-CG2 4.21Å; F378-I382 HydrophobicContact CE2-CB 4.19Å; F378-I382 HydrophobicContact CE2-CD1 3.8Å; F378-I382 HydrophobicContact CE2-CG2 4.42Å; F378-I382 HydrophobicContact CZ-CB 4.29Å; F378-I382 HydrophobicContact CZ-CD1 3.54Å; F378-I382 HydrophobicContact CZ-CG2 4.11Å; F378-I382 VanDerWaalsContact O-CG2 3.32Å; F378-I382 WeakPolarHBondContact O-CG2 3.38Å; F378-I382 PolarHBondContact O-N 2.91Å; I382-S385 PolarHBondContact O-N 2.65Å; I382-A386 VanDerWaalsContact O-CB 3.25Å; I382-A386 WeakPolarHBondContact O-CB 3.35Å; I382-A386 PolarHBondContact O-N 2.95Å
383	S	94.6	Very high	94.2	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-66.7	-45.2	176.9	67.4	0	0	0	0	111.7	P42 E379 L380 S385 I387	P42-S383 WeakPolarHBondContact O-CB 3.43Å; P42-S383 PolarHBondContact O-OG 3.02Å; E379-S383 WeakPolarHBondContact O-CB 3.2Å; E379-S383 PolarHBondContact O-N 3.13Å; E379-S383 PolarHBondContact O-OG 3.37Å; L380-S383 PolarHBondContact O-OG 2.9Å; S383-S385 PolarHBondContact O-N 3.4Å; S383-I387 WeakPolarHBondContact O-CB 3.48Å; S383-I387 WeakPolarHBondContact O-CG1 3.23Å; S383-I387 PolarHBondContact O-N 3.23Å
384	K	93.8	Very high	94.2	Very high	84 Å²	84	34 Å²	34	37%	0.365	17%	0.172	S	C	.	.	H	α-helix	trans	-56.9	-50.6	174.5	173	175.9	176.7	-178.6	0	111.2	L380 C381 L388 Y784	L380-K384 VanDerWaalsContact O-CB 3.28Å; L380-K384 WeakPolarHBondContact O-CB 3.3Å; L380-K384 PolarHBondContact O-N 3.19Å; C381-K384 PolarHBondContact O-N 2.98Å; K384-L388 HydrophobicContact CG-CD1 4.27Å; K384-L388 WeakPolarHBondContact O-CG 3.3Å; K384-L388 PolarHBondContact O-N 2.92Å; K384-Y784 HydrophobicContact CB-CD1 4.12Å; K384-Y784 HydrophobicContact CB-CE1 4.21Å; K384-Y784 HydrophobicContact CB-CG 4.4Å; K384-Y784 HydrophobicContact CD-CD1 3.68Å; K384-Y784 HydrophobicContact CD-CE1 4.4Å; K384-Y784 HydrophobicContact CD-CG 4.15Å; K384-Y784 WeakPolarHBondContact CE-O 3.32Å; K384-Y784 HydrophobicContact CG-CD1 3.62Å; K384-Y784 HydrophobicContact CG-CD2 4.39Å; K384-Y784 HydrophobicContact CG-CE1 4.22Å; K384-Y784 HydrophobicContact CG-CG 3.72Å
385	S	93.4	Very high	94.1	Very high	16 Å²	16	34 Å²	34	11%	0.112	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-52	-177.7	-172.2	0	0	0	0	110.8	D254 N285 C381 I382 S383 I387 L388 T389	D254-S385 PolarHBondContact O-OG 3.47Å; N285-S385 WeakPolarHBondContact ND2-CB 3.47Å; N285-S385 PolarHBondContact ND2-OG 3.26Å; C381-S385 VanDerWaalsContact O-CB 3.3Å; C381-S385 WeakPolarHBondContact O-CB 3.42Å; C381-S385 PolarHBondContact O-N 3.38Å; I382-S385 PolarHBondContact O-N 2.65Å; S383-S385 PolarHBondContact O-N 3.4Å; S385-I387 PolarHBondContact O-N 3.15Å; S385-L388 PolarHBondContact O-N 3.36Å; S385-T389 WeakPolarHBondContact O-CG2 3.47Å; S385-T389 PolarHBondContact O-N 2.86Å; S385-T389 PolarHBondContact O-OG1 2.91Å
386	A	93.9	Very high	94	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-37.6	-177.4	0	0	0	0	0	113	F46 M131 D254 I382 L388 K390	F46-A386 HydrophobicContact CD2-CB 3.67Å; F46-A386 HydrophobicContact CE2-CB 3.58Å; F46-A386 HydrophobicContact CZ-CB 4.48Å; M131-A386 HydrophobicContact CG-CB 3.51Å; D254-A386 HydrophobicContact CB-CB 4.47Å; D254-A386 WeakPolarHBondContact OD1-CA 3.34Å; I382-A386 VanDerWaalsContact O-CB 3.25Å; I382-A386 WeakPolarHBondContact O-CB 3.35Å; I382-A386 PolarHBondContact O-N 2.95Å; A386-L388 VanDerWaalsContact C-N 3.35Å; A386-K390 HydrophobicContact CB-CD 4.15Å; A386-K390 WeakPolarHBondContact O-CB 3.38Å; A386-K390 WeakPolarHBondContact O-CG 3.43Å; A386-K390 PolarHBondContact O-N 3.38Å
387	I	94.3	Very high	94	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-45.4	175.5	-72.7	170.5	0	0	0	110.6	R45 F46 A49 S383 S385 F391 Y780 L781 Y784	R45-I387 HydrophobicContact CG-CD1 4.29Å; F46-I387 HydrophobicContact CB-CD1 4.48Å; F46-I387 HydrophobicContact CB-CG1 4.26Å; F46-I387 HydrophobicContact CD2-CG1 3.9Å; A49-I387 HydrophobicContact CB-CD1 4.48Å; A49-I387 HydrophobicContact CB-CG1 4.36Å; S383-I387 WeakPolarHBondContact O-CB 3.48Å; S383-I387 WeakPolarHBondContact O-CG1 3.23Å; S383-I387 PolarHBondContact O-N 3.23Å; S385-I387 PolarHBondContact O-N 3.15Å; I387-F391 HydrophobicContact CB-CD2 4.42Å; I387-F391 HydrophobicContact CG1-CD2 4.45Å; I387-F391 HydrophobicContact CG1-CE2 4.34Å; I387-F391 HydrophobicContact CG2-CD2 4.33Å; I387-F391 WeakPolarHBondContact O-CB 3.37Å; I387-F391 PolarHBondContact O-N 3.4Å; I387-Y780 WeakPolarHBondContact CG2-O 3.32Å; I387-L781 HydrophobicContact CG2-CD2 3.86Å; I387-L781 WeakPolarHBondContact O-CD2 3.46Å; I387-Y784 HydrophobicContact CD1-CE2 4.08Å; I387-Y784 HydrophobicContact CG2-CD2 4.44Å
388	L	92.4	Very high	94	Very high	37 Å²	37	32.4 Å²	32.4	19%	0.194	17%	0.169	C	C	.	.	H	α-helix	trans	-69.8	-49.6	-179.1	-71.5	176.7	0	0	0	112.2	K384 S385 A386 D392 L781 L785	K384-L388 HydrophobicContact CG-CD1 4.27Å; K384-L388 WeakPolarHBondContact O-CG 3.3Å; K384-L388 PolarHBondContact O-N 2.92Å; S385-L388 PolarHBondContact O-N 3.36Å; A386-L388 VanDerWaalsContact C-N 3.35Å; L388-D392 WeakPolarHBondContact O-CB 3.38Å; L388-D392 PolarHBondContact O-N 2.99Å; L388-L781 HydrophobicContact CD2-CD2 3.98Å; L388-L785 HydrophobicContact CD2-CD2 3.76Å; L388-L785 HydrophobicContact CD2-CG 3.8Å
389	T	90.3	Very high	94	Very high	89 Å²	89	32.5 Å²	32.5	55%	0.546	17%	0.169	S	C	.	.	H	α-helix	trans	-72.4	-35.2	-173.1	55.6	0	0	0	0	112.4	D254 S385	D254-T389 PolarHBondContact OD1-OG1 3.47Å; S385-T389 WeakPolarHBondContact O-CG2 3.47Å; S385-T389 PolarHBondContact O-N 2.86Å; S385-T389 PolarHBondContact O-OG1 2.91Å
390	K	91.5	Very high	94.1	Very high	23 Å²	23	36 Å²	36	10%	0.1	19%	0.188	C	C	.	.	H	α-helix	trans	-91.6	-34.3	-173.9	-57.2	173.5	-169.2	-100.1	0	112.8	F46 D129 H130 D254 A386 H394	F46-K390 HydrophobicContact CE2-CD 4.07Å; F46-K390 HydrophobicContact CZ-CD 4.17Å; D129-K390 HydrophobicContact CB-CD 4.11Å; H130-K390 WeakPolarHBondContact O-CE 3.46Å; H130-K390 PolarHBondContact O-NZ 3.29Å; D254-K390 VanDerWaalsContact OD1-CE 3.3Å; D254-K390 WeakPolarHBondContact OD1-CE 3.28Å; D254-K390 WeakPolarHBondContact OD2-CE 3.26Å; D254-K390 IonicContact OD2-NZ 3.74Å; A386-K390 HydrophobicContact CB-CD 4.15Å; A386-K390 WeakPolarHBondContact O-CB 3.38Å; A386-K390 WeakPolarHBondContact O-CG 3.43Å; A386-K390 PolarHBondContact O-N 3.38Å; K390-H394 PolarHBondContact O-CD2 3.26Å
391	F	94.4	Very high	94.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-103.3	-26.3	-171.7	-53.4	-38.9	0	0	0	115.6	F46 A49 K50 I53 L126 I387 S393 H394 V395 F776	F46-F391 AromaticContact CD2-CE2 3.88Å; F46-F391 HydrophobicContact CD2-CE2 3.88Å; F46-F391 HydrophobicContact CD2-CZ 4.14Å; F46-F391 AromaticContact CE2-CE2 3.67Å; F46-F391 HydrophobicContact CE2-CE2 3.67Å; F46-F391 AromaticContact CE2-CZ 3.51Å; F46-F391 HydrophobicContact CE2-CZ 3.51Å; F46-F391 HydrophobicContact CZ-CE2 4.38Å; F46-F391 AromaticContact CZ-CZ 3.8Å; F46-F391 HydrophobicContact CZ-CZ 3.8Å; A49-F391 HydrophobicContact CB-CD2 4.16Å; A49-F391 HydrophobicContact CB-CE2 3.86Å; K50-F391 HydrophobicContact CB-CE1 4.44Å; K50-F391 HydrophobicContact CB-CE2 4.41Å; K50-F391 HydrophobicContact CB-CZ 3.7Å; K50-F391 HydrophobicContact CG-CE1 4.48Å; K50-F391 HydrophobicContact CG-CZ 4.14Å; I53-F391 HydrophobicContact CG2-CD1 4Å; I53-F391 HydrophobicContact CG2-CE1 4.15Å; I53-F391 HydrophobicContact CG2-CG 4.4Å; L126-F391 HydrophobicContact CD2-CD1 3.6Å; L126-F391 HydrophobicContact CD2-CE1 3.76Å; I387-F391 HydrophobicContact CB-CD2 4.42Å; I387-F391 HydrophobicContact CG1-CD2 4.45Å; I387-F391 HydrophobicContact CG1-CE2 4.34Å; I387-F391 HydrophobicContact CG2-CD2 4.33Å; I387-F391 WeakPolarHBondContact O-CB 3.37Å; I387-F391 PolarHBondContact O-N 3.4Å; F391-S393 PolarHBondContact O-N 3Å; F391-H394 PolarHBondContact O-N 3.08Å; F391-H394 VanDerWaalsContact O-N 3.12Å; F391-V395 WeakPolarHBondContact O-CG2 3.42Å; F391-V395 PolarHBondContact O-N 3.08Å; F391-F776 HydrophobicContact CB-CE1 3.91Å; F391-F776 HydrophobicContact CB-CZ 4.09Å; F391-F776 AromaticContact CD2-CZ 3.95Å; F391-F776 HydrophobicContact CD2-CZ 3.95Å; F391-F776 HydrophobicContact CG-CZ 4.19Å
392	D	92.3	Very high	94.2	Very high	60 Å²	60	32.5 Å²	32.5	32%	0.321	17%	0.168	S	C	.	.	H	α-helix	trans	-58.1	-48.1	-173	-172.1	50.1	0	0	0	112.7	L388 H394 V395 E396 L781	L388-D392 WeakPolarHBondContact O-CB 3.38Å; L388-D392 PolarHBondContact O-N 2.99Å; D392-H394 VanDerWaalsContact C-N 3.29Å; D392-H394 PolarHBondContact O-N 3.44Å; D392-V395 PolarHBondContact O-N 3.08Å; D392-E396 PolarHBondContact O-N 3.42Å; D392-E396 VanDerWaalsContact O-N 3.13Å; D392-L781 HydrophobicContact CB-CD1 4.22Å; D392-L781 HydrophobicContact CB-CD2 4.19Å
393	S	91.9	Very high	94.3	Very high	58 Å²	58	36 Å²	36	41%	0.406	19%	0.187	S	C	.	.	H	α-helix	trans	-64.2	-33.2	179.2	78.2	0	0	0	0	113.1	F391 K397	F391-S393 PolarHBondContact O-N 3Å; S393-K397 WeakPolarHBondContact O-CB 3.24Å; S393-K397 VanDerWaalsContact O-CG 3.29Å; S393-K397 WeakPolarHBondContact O-CG 3.46Å; S393-K397 PolarHBondContact O-N 3.22Å
394	H	94.5	Very high	94.3	Very high	16 Å²	16	38.1 Å²	38.1	7%	0.074	20%	0.198	C	C	.	.	H	α-helix	trans	-73.8	-38.9	177.3	-65.2	-46	0	0	0	111	Y57 I122 K390 F391 D392 E396 K397 G398	Y57-H394 HydrophobicContact CE2-CB 4.2Å; Y57-H394 PolarHBondContact OH-O 2.88Å; I122-H394 HydrophobicContact CG2-CB 4.21Å; I122-H394 WeakPolarHBondContact CG2-ND1 3.35Å; K390-H394 PolarHBondContact O-CD2 3.26Å; F391-H394 PolarHBondContact O-N 3.08Å; F391-H394 VanDerWaalsContact O-N 3.12Å; D392-H394 VanDerWaalsContact C-N 3.29Å; D392-H394 PolarHBondContact O-N 3.44Å; H394-E396 VanDerWaalsContact C-N 3.29Å; H394-E396 PolarHBondContact O-N 3.27Å; H394-K397 PolarHBondContact O-N 3.21Å; H394-G398 PolarHBondContact O-N 3.21Å
395	V	95.9	Very high	94.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.8	-46.4	174.3	172.2	0	0	0	0	110.5	I53 F391 D392 K399 L773 F776 R777 L781	I53-V395 HydrophobicContact CD1-CG2 3.93Å; F391-V395 WeakPolarHBondContact O-CG2 3.42Å; F391-V395 PolarHBondContact O-N 3.08Å; D392-V395 PolarHBondContact O-N 3.08Å; V395-K399 HydrophobicContact CG1-CD 4.18Å; V395-K399 VanDerWaalsContact O-CB 3.25Å; V395-K399 WeakPolarHBondContact O-CB 3.46Å; V395-K399 WeakPolarHBondContact O-CG 3.18Å; V395-K399 PolarHBondContact O-N 2.73Å; V395-K399 VanDerWaalsContact O-N 3.09Å; V395-L773 HydrophobicContact CG1-CB 4.4Å; V395-F776 HydrophobicContact CG2-CD1 3.35Å; V395-F776 HydrophobicContact CG2-CE1 3.67Å; V395-F776 HydrophobicContact CG2-CG 4.3Å; V395-R777 HydrophobicContact CG1-CB 4.21Å; V395-L781 HydrophobicContact CB-CD1 4.25Å; V395-L781 HydrophobicContact CG1-CD1 4.47Å; V395-L781 HydrophobicContact CG2-CD1 3.97Å
396	E	95	Very high	94.4	Very high	77 Å²	77	37.1 Å²	37.1	36%	0.36	19%	0.19	S	C	.	.	H	α-helix	trans	-69.3	-36.2	179.4	-159.6	58.3	-147	0	0	112.9	D392 H394 K399 I400 R777	D392-E396 PolarHBondContact O-N 3.42Å; D392-E396 VanDerWaalsContact O-N 3.13Å; H394-E396 VanDerWaalsContact C-N 3.29Å; H394-E396 PolarHBondContact O-N 3.27Å; E396-K399 VanDerWaalsContact O-CB 3.25Å; E396-K399 WeakPolarHBondContact O-CB 3.37Å; E396-K399 PolarHBondContact O-N 2.93Å; E396-I400 WeakPolarHBondContact O-CG1 3.36Å; E396-I400 PolarHBondContact O-N 3.12Å; E396-I400 VanDerWaalsContact O-N 3.09Å; E396-R777 IonicContact OE2-NH1 2.81Å
397	K	94.6	Very high	94.4	Very high	108 Å²	108	42.8 Å²	42.8	47%	0.47	22%	0.217	S	C	.	.	H	α-helix	trans	-65.3	-48.2	173.8	-77.1	175.4	-178.7	177.5	0	112.6	I122 S393 H394 K399 I400 I401	I122-K397 HydrophobicContact CD1-CB 4.45Å; I122-K397 HydrophobicContact CD1-CD 4.32Å; S393-K397 WeakPolarHBondContact O-CB 3.24Å; S393-K397 VanDerWaalsContact O-CG 3.29Å; S393-K397 WeakPolarHBondContact O-CG 3.46Å; S393-K397 PolarHBondContact O-N 3.22Å; H394-K397 PolarHBondContact O-N 3.21Å; K397-K399 PolarHBondContact O-N 2.84Å; K397-I400 PolarHBondContact O-N 2.92Å; K397-I401 VanDerWaalsContact O-CG1 3.31Å; K397-I401 WeakPolarHBondContact O-CG1 3.47Å; K397-I401 PolarHBondContact O-N 2.84Å
398	G	95.9	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.6	-35.1	178.3	0	0	0	0	0	111.7	Y57 H394 I401 C402	Y57-G398 WeakPolarHBondContact OH-CA 3.49Å; Y57-G398 PolarHBondContact OH-N 3.11Å; Y57-G398 VanDerWaalsContact OH-N 3.16Å; H394-G398 PolarHBondContact O-N 3.21Å; G398-I401 PolarHBondContact O-N 3.3Å; G398-C402 PolarHBondContact O-N 3.46Å; G398-C402 PolarHBondContact O-SG 3.3Å; G398-C402 VanDerWaalsContact O-SG 3.34Å
399	K	96.7	Very high	94.2	Very high	2 Å²	2	42 Å²	42	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-59.8	-53.4	174.2	-88.2	-176.8	-179.2	-169.3	0	111.9	V395 E396 K397 I401 C402 D403 R770 L773 D774	V395-K399 HydrophobicContact CG1-CD 4.18Å; V395-K399 VanDerWaalsContact O-CB 3.25Å; V395-K399 WeakPolarHBondContact O-CB 3.46Å; V395-K399 WeakPolarHBondContact O-CG 3.18Å; V395-K399 PolarHBondContact O-N 2.73Å; V395-K399 VanDerWaalsContact O-N 3.09Å; E396-K399 VanDerWaalsContact O-CB 3.25Å; E396-K399 WeakPolarHBondContact O-CB 3.37Å; E396-K399 PolarHBondContact O-N 2.93Å; K397-K399 PolarHBondContact O-N 2.84Å; K399-I401 VanDerWaalsContact C-N 3.33Å; K399-I401 PolarHBondContact O-N 3.44Å; K399-C402 PolarHBondContact O-N 2.9Å; K399-D403 VanDerWaalsContact O-CG 3.27Å; K399-D403 PolarHBondContact O-N 2.8Å; K399-R770 VanDerWaalsContact CB-CZ 3.44Å; K399-R770 PolarHBondContact O-NH1 3.28Å; K399-L773 HydrophobicContact CB-CD1 4.48Å; K399-L773 HydrophobicContact CG-CB 3.87Å; K399-L773 HydrophobicContact CG-CD1 3.91Å; K399-D774 WeakPolarHBondContact CE-OD1 3.41Å; K399-D774 IonicContact NZ-OD1 2.77Å; K399-D774 PolarHBondContact NZ-OD1 2.81Å
400	I	96.1	Very high	94.2	Very high	96 Å²	96	39.9 Å²	39.9	49%	0.492	20%	0.199	S	C	.	.	H	α-helix	trans	-58.6	-44.2	176.6	-67	163.4	0	0	0	111.1	E396 K397 D403 D404	E396-I400 WeakPolarHBondContact O-CG1 3.36Å; E396-I400 PolarHBondContact O-N 3.12Å; E396-I400 VanDerWaalsContact O-N 3.09Å; K397-I400 PolarHBondContact O-N 2.92Å; I400-D403 PolarHBondContact O-N 3.3Å; I400-D404 WeakPolarHBondContact O-CB 3.5Å; I400-D404 PolarHBondContact O-N 3.01Å
401	I	95.6	Very high	94.2	Very high	14 Å²	14	42.1 Å²	42.1	7%	0.072	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-47.2	178.9	-65.7	167.4	0	0	0	111	I60 Y115 V119 K397 G398 K399 D403 D404 I405	I60-I401 HydrophobicContact CG2-CG2 4.41Å; Y115-I401 HydrophobicContact CD1-CB 4.45Å; Y115-I401 HydrophobicContact CD1-CD1 4.31Å; Y115-I401 HydrophobicContact CD1-CG1 3.76Å; Y115-I401 HydrophobicContact CD1-CG2 4.11Å; Y115-I401 HydrophobicContact CE1-CG1 4Å; Y115-I401 HydrophobicContact CG-CG2 4.08Å; V119-I401 HydrophobicContact CG2-CD1 3.89Å; V119-I401 HydrophobicContact CG2-CG2 4.36Å; K397-I401 VanDerWaalsContact O-CG1 3.31Å; K397-I401 WeakPolarHBondContact O-CG1 3.47Å; K397-I401 PolarHBondContact O-N 2.84Å; G398-I401 PolarHBondContact O-N 3.3Å; K399-I401 VanDerWaalsContact C-N 3.33Å; K399-I401 PolarHBondContact O-N 3.44Å; I401-D403 VanDerWaalsContact C-N 3.34Å; I401-D403 PolarHBondContact O-N 3.04Å; I401-D404 PolarHBondContact O-N 3.16Å; I401-I405 HydrophobicContact CG2-CD1 3.72Å; I401-I405 HydrophobicContact CG2-CG1 4.45Å; I401-I405 VanDerWaalsContact O-CG1 3.28Å; I401-I405 WeakPolarHBondContact O-CG1 3.31Å; I401-I405 PolarHBondContact O-N 2.77Å; I401-I405 VanDerWaalsContact O-N 3.09Å
402	C	96.2	Very high	93.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-43.1	178.4	-74.3	0	0	0	0	112	G398 K399 Y406 R770	G398-C402 PolarHBondContact O-N 3.46Å; G398-C402 PolarHBondContact O-SG 3.3Å; G398-C402 VanDerWaalsContact O-SG 3.34Å; K399-C402 PolarHBondContact O-N 2.9Å; C402-Y406 WeakPolarHBondContact O-CB 3.47Å; C402-Y406 PolarHBondContact O-N 3.17Å; C402-R770 HydrophobicContact CB-CB 4.17Å
403	D	96.6	Very high	93.6	Very high	73 Å²	73	41.7 Å²	41.7	39%	0.39	21%	0.208	S	C	.	.	H	α-helix	trans	-67.5	-43.2	-178.4	-65	-6.8	0	0	0	111.5	K399 I400 I401 Y406 E407 R770	K399-D403 VanDerWaalsContact O-CG 3.27Å; K399-D403 PolarHBondContact O-N 2.8Å; I400-D403 PolarHBondContact O-N 3.3Å; I401-D403 VanDerWaalsContact C-N 3.34Å; I401-D403 PolarHBondContact O-N 3.04Å; D403-Y406 WeakPolarHBondContact O-CB 3.45Å; D403-Y406 PolarHBondContact O-N 2.91Å; D403-E407 PolarHBondContact O-N 3.11Å; D403-R770 IonicContact OD1-CZ 2.92Å; D403-R770 IonicContact OD1-NE 3.07Å; D403-R770 IonicContact OD1-NH1 2.66Å; D403-R770 PolarHBondContact OD1-NH1 3.25Å; D403-R770 IonicContact OD2-CZ 3.66Å; D403-R770 IonicContact OD2-NH1 3.97Å; D403-R770 PolarHBondContact OD2-NH1 3.04Å; D403-R770 IonicContact OD2-NH2 3.73Å
404	D	95.5	Very high	93.5	Very high	46 Å²	46	45.5 Å²	45.5	25%	0.246	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-43.7	-178.9	-176.2	80.5	0	0	0	112.4	H111 Y115 I400 I401 Y406 E407 T408	H111-D404 IonicContact CD2-OD2 3.84Å; H111-D404 IonicContact CE1-OD2 3.79Å; H111-D404 IonicContact NE2-OD1 3.51Å; H111-D404 IonicContact NE2-OD2 2.97Å; H111-D404 PolarHBondContact NE2-OD2 3.37Å; Y115-D404 VanDerWaalsContact CE2-OD2 3.26Å; Y115-D404 WeakPolarHBondContact CE2-OD2 3.37Å; Y115-D404 PolarHBondContact OH-OD2 2.95Å; I400-D404 WeakPolarHBondContact O-CB 3.5Å; I400-D404 PolarHBondContact O-N 3.01Å; I401-D404 PolarHBondContact O-N 3.16Å; D404-Y406 VanDerWaalsContact C-N 3.29Å; D404-Y406 PolarHBondContact O-N 3.36Å; D404-E407 PolarHBondContact O-N 3.03Å; D404-T408 WeakPolarHBondContact O-CB 3.31Å; D404-T408 PolarHBondContact O-N 3.01Å; D404-T408 PolarHBondContact O-OG1 3.07Å
405	I	93.9	Very high	93.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-39.8	173.5	-61.9	171.1	0	0	0	109.9	I64 I67 V112 Y115 I401 T408 L409 L766	I64-I405 HydrophobicContact CD1-CD1 4.01Å; I64-I405 HydrophobicContact CG1-CD1 3.77Å; I67-I405 HydrophobicContact CD1-CG2 3.79Å; V112-I405 HydrophobicContact CG1-CD1 4.47Å; V112-I405 HydrophobicContact CG1-CG2 4.33Å; V112-I405 HydrophobicContact CG2-CG2 4.16Å; Y115-I405 HydrophobicContact CD2-CD1 4.32Å; Y115-I405 HydrophobicContact CD2-CG1 4.1Å; Y115-I405 HydrophobicContact CE2-CG1 4.43Å; I401-I405 HydrophobicContact CG2-CD1 3.72Å; I401-I405 HydrophobicContact CG2-CG1 4.45Å; I401-I405 VanDerWaalsContact O-CG1 3.28Å; I401-I405 WeakPolarHBondContact O-CG1 3.31Å; I401-I405 PolarHBondContact O-N 2.77Å; I401-I405 VanDerWaalsContact O-N 3.09Å; I405-T408 PolarHBondContact O-N 2.92Å; I405-L409 HydrophobicContact CG2-CD1 4.37Å; I405-L409 HydrophobicContact CG2-CG 4.46Å; I405-L409 WeakPolarHBondContact O-CG 3.47Å; I405-L409 PolarHBondContact O-N 2.73Å; I405-L766 HydrophobicContact CB-CD1 4.06Å; I405-L766 HydrophobicContact CB-CD2 4.38Å; I405-L766 HydrophobicContact CG2-CD1 3.49Å; I405-L766 VanDerWaalsContact CG2-CD1 3.49Å; I405-L766 HydrophobicContact CG2-CD2 4.22Å
406	Y	95.2	Very high	92.6	Very high	80 Å²	80	48.3 Å²	48.3	31%	0.314	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-42.7	177.7	-175.5	-86.5	0	0	0	112	C402 D403 D404 L409 N410 K763 L766 A767	C402-Y406 WeakPolarHBondContact O-CB 3.47Å; C402-Y406 PolarHBondContact O-N 3.17Å; D403-Y406 WeakPolarHBondContact O-CB 3.45Å; D403-Y406 PolarHBondContact O-N 2.91Å; D404-Y406 VanDerWaalsContact C-N 3.29Å; D404-Y406 PolarHBondContact O-N 3.36Å; Y406-L409 PolarHBondContact O-N 3.07Å; Y406-N410 WeakPolarHBondContact CE1-ND2 3.06Å; Y406-N410 WeakPolarHBondContact O-CB 3.43Å; Y406-N410 PolarHBondContact O-N 3.47Å; Y406-K763 HydrophobicContact CD2-CB 3.94Å; Y406-K763 HydrophobicContact CD2-CG 4.06Å; Y406-K763 WeakPolarHBondContact CD2-O 3.49Å; Y406-K763 HydrophobicContact CE2-CB 3.6Å; Y406-K763 HydrophobicContact CE2-CG 4Å; Y406-K763 WeakPolarHBondContact CE2-O 3.44Å; Y406-L766 HydrophobicContact CD2-CB 4.28Å; Y406-A767 HydrophobicContact CE2-CB 4.35Å
407	E	94.6	Very high	92.3	Very high	118 Å²	118	50.9 Å²	50.9	55%	0.551	24%	0.243	S	C	*	.	H	α-helix	trans	-65.7	-41.5	175.6	-173.6	167.3	-172.4	0	0	112	D403 D404 L409 N410 N411	D403-E407 PolarHBondContact O-N 3.11Å; D404-E407 PolarHBondContact O-N 3.03Å; E407-L409 PolarHBondContact O-N 2.92Å; E407-N410 VanDerWaalsContact O-CB 3.24Å; E407-N410 WeakPolarHBondContact O-CB 3.31Å; E407-N410 PolarHBondContact O-N 3.44Å; E407-N410 VanDerWaalsContact O-N 3.14Å; E407-N411 PolarHBondContact O-N 3.3Å; E407-N411 PolarHBondContact O-ND2 3.32Å
408	T	91.4	Very high	92	Very high	20 Å²	20	48.4 Å²	48.4	12%	0.123	24%	0.239	C	C	.	.	H	α-helix	trans	-58.3	-47.6	174.7	-60.5	0	0	0	0	111.1	V108 V112 D404 I405 N410 N411 L412	V108-T408 HydrophobicContact CB-CG2 4.26Å; V108-T408 HydrophobicContact CG1-CG2 3.65Å; V108-T408 HydrophobicContact CG2-CG2 4.08Å; V112-T408 HydrophobicContact CG2-CG2 4.32Å; D404-T408 WeakPolarHBondContact O-CB 3.31Å; D404-T408 PolarHBondContact O-N 3.01Å; D404-T408 PolarHBondContact O-OG1 3.07Å; I405-T408 PolarHBondContact O-N 2.92Å; T408-N410 VanDerWaalsContact C-N 3.32Å; T408-N410 PolarHBondContact O-N 3.35Å; T408-N411 PolarHBondContact O-N 2.97Å; T408-L412 PolarHBondContact O-N 3.49Å
409	L	89.8	Confident	91.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-33.4	176.1	-70.8	-177.9	0	0	0	112.8	I67 L71 I405 Y406 E407 L412 Q413 I759 M762 K763 L766	I67-L409 HydrophobicContact CD1-CD1 4.07Å; I67-L409 HydrophobicContact CG2-CD2 4.23Å; L71-L409 HydrophobicContact CD1-CD2 3.92Å; I405-L409 HydrophobicContact CG2-CD1 4.37Å; I405-L409 HydrophobicContact CG2-CG 4.46Å; I405-L409 WeakPolarHBondContact O-CG 3.47Å; I405-L409 PolarHBondContact O-N 2.73Å; Y406-L409 PolarHBondContact O-N 3.07Å; E407-L409 PolarHBondContact O-N 2.92Å; L409-L412 HydrophobicContact CD2-CD2 4.44Å; L409-L412 PolarHBondContact O-N 3.27Å; L409-Q413 WeakPolarHBondContact O-CB 3.49Å; L409-Q413 PolarHBondContact O-N 2.9Å; L409-I759 HydrophobicContact CB-CG2 4.18Å; L409-M762 HydrophobicContact CD1-CB 3.95Å; L409-K763 HydrophobicContact CB-CD 4.19Å; L409-K763 HydrophobicContact CB-CG 3.82Å; L409-K763 HydrophobicContact CD1-CG 4.06Å; L409-L766 HydrophobicContact CD1-CD1 3.71Å
410	N	91.9	Very high	91	Very high	46 Å²	46	53.3 Å²	53.3	25%	0.246	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-45	172.8	-100.3	-24.4	0	0	0	112.1	Y406 E407 T408 Q413 K414 K763	Y406-N410 WeakPolarHBondContact CE1-ND2 3.06Å; Y406-N410 WeakPolarHBondContact O-CB 3.43Å; Y406-N410 PolarHBondContact O-N 3.47Å; E407-N410 VanDerWaalsContact O-CB 3.24Å; E407-N410 WeakPolarHBondContact O-CB 3.31Å; E407-N410 PolarHBondContact O-N 3.44Å; E407-N410 VanDerWaalsContact O-N 3.14Å; T408-N410 VanDerWaalsContact C-N 3.32Å; T408-N410 PolarHBondContact O-N 3.35Å; N410-Q413 PolarHBondContact O-N 2.96Å; N410-K414 WeakPolarHBondContact O-CG 3.49Å; N410-K414 PolarHBondContact O-N 3.38Å; N410-K414 VanDerWaalsContact O-N 3.11Å; N410-K763 WeakPolarHBondContact OD1-CE 3.46Å; N410-K763 PolarHBondContact OD1-NZ 3.24Å
411	N	89.5	Confident	90.7	Very high	70 Å²	70	53.2 Å²	53.2	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-67.9	-42	178.6	-69.5	-27	0	0	0	110.9	E407 T408 Q413 K414 N415	E407-N411 PolarHBondContact O-N 3.3Å; E407-N411 PolarHBondContact O-ND2 3.32Å; T408-N411 PolarHBondContact O-N 2.97Å; N411-Q413 VanDerWaalsContact C-N 3.32Å; N411-Q413 PolarHBondContact O-N 3.43Å; N411-K414 PolarHBondContact O-N 3.25Å; N411-N415 PolarHBondContact O-N 3.49Å
412	L	86.4	Confident	90.3	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-45	172	-178.4	63.7	0	0	0	111.5	L71 V108 T408 L409 K414 N415 V416 I759	L71-L412 HydrophobicContact CD1-CD2 3.93Å; V108-L412 HydrophobicContact CG1-CD2 4.2Å; T408-L412 PolarHBondContact O-N 3.49Å; L409-L412 HydrophobicContact CD2-CD2 4.44Å; L409-L412 PolarHBondContact O-N 3.27Å; L412-K414 VanDerWaalsContact C-N 3.32Å; L412-K414 PolarHBondContact O-N 2.91Å; L412-N415 PolarHBondContact O-N 2.97Å; L412-V416 HydrophobicContact CD1-CG2 4.14Å; L412-V416 HydrophobicContact CG-CG2 4.26Å; L412-V416 WeakPolarHBondContact O-CB 3.46Å; L412-V416 VanDerWaalsContact O-CG2 3.32Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 3.28Å; L412-I759 HydrophobicContact CD2-CD1 3.83Å; L412-I759 HydrophobicContact CD2-CG1 4.38Å; L412-I759 HydrophobicContact CG-CD1 3.89Å
413	Q	88.9	Confident	89.9	Confident	46 Å²	46	57.3 Å²	57.3	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-40	178.8	-170.2	170.4	27.2	0	0	112.5	L409 N410 N411 K417 I759 T760	L409-Q413 WeakPolarHBondContact O-CB 3.49Å; L409-Q413 PolarHBondContact O-N 2.9Å; N410-Q413 PolarHBondContact O-N 2.96Å; N411-Q413 VanDerWaalsContact C-N 3.32Å; N411-Q413 PolarHBondContact O-N 3.43Å; Q413-K417 WeakPolarHBondContact O-CB 3.46Å; Q413-K417 PolarHBondContact O-N 3.4Å; Q413-I759 HydrophobicContact CB-CG2 4.07Å; Q413-I759 HydrophobicContact CG-CG2 4.47Å; Q413-T760 PolarHBondContact NE2-OG1 3.28Å
414	K	89.7	Confident	89.5	Confident	138 Å²	138	57.6 Å²	57.6	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-63.5	-44.9	175.3	-70.7	172.9	-174.5	169.2	0	111.3	N410 N411 L412 K417 S418	N410-K414 WeakPolarHBondContact O-CG 3.49Å; N410-K414 PolarHBondContact O-N 3.38Å; N410-K414 VanDerWaalsContact O-N 3.11Å; N411-K414 PolarHBondContact O-N 3.25Å; L412-K414 VanDerWaalsContact C-N 3.32Å; L412-K414 PolarHBondContact O-N 2.91Å; K414-K417 PolarHBondContact O-N 3.3Å; K414-S418 PolarHBondContact O-N 3.23Å; K414-S418 PolarHBondContact O-OG 2.85Å
415	N	86.4	Confident	89.3	Confident	71 Å²	71	63.5 Å²	63.5	38%	0.38	30%	0.298	S	S	.	.	H	α-helix	trans	-65.3	-44.7	179.8	-66.8	-10.6	0	0	0	111.9	N411 L412 K417 S418 E419	N411-N415 PolarHBondContact O-N 3.49Å; L412-N415 PolarHBondContact O-N 2.97Å; N415-K417 VanDerWaalsContact C-N 3.28Å; N415-K417 PolarHBondContact O-N 3.38Å; N415-S418 PolarHBondContact O-N 3.34Å; N415-S418 PolarHBondContact O-OG 3.28Å; N415-E419 WeakPolarHBondContact O-CB 3.31Å; N415-E419 PolarHBondContact O-N 3.1Å
416	V	85.4	Confident	89.1	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-42	175.3	168.6	0	0	0	0	110.5	L412 K420 L752 V755 I759	L412-V416 HydrophobicContact CD1-CG2 4.14Å; L412-V416 HydrophobicContact CG-CG2 4.26Å; L412-V416 WeakPolarHBondContact O-CB 3.46Å; L412-V416 VanDerWaalsContact O-CG2 3.32Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 3.28Å; V416-K420 WeakPolarHBondContact O-CB 3.2Å; V416-K420 PolarHBondContact O-N 2.99Å; V416-L752 HydrophobicContact CG1-CB 4.19Å; V416-L752 HydrophobicContact CG1-CD2 4.1Å; V416-L752 WeakPolarHBondContact CG1-O 3.29Å; V416-L752 HydrophobicContact CG2-CD2 4.49Å; V416-V755 HydrophobicContact CG2-CG1 4Å; V416-I759 HydrophobicContact CG2-CD1 4.44Å
417	K	88.6	Confident	88.7	Confident	131 Å²	131	65.2 Å²	65.2	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-47.1	176.7	-174.3	-178.7	175.3	-174.3	0	112.2	Q413 K414 N415 K420 E421	Q413-K417 WeakPolarHBondContact O-CB 3.46Å; Q413-K417 PolarHBondContact O-N 3.4Å; K414-K417 PolarHBondContact O-N 3.3Å; N415-K417 VanDerWaalsContact C-N 3.28Å; N415-K417 PolarHBondContact O-N 3.38Å; K417-K420 PolarHBondContact O-N 2.98Å; K417-E421 WeakPolarHBondContact CE-OE1 3.43Å; K417-E421 WeakPolarHBondContact O-CG 3.34Å; K417-E421 PolarHBondContact O-N 2.81Å
418	S	88.7	Confident	88.5	Confident	56 Å²	56	62.7 Å²	62.7	39%	0.392	31%	0.306	S	S	.	.	H	α-helix	trans	-65.8	-39.5	179.9	60.7	0	0	0	0	112.3	K414 N415 E421 R422	K414-S418 PolarHBondContact O-N 3.23Å; K414-S418 PolarHBondContact O-OG 2.85Å; N415-S418 PolarHBondContact O-N 3.34Å; N415-S418 PolarHBondContact O-OG 3.28Å; S418-E421 PolarHBondContact O-N 2.87Å; S418-R422 PolarHBondContact O-N 3.43Å
419	E	84.2	Confident	88.5	Confident	37 Å²	37	68.7 Å²	68.7	17%	0.173	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-38.3	174.3	-78.6	-60.3	130	0	0	112.1	N415 R422 C423 L752	N415-E419 WeakPolarHBondContact O-CB 3.31Å; N415-E419 PolarHBondContact O-N 3.1Å; E419-R422 WeakPolarHBondContact O-CB 3.21Å; E419-R422 PolarHBondContact O-N 3Å; E419-R422 IonicContact OE1-CZ 3.54Å; E419-R422 IonicContact OE1-NE 3.55Å; E419-R422 PolarHBondContact OE1-NE 2.96Å; E419-R422 IonicContact OE1-NH2 3.51Å; E419-R422 IonicContact OE2-CZ 2.75Å; E419-R422 VanDerWaalsContact OE2-CZ 3.25Å; E419-R422 IonicContact OE2-NE 3.28Å; E419-R422 PolarHBondContact OE2-NE 3.14Å; E419-R422 IonicContact OE2-NH2 3.92Å; E419-R422 PolarHBondContact OE2-NH2 2.87Å; E419-C423 WeakPolarHBondContact O-CB 3.12Å; E419-C423 PolarHBondContact O-N 3.48Å; E419-L752 HydrophobicContact CB-CD1 4.12Å
420	K	85.9	Confident	88.5	Confident	68 Å²	68	71.2 Å²	71.2	30%	0.296	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-48	173	-175.4	-174	179.2	-179.1	0	111.2	V416 K417 R422 C423 V424 L752 D753	V416-K420 WeakPolarHBondContact O-CB 3.2Å; V416-K420 PolarHBondContact O-N 2.99Å; K417-K420 PolarHBondContact O-N 2.98Å; K420-R422 PolarHBondContact O-N 3.27Å; K420-C423 WeakPolarHBondContact O-CB 3.44Å; K420-C423 PolarHBondContact O-N 3.49Å; K420-C423 VanDerWaalsContact O-N 3.12Å; K420-V424 HydrophobicContact CG-CG2 4.39Å; K420-V424 WeakPolarHBondContact O-CG2 3.47Å; K420-V424 PolarHBondContact O-N 2.93Å; K420-L752 HydrophobicContact CB-CB 4.48Å; K420-L752 HydrophobicContact CB-CD1 4.22Å; K420-D753 WeakPolarHBondContact CD-OD1 3.42Å; K420-D753 VanDerWaalsContact CE-OD1 3.25Å; K420-D753 WeakPolarHBondContact CE-OD1 3.33Å; K420-D753 VanDerWaalsContact CE-OD2 3.26Å; K420-D753 WeakPolarHBondContact CE-OD2 3.29Å; K420-D753 IonicContact NZ-OD1 3.65Å; K420-D753 PolarHBondContact NZ-OD1 3Å; K420-D753 IonicContact NZ-OD2 2.73Å; K420-D753 PolarHBondContact NZ-OD2 3.37Å
421	E	89.9	Confident	88.4	Confident	95 Å²	95	73.2 Å²	73.2	44%	0.444	35%	0.349	S	S	.	.	H	α-helix	trans	-61.7	-33.3	177.4	-72	172.5	-172.7	0	0	112.2	K417 S418 R425	K417-E421 WeakPolarHBondContact CE-OE1 3.43Å; K417-E421 WeakPolarHBondContact O-CG 3.34Å; K417-E421 PolarHBondContact O-N 2.81Å; S418-E421 PolarHBondContact O-N 2.87Å; E421-R425 WeakPolarHBondContact O-CB 3.35Å; E421-R425 VanDerWaalsContact O-CG 3.32Å; E421-R425 WeakPolarHBondContact O-CG 3.13Å; E421-R425 PolarHBondContact O-N 3.46Å; E421-R425 PolarHBondContact O-NE 3.39Å; E421-R425 VanDerWaalsContact O-NE 3.1Å
422	R	88.1	Confident	88.4	Confident	91 Å²	91	74 Å²	74	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-68	-44.6	171.7	-172.5	175.7	77.2	122.6	-6.4	111.7	S418 E419 K420 R425 T426	S418-R422 PolarHBondContact O-N 3.43Å; E419-R422 WeakPolarHBondContact O-CB 3.21Å; E419-R422 PolarHBondContact O-N 3Å; E419-R422 IonicContact OE1-CZ 3.54Å; E419-R422 IonicContact OE1-NE 3.55Å; E419-R422 PolarHBondContact OE1-NE 2.96Å; E419-R422 IonicContact OE1-NH2 3.51Å; E419-R422 IonicContact OE2-CZ 2.75Å; E419-R422 VanDerWaalsContact OE2-CZ 3.25Å; E419-R422 IonicContact OE2-NE 3.28Å; E419-R422 PolarHBondContact OE2-NE 3.14Å; E419-R422 IonicContact OE2-NH2 3.92Å; E419-R422 PolarHBondContact OE2-NH2 2.87Å; K420-R422 PolarHBondContact O-N 3.27Å; R422-R425 PolarHBondContact O-N 2.99Å; R422-T426 PolarHBondContact O-N 2.96Å; R422-T426 PolarHBondContact O-OG1 3Å
423	C	87	Confident	88.5	Confident	9 Å²	9	77.3 Å²	77.3	6%	0.061	37%	0.367	C	S	.	.	H	α-helix	trans	-61.7	-48.8	179.8	-155.8	0	0	0	0	111.3	E419 K420 R425 T426 Y427 L745	E419-C423 WeakPolarHBondContact O-CB 3.12Å; E419-C423 PolarHBondContact O-N 3.48Å; K420-C423 WeakPolarHBondContact O-CB 3.44Å; K420-C423 PolarHBondContact O-N 3.49Å; K420-C423 VanDerWaalsContact O-N 3.12Å; C423-R425 PolarHBondContact O-N 3.35Å; C423-T426 PolarHBondContact O-N 3.4Å; C423-Y427 VanDerWaalsContact O-CB 3.25Å; C423-Y427 WeakPolarHBondContact O-CB 3.46Å; C423-Y427 PolarHBondContact O-N 3.3Å; C423-L745 PolarHBondContact SG-O 2.75Å
424	V	89.5	Confident	88.5	Confident	79 Å²	79	75.9 Å²	75.9	48%	0.479	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-42.4	178.7	172.4	0	0	0	0	111.9	K420 S428	K420-V424 HydrophobicContact CG-CG2 4.39Å; K420-V424 WeakPolarHBondContact O-CG2 3.47Å; K420-V424 PolarHBondContact O-N 2.93Å; V424-S428 VanDerWaalsContact O-CB 3.32Å; V424-S428 WeakPolarHBondContact O-CB 3.27Å; V424-S428 PolarHBondContact O-N 3.47Å
425	R	90.2	Very high	88.4	Confident	171 Å²	171	75.9 Å²	75.9	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-63.4	-42.8	176.4	-77.4	-176.6	-71.7	177.8	-2.5	112.3	E421 R422 C423 K429	E421-R425 WeakPolarHBondContact O-CB 3.35Å; E421-R425 VanDerWaalsContact O-CG 3.32Å; E421-R425 WeakPolarHBondContact O-CG 3.13Å; E421-R425 PolarHBondContact O-N 3.46Å; E421-R425 PolarHBondContact O-NE 3.39Å; E421-R425 VanDerWaalsContact O-NE 3.1Å; R422-R425 PolarHBondContact O-N 2.99Å; C423-R425 PolarHBondContact O-N 3.35Å; R425-K429 PolarHBondContact O-N 3.47Å; R425-K429 VanDerWaalsContact O-N 3.16Å
426	T	88.8	Confident	88.5	Confident	59 Å²	59	76.3 Å²	76.3	36%	0.362	36%	0.357	S	S	.	.	H	α-helix	trans	-69	-44.8	-179.6	-50.4	0	0	0	0	111	R422 C423 K429 K430 L745	R422-T426 PolarHBondContact O-N 2.96Å; R422-T426 PolarHBondContact O-OG1 3Å; C423-T426 PolarHBondContact O-N 3.4Å; T426-K429 PolarHBondContact O-N 3.43Å; T426-K430 WeakPolarHBondContact O-CG 3.43Å; T426-K430 PolarHBondContact O-N 3.18Å; T426-L745 HydrophobicContact CG2-CD1 3.83Å
427	Y	87.8	Confident	88.5	Confident	56 Å²	56	77.2 Å²	77.2	22%	0.22	36%	0.364	C	S	.	.	H	α-helix	trans	-54.3	-53.6	173	165	-91.8	0	0	0	111.3	C423 K429 K430 E431 V742 K746	C423-Y427 VanDerWaalsContact O-CB 3.25Å; C423-Y427 WeakPolarHBondContact O-CB 3.46Å; C423-Y427 PolarHBondContact O-N 3.3Å; Y427-K429 VanDerWaalsContact C-N 3.3Å; Y427-K429 PolarHBondContact O-N 3.32Å; Y427-K430 PolarHBondContact O-N 2.76Å; Y427-K430 VanDerWaalsContact O-N 3.13Å; Y427-E431 WeakPolarHBondContact CE1-OE2 3.35Å; Y427-E431 WeakPolarHBondContact O-CB 3.28Å; Y427-E431 PolarHBondContact O-N 2.65Å; Y427-E431 PolarHBondContact OH-OE1 3.03Å; Y427-E431 PolarHBondContact OH-OE2 2.97Å; Y427-V742 HydrophobicContact CD2-CG1 3.66Å; Y427-V742 HydrophobicContact CE2-CG1 3.36Å; Y427-K746 HydrophobicContact CD2-CB 4.26Å; Y427-K746 HydrophobicContact CE2-CB 4.11Å
428	S	91.4	Very high	88.5	Confident	65 Å²	65	77.8 Å²	77.8	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-38.5	-176.9	177.3	0	0	0	0	112.3	V424 E432	V424-S428 VanDerWaalsContact O-CB 3.32Å; V424-S428 WeakPolarHBondContact O-CB 3.27Å; V424-S428 PolarHBondContact O-N 3.47Å; S428-E432 WeakPolarHBondContact O-CB 3.28Å; S428-E432 PolarHBondContact O-N 3.38Å
429	K	91.2	Very high	88.6	Confident	146 Å²	146	78.2 Å²	78.2	64%	0.635	37%	0.365	S	S	*	.	H	α-helix	trans	-66	-43.9	175.6	-173.6	178.6	178.3	-177.3	0	112.1	R425 T426 Y427 E432 M433	R425-K429 PolarHBondContact O-N 3.47Å; R425-K429 VanDerWaalsContact O-N 3.16Å; T426-K429 PolarHBondContact O-N 3.43Å; Y427-K429 VanDerWaalsContact C-N 3.3Å; Y427-K429 PolarHBondContact O-N 3.32Å; K429-E432 PolarHBondContact O-N 2.92Å; K429-M433 WeakPolarHBondContact O-CG 3.31Å; K429-M433 PolarHBondContact O-N 2.71Å
430	K	88.3	Confident	88.7	Confident	53 Å²	53	81 Å²	81	23%	0.23	37%	0.374	C	S	.	.	H	α-helix	trans	-69.4	-38.3	179.1	-72.8	-84.5	-175	159.8	0	111.7	T426 Y427 E432 M433 V434 I738 E741 V742	T426-K430 WeakPolarHBondContact O-CG 3.43Å; T426-K430 PolarHBondContact O-N 3.18Å; Y427-K430 PolarHBondContact O-N 2.76Å; Y427-K430 VanDerWaalsContact O-N 3.13Å; K430-E432 VanDerWaalsContact C-N 3.33Å; K430-E432 PolarHBondContact O-N 2.58Å; K430-M433 HydrophobicContact CD-SD 4.32Å; K430-M433 WeakPolarHBondContact O-CB 3.47Å; K430-M433 PolarHBondContact O-N 2.97Å; K430-M433 VanDerWaalsContact O-N 3.16Å; K430-V434 WeakPolarHBondContact O-CG2 3.49Å; K430-V434 PolarHBondContact O-N 3.5Å; K430-I738 HydrophobicContact CD-CG2 4.1Å; K430-E741 WeakPolarHBondContact CE-OE2 3.39Å; K430-E741 IonicContact NZ-OE2 3.68Å; K430-E741 PolarHBondContact NZ-OE2 2.91Å; K430-V742 HydrophobicContact CB-CG2 3.54Å
431	E	90.1	Very high	88.7	Confident	89 Å²	89	78.4 Å²	78.4	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-40.3	174.1	-174.6	177.2	-145.2	0	0	111.7	Y427 V434 R435	Y427-E431 WeakPolarHBondContact CE1-OE2 3.35Å; Y427-E431 WeakPolarHBondContact O-CB 3.28Å; Y427-E431 PolarHBondContact O-N 2.65Å; Y427-E431 PolarHBondContact OH-OE1 3.03Å; Y427-E431 PolarHBondContact OH-OE2 2.97Å; E431-V434 PolarHBondContact O-N 3.05Å; E431-R435 WeakPolarHBondContact O-CB 3.31Å; E431-R435 PolarHBondContact O-N 3.41Å
432	E	90.9	Very high	88.7	Confident	87 Å²	87	77.3 Å²	77.3	41%	0.407	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-45.6	170.4	170	150.4	-115.3	0	0	112.2	S428 K429 K430 V434 R435 E436	S428-E432 WeakPolarHBondContact O-CB 3.28Å; S428-E432 PolarHBondContact O-N 3.38Å; K429-E432 PolarHBondContact O-N 2.92Å; K430-E432 VanDerWaalsContact C-N 3.33Å; K430-E432 PolarHBondContact O-N 2.58Å; E432-V434 VanDerWaalsContact C-N 3.32Å; E432-V434 PolarHBondContact O-N 3.23Å; E432-R435 VanDerWaalsContact CB-NH2 3.35Å; E432-R435 VanDerWaalsContact CD-NH2 3.27Å; E432-R435 PolarHBondContact O-N 3.27Å; E432-R435 IonicContact OE1-CZ 3.8Å; E432-R435 IonicContact OE1-NH1 3.68Å; E432-R435 IonicContact OE1-NH2 2.66Å; E432-R435 PolarHBondContact OE1-NH2 3.44Å; E432-E436 WeakPolarHBondContact O-CG 3.37Å; E432-E436 PolarHBondContact O-N 2.87Å
433	M	87.8	Confident	88.7	Confident	73 Å²	73	79.3 Å²	79.3	36%	0.36	38%	0.379	S	S	.	.	H	α-helix	trans	-59.2	-41.1	175.5	-69.7	174.2	63.6	0	0	112.5	K429 K430 S437	K429-M433 WeakPolarHBondContact O-CG 3.31Å; K429-M433 PolarHBondContact O-N 2.71Å; K430-M433 HydrophobicContact CD-SD 4.32Å; K430-M433 WeakPolarHBondContact O-CB 3.47Å; K430-M433 PolarHBondContact O-N 2.97Å; K430-M433 VanDerWaalsContact O-N 3.16Å; M433-S437 VanDerWaalsContact O-CB 3.28Å; M433-S437 WeakPolarHBondContact O-CB 3.46Å; M433-S437 PolarHBondContact O-N 3.18Å; M433-S437 PolarHBondContact O-OG 3.3Å
434	V	87.6	Confident	88.8	Confident	15 Å²	15	79.1 Å²	79.1	9%	0.091	38%	0.377	C	S	.	.	H	α-helix	trans	-62.7	-46.3	175.4	169.3	0	0	0	0	110.6	K430 E431 E432 S437 R438 L735 I738 Q739 V742	K430-V434 WeakPolarHBondContact O-CG2 3.49Å; K430-V434 PolarHBondContact O-N 3.5Å; E431-V434 PolarHBondContact O-N 3.05Å; E432-V434 VanDerWaalsContact C-N 3.32Å; E432-V434 PolarHBondContact O-N 3.23Å; V434-S437 PolarHBondContact O-N 2.95Å; V434-R438 WeakPolarHBondContact O-CB 3.44Å; V434-R438 PolarHBondContact O-N 3.37Å; V434-L735 HydrophobicContact CB-CD1 4.38Å; V434-L735 HydrophobicContact CG1-CD1 4Å; V434-L735 HydrophobicContact CG2-CD1 4.46Å; V434-I738 HydrophobicContact CG2-CB 4.1Å; V434-I738 HydrophobicContact CG2-CG2 3.49Å; V434-I738 VanDerWaalsContact CG2-CG2 3.49Å; V434-Q739 HydrophobicContact CG1-CG 3.73Å; V434-Q739 HydrophobicContact CG2-CG 3.99Å; V434-V742 HydrophobicContact CG2-CG2 4.36Å
435	R	89.6	Confident	88.7	Confident	139 Å²	139	79.3 Å²	79.3	53%	0.525	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-46.4	178.6	173.6	176	43.8	71.9	-5.5	111.6	E431 E432 S439	E431-R435 WeakPolarHBondContact O-CB 3.31Å; E431-R435 PolarHBondContact O-N 3.41Å; E432-R435 VanDerWaalsContact CB-NH2 3.35Å; E432-R435 VanDerWaalsContact CD-NH2 3.27Å; E432-R435 PolarHBondContact O-N 3.27Å; E432-R435 IonicContact OE1-CZ 3.8Å; E432-R435 IonicContact OE1-NH1 3.68Å; E432-R435 IonicContact OE1-NH2 2.66Å; E432-R435 PolarHBondContact OE1-NH2 3.44Å; R435-S439 PolarHBondContact O-N 3.36Å; R435-S439 VanDerWaalsContact O-N 3.08Å
436	E	88.5	Confident	88.7	Confident	79 Å²	79	76.1 Å²	76.1	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-44.2	176.2	-73.3	-176.7	-174.5	0	0	112.4	E432 R438 S439 R440	E432-E436 WeakPolarHBondContact O-CG 3.37Å; E432-E436 PolarHBondContact O-N 2.87Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 3.11Å; E436-S439 WeakPolarHBondContact O-CB 3.46Å; E436-S439 PolarHBondContact O-N 2.89Å; E436-R440 WeakPolarHBondContact O-CG 3.39Å; E436-R440 PolarHBondContact O-N 2.61Å; E436-R440 IonicContact OE2-NH2 2.73Å; E436-R440 PolarHBondContact OE2-NH2 2.97Å
437	S	85.5	Confident	88.7	Confident	24 Å²	24	77.5 Å²	77.5	17%	0.168	37%	0.373	C	S	.	.	H	α-helix	trans	-65	-39.5	-179.3	-58.5	0	0	0	0	111.4	M433 V434 R440 M441	M433-S437 VanDerWaalsContact O-CB 3.28Å; M433-S437 WeakPolarHBondContact O-CB 3.46Å; M433-S437 PolarHBondContact O-N 3.18Å; M433-S437 PolarHBondContact O-OG 3.3Å; V434-S437 PolarHBondContact O-N 2.95Å; S437-R440 PolarHBondContact O-N 3Å; S437-M441 WeakPolarHBondContact O-CB 3.3Å; S437-M441 PolarHBondContact O-N 3.45Å
438	R	88.5	Confident	88.7	Confident	142 Å²	142	75.4 Å²	75.4	54%	0.536	37%	0.365	S	S	.	.	H	α-helix	trans	-65.4	-37.2	174	-172.9	178	-83.5	177.2	-8	112.5	V434 E436 S442 L735	V434-R438 WeakPolarHBondContact O-CB 3.44Å; V434-R438 PolarHBondContact O-N 3.37Å; E436-R438 VanDerWaalsContact C-N 3.35Å; E436-R438 PolarHBondContact O-N 3.11Å; R438-S442 PolarHBondContact O-N 3.34Å; R438-S442 VanDerWaalsContact O-N 3.12Å; R438-S442 PolarHBondContact O-OG 3.04Å; R438-L735 HydrophobicContact CB-CD2 4.41Å
439	S	89.4	Confident	88.5	Confident	65 Å²	65	78.9 Å²	78.9	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-50	173.1	-165.7	0	0	0	0	111	R435 E436 M441 S442 E443	R435-S439 PolarHBondContact O-N 3.36Å; R435-S439 VanDerWaalsContact O-N 3.08Å; E436-S439 WeakPolarHBondContact O-CB 3.46Å; E436-S439 PolarHBondContact O-N 2.89Å; S439-M441 VanDerWaalsContact C-N 3.31Å; S439-M441 PolarHBondContact O-N 2.92Å; S439-S442 WeakPolarHBondContact O-CB 3.36Å; S439-S442 PolarHBondContact O-N 3.09Å; S439-S442 VanDerWaalsContact O-N 3.09Å; S439-E443 PolarHBondContact O-N 3.33Å
440	R	86.9	Confident	88.4	Confident	96 Å²	96	75.6 Å²	75.6	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-38.6	177.3	-74	-175.1	-110	173.8	-5.4	112.4	E436 S437 S442 E443 F444	E436-R440 WeakPolarHBondContact O-CG 3.39Å; E436-R440 PolarHBondContact O-N 2.61Å; E436-R440 IonicContact OE2-NH2 2.73Å; E436-R440 PolarHBondContact OE2-NH2 2.97Å; S437-R440 PolarHBondContact O-N 3Å; R440-S442 VanDerWaalsContact C-N 3.32Å; R440-S442 PolarHBondContact O-N 3.29Å; R440-E443 PolarHBondContact O-N 3.18Å; R440-F444 WeakPolarHBondContact O-CB 3.47Å; R440-F444 PolarHBondContact O-N 2.68Å
441	M	86.4	Confident	88.4	Confident	14 Å²	14	73.8 Å²	73.8	7%	0.069	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-42.9	173.7	-172.6	52.2	63	0	0	112	S437 S439 F444 L445 F537 T728 A731	S437-M441 WeakPolarHBondContact O-CB 3.3Å; S437-M441 PolarHBondContact O-N 3.45Å; S439-M441 VanDerWaalsContact C-N 3.31Å; S439-M441 PolarHBondContact O-N 2.92Å; M441-F444 PolarHBondContact O-N 3.12Å; M441-F444 HydrophobicContact SD-CD1 4.23Å; M441-L445 WeakPolarHBondContact O-CG 3.38Å; M441-L445 PolarHBondContact O-N 2.95Å; M441-F537 HydrophobicContact CE-CE2 3.75Å; M441-F537 HydrophobicContact CE-CZ 3.89Å; M441-T728 HydrophobicContact SD-CG2 4.14Å; M441-A731 HydrophobicContact CE-CB 3.11Å
442	S	89	Confident	88.3	Confident	72 Å²	72	70.1 Å²	70.1	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-66.6	-39.9	180	-56.3	0	0	0	0	111.8	R438 S439 R440 L446	R438-S442 PolarHBondContact O-N 3.34Å; R438-S442 VanDerWaalsContact O-N 3.12Å; R438-S442 PolarHBondContact O-OG 3.04Å; S439-S442 WeakPolarHBondContact O-CB 3.36Å; S439-S442 PolarHBondContact O-N 3.09Å; S439-S442 VanDerWaalsContact O-N 3.09Å; R440-S442 VanDerWaalsContact C-N 3.32Å; R440-S442 PolarHBondContact O-N 3.29Å; S442-L446 PolarHBondContact O-N 3.21Å
443	E	89	Confident	88.2	Confident	132 Å²	132	69.6 Å²	69.6	62%	0.617	34%	0.341	S	S	*	.	H	α-helix	trans	-64.4	-40.9	172.1	-71.4	179.8	-179.7	0	0	112	S439 R440 L445 L446 H447	S439-E443 PolarHBondContact O-N 3.33Å; R440-E443 PolarHBondContact O-N 3.18Å; E443-L445 PolarHBondContact O-N 3.33Å; E443-L446 WeakPolarHBondContact O-CB 3.38Å; E443-L446 PolarHBondContact O-N 3.46Å; E443-H447 PolarHBondContact O-N 3.33Å
444	F	88.1	Confident	88.3	Confident	5 Å²	5	70.6 Å²	70.6	2%	0.022	35%	0.348	C	S	.	.	H	α-helix	trans	-62.5	-42.7	177.2	179.5	-113.5	0	0	0	112.2	R440 M441 L446 H447 I448 L530 T533 I534 F537 L727	R440-F444 WeakPolarHBondContact O-CB 3.47Å; R440-F444 PolarHBondContact O-N 2.68Å; M441-F444 PolarHBondContact O-N 3.12Å; M441-F444 HydrophobicContact SD-CD1 4.23Å; F444-L446 VanDerWaalsContact C-N 3.3Å; F444-L446 PolarHBondContact O-N 3.41Å; F444-H447 WeakPolarHBondContact O-CB 3.48Å; F444-H447 PolarHBondContact O-N 3.23Å; F444-H447 VanDerWaalsContact O-N 3.1Å; F444-I448 HydrophobicContact CD1-CD1 3.58Å; F444-I448 HydrophobicContact CD1-CG1 4.44Å; F444-I448 HydrophobicContact CE1-CD1 3.23Å; F444-I448 HydrophobicContact CE1-CG1 4.05Å; F444-I448 HydrophobicContact CE2-CD1 4.28Å; F444-I448 HydrophobicContact CE2-CG1 4.23Å; F444-I448 HydrophobicContact CG-CD1 4.23Å; F444-I448 HydrophobicContact CZ-CD1 3.63Å; F444-I448 HydrophobicContact CZ-CG1 3.93Å; F444-I448 WeakPolarHBondContact O-CG1 3.43Å; F444-I448 PolarHBondContact O-N 2.91Å; F444-L530 HydrophobicContact CE2-CD2 4.28Å; F444-L530 WeakPolarHBondContact CE2-O 3.35Å; F444-T533 HydrophobicContact CD2-CG2 3.9Å; F444-T533 HydrophobicContact CE2-CG2 4.31Å; F444-I534 HydrophobicContact CD1-CD1 4.19Å; F444-I534 HydrophobicContact CD1-CG1 4.38Å; F444-I534 HydrophobicContact CE1-CB 4.13Å; F444-I534 HydrophobicContact CE1-CD1 3.64Å; F444-I534 HydrophobicContact CE1-CG1 4.05Å; F444-I534 HydrophobicContact CE2-CB 4.07Å; F444-I534 HydrophobicContact CZ-CB 3.8Å; F444-I534 HydrophobicContact CZ-CD1 4.13Å; F444-I534 HydrophobicContact CZ-CG1 4.25Å; F444-F537 HydrophobicContact CB-CE1 4.27Å; F444-F537 HydrophobicContact CB-CZ 4.33Å; F444-F537 HydrophobicContact CG-CE1 4.36Å; F444-F537 HydrophobicContact CG-CZ 4.42Å; F444-L727 HydrophobicContact CZ-CD1 4.47Å
445	L	88.2	Confident	88.4	Confident	83 Å²	83	70 Å²	70	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-60.9	-38.3	174.5	-71.7	174.3	0	0	0	112.3	M441 E443 I448 K449 T728	M441-L445 WeakPolarHBondContact O-CG 3.38Å; M441-L445 PolarHBondContact O-N 2.95Å; E443-L445 PolarHBondContact O-N 3.33Å; L445-I448 HydrophobicContact CD2-CD1 4.23Å; L445-K449 PolarHBondContact O-N 3.12Å; L445-T728 HydrophobicContact CD2-CG2 4.18Å
446	L	89.4	Confident	88.4	Confident	104 Å²	104	63.4 Å²	63.4	55%	0.545	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-40.4	173.8	-173.9	64.9	0	0	0	111.3	S442 E443 F444 K449 N450	S442-L446 PolarHBondContact O-N 3.21Å; E443-L446 WeakPolarHBondContact O-CB 3.38Å; E443-L446 PolarHBondContact O-N 3.46Å; F444-L446 VanDerWaalsContact C-N 3.3Å; F444-L446 PolarHBondContact O-N 3.41Å; L446-K449 PolarHBondContact O-N 3.29Å; L446-N450 PolarHBondContact O-N 2.68Å; L446-N450 PolarHBondContact O-ND2 3.34Å
447	H	88.5	Confident	88.3	Confident	89 Å²	89	64 Å²	64	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-42.3	177	-171.5	-95.6	0	0	0	112.2	E443 F444 K449 N450 A451	E443-H447 PolarHBondContact O-N 3.33Å; F444-H447 WeakPolarHBondContact O-CB 3.48Å; F444-H447 PolarHBondContact O-N 3.23Å; F444-H447 VanDerWaalsContact O-N 3.1Å; H447-K449 PolarHBondContact O-N 3.31Å; H447-N450 PolarHBondContact O-N 3.46Å; H447-A451 VanDerWaalsContact O-CB 3.32Å; H447-A451 WeakPolarHBondContact O-CB 3.4Å; H447-A451 PolarHBondContact O-N 3.35Å
448	I	87.8	Confident	88.4	Confident	12 Å²	12	67 Å²	67	6%	0.062	34%	0.336	C	S	.	.	H	α-helix	trans	-56.7	-49	173.2	-71.3	156.7	0	0	0	110.9	F444 L445 N450 A451 A452 L530 S724	F444-I448 HydrophobicContact CD1-CD1 3.58Å; F444-I448 HydrophobicContact CD1-CG1 4.44Å; F444-I448 HydrophobicContact CE1-CD1 3.23Å; F444-I448 HydrophobicContact CE1-CG1 4.05Å; F444-I448 HydrophobicContact CE2-CD1 4.28Å; F444-I448 HydrophobicContact CE2-CG1 4.23Å; F444-I448 HydrophobicContact CG-CD1 4.23Å; F444-I448 HydrophobicContact CZ-CD1 3.63Å; F444-I448 HydrophobicContact CZ-CG1 3.93Å; F444-I448 WeakPolarHBondContact O-CG1 3.43Å; F444-I448 PolarHBondContact O-N 2.91Å; L445-I448 HydrophobicContact CD2-CD1 4.23Å; I448-N450 VanDerWaalsContact C-N 3.32Å; I448-N450 PolarHBondContact O-N 2.9Å; I448-A451 PolarHBondContact O-N 3.29Å; I448-A452 WeakPolarHBondContact O-CB 3.45Å; I448-A452 PolarHBondContact O-N 2.88Å; I448-L530 HydrophobicContact CG1-CD1 4.49Å; I448-L530 HydrophobicContact CG1-CD2 3.93Å; I448-S724 VanDerWaalsContact CG2-CB 3.42Å
449	K	88.1	Confident	88.4	Confident	138 Å²	138	60.2 Å²	60.2	60%	0.6	31%	0.31	S	S	*	.	H	α-helix	trans	-60.4	-42.6	-179.7	-177.9	175.7	178.7	177.2	0	111.7	L445 L446 H447 N453	L445-K449 PolarHBondContact O-N 3.12Å; L446-K449 PolarHBondContact O-N 3.29Å; H447-K449 PolarHBondContact O-N 3.31Å; K449-N453 PolarHBondContact O-N 3.44Å; K449-N453 VanDerWaalsContact O-N 3.16Å; K449-N453 PolarHBondContact O-ND2 3.14Å
450	N	89.6	Confident	88.4	Confident	76 Å²	76	61 Å²	61	41%	0.406	31%	0.307	S	S	.	.	H	α-helix	trans	-68.3	-41.9	177.5	-69.4	-19.3	0	0	0	111.8	L446 H447 I448 N453 N454	L446-N450 PolarHBondContact O-N 2.68Å; L446-N450 PolarHBondContact O-ND2 3.34Å; H447-N450 PolarHBondContact O-N 3.46Å; I448-N450 VanDerWaalsContact C-N 3.32Å; I448-N450 PolarHBondContact O-N 2.9Å; N450-N453 PolarHBondContact O-N 2.96Å; N450-N454 WeakPolarHBondContact O-CB 3.48Å; N450-N454 VanDerWaalsContact O-CG 3.24Å; N450-N454 PolarHBondContact O-N 3.32Å; N450-N454 PolarHBondContact O-ND2 2.94Å
451	A	88.4	Confident	88.4	Confident	15 Å²	15	62 Å²	62	12%	0.124	32%	0.315	C	S	.	.	H	α-helix	trans	-61.9	-44.2	177.1	0	0	0	0	0	111.9	H447 I448 N453 N454 L455 T526 L530	H447-A451 VanDerWaalsContact O-CB 3.32Å; H447-A451 WeakPolarHBondContact O-CB 3.4Å; H447-A451 PolarHBondContact O-N 3.35Å; I448-A451 PolarHBondContact O-N 3.29Å; A451-N453 PolarHBondContact O-N 2.99Å; A451-N454 PolarHBondContact O-N 3.45Å; A451-L455 WeakPolarHBondContact O-CB 3.13Å; A451-L455 PolarHBondContact O-N 3.45Å; A451-T526 HydrophobicContact CB-CG2 4.02Å; A451-L530 HydrophobicContact CB-CD2 4.24Å
452	A	88.2	Confident	88.6	Confident	13 Å²	13	63.2 Å²	63.2	11%	0.107	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-42	176.7	0	0	0	0	0	112.2	I448 G456 I720	I448-A452 WeakPolarHBondContact O-CB 3.45Å; I448-A452 PolarHBondContact O-N 2.88Å; A452-G456 PolarHBondContact O-N 2.9Å; A452-I720 HydrophobicContact CB-CB 4.35Å; A452-I720 HydrophobicContact CB-CG2 4.04Å
453	N	88.5	Confident	88.6	Confident	75 Å²	75	59.8 Å²	59.8	40%	0.401	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-47.3	177.5	-78.9	-22	0	0	0	112.5	K449 N450 A451 G456 I457	K449-N453 PolarHBondContact O-N 3.44Å; K449-N453 VanDerWaalsContact O-N 3.16Å; K449-N453 PolarHBondContact O-ND2 3.14Å; N450-N453 PolarHBondContact O-N 2.96Å; A451-N453 PolarHBondContact O-N 2.99Å; N453-G456 PolarHBondContact O-N 3.08Å; N453-I457 WeakPolarHBondContact O-CG1 3.41Å; N453-I457 PolarHBondContact O-N 3.4Å
454	N	89.6	Confident	88.6	Confident	94 Å²	94	54.9 Å²	54.9	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-45.8	179.8	-70.7	-15	0	0	0	111	N450 A451 G456 I457 E458	N450-N454 WeakPolarHBondContact O-CB 3.48Å; N450-N454 VanDerWaalsContact O-CG 3.24Å; N450-N454 PolarHBondContact O-N 3.32Å; N450-N454 PolarHBondContact O-ND2 2.94Å; A451-N454 PolarHBondContact O-N 3.45Å; N454-G456 VanDerWaalsContact C-N 3.29Å; N454-G456 PolarHBondContact O-N 2.98Å; N454-I457 PolarHBondContact O-N 2.87Å; N454-I457 VanDerWaalsContact O-N 3.17Å; N454-E458 PolarHBondContact O-N 2.94Å
455	L	89.3	Confident	88.6	Confident	3 Å²	3	61 Å²	61	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-60.9	-41.2	175.6	-174.8	62.5	0	0	0	110.9	A451 I457 E458 V459 Q522 I523 T526 V716 I720	A451-L455 WeakPolarHBondContact O-CB 3.13Å; A451-L455 PolarHBondContact O-N 3.45Å; L455-I457 VanDerWaalsContact C-N 3.31Å; L455-I457 PolarHBondContact O-N 3.42Å; L455-E458 PolarHBondContact O-N 2.89Å; L455-V459 HydrophobicContact CD1-CG2 4.27Å; L455-V459 HydrophobicContact CG-CG2 4.17Å; L455-V459 WeakPolarHBondContact O-CB 3.25Å; L455-V459 WeakPolarHBondContact O-CG2 3.25Å; L455-V459 PolarHBondContact O-N 3.07Å; L455-Q522 HydrophobicContact CD1-CB 3.73Å; L455-I523 HydrophobicContact CD2-CG1 4.12Å; L455-T526 HydrophobicContact CD2-CG2 4.26Å; L455-V716 HydrophobicContact CD2-CG1 3.47Å; L455-V716 VanDerWaalsContact CD2-CG1 3.47Å; L455-V716 HydrophobicContact CG-CG1 3.75Å; L455-I720 HydrophobicContact CD2-CD1 3.94Å; L455-I720 HydrophobicContact CD2-CG1 3.85Å
456	G	89	Confident	88.7	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-38.3	175	0	0	0	0	0	114	A452 N453 N454 Q460	A452-G456 PolarHBondContact O-N 2.9Å; N453-G456 PolarHBondContact O-N 3.08Å; N454-G456 VanDerWaalsContact C-N 3.29Å; N454-G456 PolarHBondContact O-N 2.98Å; G456-Q460 PolarHBondContact O-N 3.33Å; G456-Q460 VanDerWaalsContact O-N 3.15Å
457	I	87.8	Confident	88.6	Confident	91 Å²	91	53.3 Å²	53.3	47%	0.467	26%	0.263	S	S	.	.	H	α-helix	trans	-70.2	-44.7	176.2	-64.2	165.7	0	0	0	110.7	N453 N454 L455 V459 Q460 E461	N453-I457 WeakPolarHBondContact O-CG1 3.41Å; N453-I457 PolarHBondContact O-N 3.4Å; N454-I457 PolarHBondContact O-N 2.87Å; N454-I457 VanDerWaalsContact O-N 3.17Å; L455-I457 VanDerWaalsContact C-N 3.31Å; L455-I457 PolarHBondContact O-N 3.42Å; I457-V459 VanDerWaalsContact C-N 3.33Å; I457-V459 PolarHBondContact O-N 2.72Å; I457-Q460 WeakPolarHBondContact O-CB 3.41Å; I457-Q460 PolarHBondContact O-N 3.16Å; I457-E461 PolarHBondContact O-N 2.95Å
458	E	87.7	Confident	88.6	Confident	88 Å²	88	52.7 Å²	52.7	41%	0.411	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-41.4	177.7	-70.9	-179.6	-159.4	0	0	112.1	N454 L455 Q460 E461 Q462 Q522	N454-E458 PolarHBondContact O-N 2.94Å; L455-E458 PolarHBondContact O-N 2.89Å; E458-Q460 VanDerWaalsContact C-N 3.33Å; E458-Q460 PolarHBondContact O-N 3.44Å; E458-E461 PolarHBondContact O-N 3.42Å; E458-Q462 WeakPolarHBondContact O-CG 3.25Å; E458-Q462 PolarHBondContact O-N 2.94Å; E458-Q462 VanDerWaalsContact O-N 3.13Å; E458-Q522 PolarHBondContact OE2-NE2 3.43Å
459	V	87.8	Confident	88.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-45.2	175.6	170.3	0	0	0	0	110.5	L455 I457 E461 Q462 I463 V519 F558 V716	L455-V459 HydrophobicContact CD1-CG2 4.27Å; L455-V459 HydrophobicContact CG-CG2 4.17Å; L455-V459 WeakPolarHBondContact O-CB 3.25Å; L455-V459 WeakPolarHBondContact O-CG2 3.25Å; L455-V459 PolarHBondContact O-N 3.07Å; I457-V459 VanDerWaalsContact C-N 3.33Å; I457-V459 PolarHBondContact O-N 2.72Å; V459-E461 VanDerWaalsContact C-N 3.34Å; V459-E461 PolarHBondContact O-N 2.98Å; V459-Q462 PolarHBondContact O-N 2.92Å; V459-I463 HydrophobicContact CG1-CD1 3.42Å; V459-I463 VanDerWaalsContact CG1-CD1 3.42Å; V459-I463 HydrophobicContact CG1-CG1 4.12Å; V459-I463 WeakPolarHBondContact O-CB 3.49Å; V459-I463 VanDerWaalsContact O-CG1 3.28Å; V459-I463 WeakPolarHBondContact O-CG1 3.42Å; V459-I463 PolarHBondContact O-N 3.01Å; V459-V519 HydrophobicContact CG1-CG1 4.39Å; V459-V519 HydrophobicContact CG1-CG2 4.29Å; V459-V519 HydrophobicContact CG2-CG1 3.6Å; V459-F558 HydrophobicContact CG1-CZ 4.09Å; V459-V716 HydrophobicContact CG1-CG2 4.14Å; V459-V716 HydrophobicContact CG2-CB 4.39Å; V459-V716 HydrophobicContact CG2-CG1 4.16Å; V459-V716 HydrophobicContact CG2-CG2 3.99Å
460	Q	88.7	Confident	88.6	Confident	81 Å²	81	50.5 Å²	50.5	38%	0.379	26%	0.257	S	S	.	.	H	α-helix	trans	-57.3	-46.8	178.1	157	165.8	16.5	0	0	111.7	G456 I457 E458 Q462 I463 S464 V709	G456-Q460 PolarHBondContact O-N 3.33Å; G456-Q460 VanDerWaalsContact O-N 3.15Å; I457-Q460 WeakPolarHBondContact O-CB 3.41Å; I457-Q460 PolarHBondContact O-N 3.16Å; E458-Q460 VanDerWaalsContact C-N 3.33Å; E458-Q460 PolarHBondContact O-N 3.44Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 3.39Å; Q460-I463 PolarHBondContact O-N 3.19Å; Q460-S464 WeakPolarHBondContact O-CB 3.42Å; Q460-S464 PolarHBondContact O-N 2.93Å; Q460-S464 PolarHBondContact O-OG 2.99Å; Q460-V709 HydrophobicContact CB-CG1 3.65Å; Q460-V709 HydrophobicContact CG-CG1 3.47Å; Q460-V709 VanDerWaalsContact CG-CG1 3.47Å
461	E	88.3	Confident	88.4	Confident	116 Å²	116	49 Å²	49	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-35.8	178.2	-67.9	-174.4	177.1	0	0	112.9	I457 E458 V459 K465	I457-E461 PolarHBondContact O-N 2.95Å; E458-E461 PolarHBondContact O-N 3.42Å; V459-E461 VanDerWaalsContact C-N 3.34Å; V459-E461 PolarHBondContact O-N 2.98Å; E461-K465 WeakPolarHBondContact O-CG 3.48Å; E461-K465 PolarHBondContact O-N 2.94Å
462	Q	88.9	Confident	88.4	Confident	40 Å²	40	53.3 Å²	53.3	19%	0.187	27%	0.268	C	S	.	.	H	α-helix	trans	-73.1	-42.3	179	-72.9	-174.3	6.1	0	0	112.6	E458 V459 Q460 K465 E466 R518 V519 Q522	E458-Q462 WeakPolarHBondContact O-CG 3.25Å; E458-Q462 PolarHBondContact O-N 2.94Å; E458-Q462 VanDerWaalsContact O-N 3.13Å; V459-Q462 PolarHBondContact O-N 2.92Å; Q460-Q462 VanDerWaalsContact C-N 3.31Å; Q460-Q462 PolarHBondContact O-N 3.39Å; Q462-K465 WeakPolarHBondContact O-CB 3.42Å; Q462-K465 PolarHBondContact O-N 3.28Å; Q462-E466 PolarHBondContact O-N 2.94Å; Q462-R518 PolarHBondContact OE1-O 3.38Å; Q462-V519 HydrophobicContact CB-CG2 4.45Å; Q462-Q522 VanDerWaalsContact CD-OE1 3.25Å
463	I	89.6	Confident	88.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-42.3	178.4	-67.8	176.2	0	0	0	110.1	V459 Q460 K465 E466 F467 C515 F558 V709 C712	V459-I463 HydrophobicContact CG1-CD1 3.42Å; V459-I463 VanDerWaalsContact CG1-CD1 3.42Å; V459-I463 HydrophobicContact CG1-CG1 4.12Å; V459-I463 WeakPolarHBondContact O-CB 3.49Å; V459-I463 VanDerWaalsContact O-CG1 3.28Å; V459-I463 WeakPolarHBondContact O-CG1 3.42Å; V459-I463 PolarHBondContact O-N 3.01Å; Q460-I463 PolarHBondContact O-N 3.19Å; I463-K465 VanDerWaalsContact C-N 3.29Å; I463-K465 PolarHBondContact O-N 3.43Å; I463-E466 PolarHBondContact O-N 3.19Å; I463-E466 VanDerWaalsContact O-N 3.17Å; I463-F467 HydrophobicContact CG2-CD2 3.82Å; I463-F467 HydrophobicContact CG2-CE2 4.03Å; I463-F467 WeakPolarHBondContact O-CB 3.31Å; I463-F467 PolarHBondContact O-N 3.24Å; I463-C515 HydrophobicContact CG1-CB 4.44Å; I463-F558 HydrophobicContact CD1-CE2 4.3Å; I463-F558 HydrophobicContact CD1-CZ 4.04Å; I463-V709 HydrophobicContact CB-CG2 4.27Å; I463-V709 HydrophobicContact CG2-CG2 3.73Å; I463-C712 HydrophobicContact CD1-CB 3.17Å
464	S	88.9	Confident	88.3	Confident	29 Å²	29	53.8 Å²	53.8	20%	0.203	26%	0.262	C	S	.	.	H	α-helix	trans	-59	-39.1	173.5	-79.8	0	0	0	0	112.6	Q460 N468 E705	Q460-S464 WeakPolarHBondContact O-CB 3.42Å; Q460-S464 PolarHBondContact O-N 2.93Å; Q460-S464 PolarHBondContact O-OG 2.99Å; S464-N468 PolarHBondContact O-N 3.02Å; S464-N468 PolarHBondContact O-ND2 3.31Å; S464-E705 WeakPolarHBondContact CA-OE1 3.47Å; S464-E705 WeakPolarHBondContact CB-OE1 3.47Å; S464-E705 PolarHBondContact OG-OE1 2.8Å
465	K	89.3	Confident	88.1	Confident	134 Å²	134	52.7 Å²	52.7	58%	0.583	26%	0.256	S	S	*	.	H	α-helix	trans	-64.8	-44.9	174.1	-75.4	172.7	-174.8	168.6	0	111.8	E461 Q462 I463 F467 N468 D469	E461-K465 WeakPolarHBondContact O-CG 3.48Å; E461-K465 PolarHBondContact O-N 2.94Å; Q462-K465 WeakPolarHBondContact O-CB 3.42Å; Q462-K465 PolarHBondContact O-N 3.28Å; I463-K465 VanDerWaalsContact C-N 3.29Å; I463-K465 PolarHBondContact O-N 3.43Å; K465-F467 VanDerWaalsContact C-N 3.31Å; K465-F467 PolarHBondContact O-N 3.47Å; K465-N468 PolarHBondContact O-N 3.29Å; K465-D469 PolarHBondContact O-N 3.37Å
466	E	89.4	Confident	88	Confident	19 Å²	19	56.2 Å²	56.2	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-35.8	179.4	-164.4	58.2	-130.1	0	0	112	Q462 I463 N468 D469 Q470 L511 R514	Q462-E466 PolarHBondContact O-N 2.94Å; I463-E466 PolarHBondContact O-N 3.19Å; I463-E466 VanDerWaalsContact O-N 3.17Å; E466-N468 PolarHBondContact O-N 3.36Å; E466-D469 PolarHBondContact O-N 2.99Å; E466-Q470 WeakPolarHBondContact O-CB 3.15Å; E466-Q470 WeakPolarHBondContact O-CG 3.49Å; E466-Q470 PolarHBondContact O-N 2.97Å; E466-Q470 PolarHBondContact OE1-NE2 3.09Å; E466-L511 HydrophobicContact CG-CD1 4.48Å; E466-R514 HydrophobicContact CG-CB 3.83Å; E466-R514 VanDerWaalsContact OE1-CD 3.32Å; E466-R514 WeakPolarHBondContact OE1-CD 3.41Å; E466-R514 IonicContact OE1-CZ 2.73Å; E466-R514 IonicContact OE1-NE 3.34Å; E466-R514 IonicContact OE1-NH1 3.19Å; E466-R514 PolarHBondContact OE1-NH1 2.94Å
467	F	88.1	Confident	88.1	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-45.7	171.7	-106.8	-92.8	0	0	0	112.3	I463 K465 Q470 M471 L511 V701 E705 I708	I463-F467 HydrophobicContact CG2-CD2 3.82Å; I463-F467 HydrophobicContact CG2-CE2 4.03Å; I463-F467 WeakPolarHBondContact O-CB 3.31Å; I463-F467 PolarHBondContact O-N 3.24Å; K465-F467 VanDerWaalsContact C-N 3.31Å; K465-F467 PolarHBondContact O-N 3.47Å; F467-Q470 PolarHBondContact O-N 3.49Å; F467-M471 PolarHBondContact O-N 2.97Å; F467-L511 HydrophobicContact CD2-CD1 4.12Å; F467-L511 HydrophobicContact CD2-CD2 4.39Å; F467-L511 HydrophobicContact CE1-CD2 3.98Å; F467-L511 HydrophobicContact CE2-CD1 4.27Å; F467-L511 HydrophobicContact CE2-CD2 3.84Å; F467-L511 HydrophobicContact CE2-CG 4.43Å; F467-L511 HydrophobicContact CG-CD1 4.48Å; F467-L511 HydrophobicContact CZ-CD2 3.62Å; F467-V701 HydrophobicContact CD1-CG1 3.86Å; F467-V701 HydrophobicContact CE1-CG1 3.64Å; F467-E705 HydrophobicContact CB-CG 4.28Å; F467-E705 HydrophobicContact CD1-CB 4.27Å; F467-E705 HydrophobicContact CD1-CG 4.14Å; F467-E705 HydrophobicContact CD2-CG 4.37Å; F467-E705 HydrophobicContact CE1-CB 4.41Å; F467-E705 HydrophobicContact CG-CG 4.01Å; F467-I708 HydrophobicContact CE1-CD1 4.47Å; F467-I708 HydrophobicContact CE2-CB 4.19Å; F467-I708 HydrophobicContact CE2-CG2 3.73Å; F467-I708 HydrophobicContact CZ-CB 4.01Å; F467-I708 HydrophobicContact CZ-CD1 3.67Å; F467-I708 HydrophobicContact CZ-CG1 4.43Å; F467-I708 HydrophobicContact CZ-CG2 3.9Å
468	N	87.5	Confident	88.1	Confident	75 Å²	75	55.3 Å²	55.3	40%	0.401	27%	0.268	S	S	.	.	H	α-helix	trans	-67.1	-41.7	178.3	-72.2	-64.5	0	0	0	111.6	S464 K465 E466 Q470 M471 I472	S464-N468 PolarHBondContact O-N 3.02Å; S464-N468 PolarHBondContact O-ND2 3.31Å; K465-N468 PolarHBondContact O-N 3.29Å; E466-N468 PolarHBondContact O-N 3.36Å; N468-Q470 VanDerWaalsContact C-N 3.35Å; N468-M471 WeakPolarHBondContact O-CB 3.49Å; N468-M471 PolarHBondContact O-N 3.34Å; N468-I472 PolarHBondContact O-N 3.05Å
469	D	88.9	Confident	88	Confident	85 Å²	85	56.5 Å²	56.5	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-38.5	176.2	-80.1	4.5	0	0	0	111.7	K465 E466 M471 I472 R473	K465-D469 PolarHBondContact O-N 3.37Å; E466-D469 PolarHBondContact O-N 2.99Å; D469-M471 VanDerWaalsContact C-N 3.32Å; D469-M471 PolarHBondContact O-N 3.34Å; D469-I472 PolarHBondContact O-N 3.3Å; D469-R473 WeakPolarHBondContact O-CG 3.14Å; D469-R473 PolarHBondContact O-N 3.43Å; D469-R473 VanDerWaalsContact O-N 3.12Å
470	Q	87.3	Confident	87.9	Confident	20 Å²	20	63.3 Å²	63.3	9%	0.093	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-39.6	172.2	-76.1	-32.2	-62.2	0	0	112	E466 F467 N468 I472 R473 L474 L511	E466-Q470 WeakPolarHBondContact O-CB 3.15Å; E466-Q470 WeakPolarHBondContact O-CG 3.49Å; E466-Q470 PolarHBondContact O-N 2.97Å; E466-Q470 PolarHBondContact OE1-NE2 3.09Å; F467-Q470 PolarHBondContact O-N 3.49Å; N468-Q470 VanDerWaalsContact C-N 3.35Å; Q470-I472 VanDerWaalsContact C-N 3.31Å; Q470-I472 PolarHBondContact O-N 3.45Å; Q470-R473 PolarHBondContact O-N 3.22Å; Q470-L474 VanDerWaalsContact O-CB 3.3Å; Q470-L474 WeakPolarHBondContact O-CB 3.45Å; Q470-L474 PolarHBondContact O-N 3.05Å; Q470-L511 HydrophobicContact CB-CD1 4.19Å; Q470-L511 HydrophobicContact CG-CB 4.25Å; Q470-L511 HydrophobicContact CG-CD1 3.43Å; Q470-L511 VanDerWaalsContact CG-CD1 3.43Å; Q470-L511 HydrophobicContact CG-CG 4.37Å
471	M	85	Confident	87.9	Confident	45 Å²	45	60.7 Å²	60.7	22%	0.222	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-42.4	178.7	-164.4	56.4	61.1	0	0	111.9	F467 N468 D469 R473 L474 D475 G698 V701	F467-M471 PolarHBondContact O-N 2.97Å; N468-M471 WeakPolarHBondContact O-CB 3.49Å; N468-M471 PolarHBondContact O-N 3.34Å; D469-M471 VanDerWaalsContact C-N 3.32Å; D469-M471 PolarHBondContact O-N 3.34Å; M471-R473 VanDerWaalsContact C-N 3.35Å; M471-R473 PolarHBondContact O-N 3.28Å; M471-L474 PolarHBondContact O-N 3.24Å; M471-D475 PolarHBondContact O-N 2.63Å; M471-G698 WeakPolarHBondContact SD-CA 3.43Å; M471-V701 HydrophobicContact CE-CB 3.54Å; M471-V701 HydrophobicContact CE-CG1 3.52Å; M471-V701 HydrophobicContact CE-CG2 4.13Å
472	I	87.6	Confident	87.5	Confident	104 Å²	104	60 Å²	60	53%	0.533	31%	0.305	S	S	.	.	H	α-helix	trans	-65.3	-39.2	176.9	-62.7	166.6	0	0	0	111.1	N468 D469 Q470 D475 N476	N468-I472 PolarHBondContact O-N 3.05Å; D469-I472 PolarHBondContact O-N 3.3Å; Q470-I472 VanDerWaalsContact C-N 3.31Å; Q470-I472 PolarHBondContact O-N 3.45Å; I472-D475 PolarHBondContact O-N 2.94Å; I472-N476 PolarHBondContact O-N 3.22Å; I472-N476 PolarHBondContact O-ND2 3Å
473	R	87.7	Confident	87.1	Confident	88 Å²	88	62.5 Å²	62.5	33%	0.332	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-37	178	-71.5	178.2	70.7	-134.5	-2.3	112	D469 Q470 M471 N476 F477 E510 R514	D469-R473 WeakPolarHBondContact O-CG 3.14Å; D469-R473 PolarHBondContact O-N 3.43Å; D469-R473 VanDerWaalsContact O-N 3.12Å; Q470-R473 PolarHBondContact O-N 3.22Å; M471-R473 VanDerWaalsContact C-N 3.35Å; M471-R473 PolarHBondContact O-N 3.28Å; R473-N476 PolarHBondContact O-N 2.97Å; R473-F477 PolarHBondContact O-N 2.77Å; R473-E510 IonicContact CZ-OE2 3.82Å; R473-E510 IonicContact NH1-OE2 2.67Å; R473-E510 PolarHBondContact NH1-OE2 3.24Å; R473-E510 IonicContact NH2-OE1 2.71Å; R473-E510 IonicContact NH2-OE2 3.84Å; R473-E510 PolarHBondContact NH2-OE2 3.33Å; R473-R514 VanDerWaalsContact NH1-NE 3.16Å
474	L	87.2	Confident	86.6	Confident	10 Å²	10	71 Å²	71	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-68.5	-37.2	177.3	-160.5	67.1	0	0	0	111.6	Q470 M471 F477 V478 V503 V506 I507 L697	Q470-L474 VanDerWaalsContact O-CB 3.3Å; Q470-L474 WeakPolarHBondContact O-CB 3.45Å; Q470-L474 PolarHBondContact O-N 3.05Å; M471-L474 PolarHBondContact O-N 3.24Å; L474-F477 HydrophobicContact CD1-CD1 4.35Å; L474-F477 WeakPolarHBondContact O-CB 2.93Å; L474-F477 PolarHBondContact O-N 3.02Å; L474-V478 VanDerWaalsContact O-CG2 3.31Å; L474-V478 WeakPolarHBondContact O-CG2 3.22Å; L474-V478 PolarHBondContact O-N 2.94Å; L474-V503 HydrophobicContact CD1-CG1 4.21Å; L474-V503 HydrophobicContact CD1-CG2 4.37Å; L474-V503 HydrophobicContact CD2-CG1 4.11Å; L474-V503 HydrophobicContact CG-CG1 4.5Å; L474-V506 HydrophobicContact CD1-CG1 4.43Å; L474-I507 HydrophobicContact CD1-CD1 4.35Å; L474-I507 HydrophobicContact CD1-CG1 3.98Å; L474-I507 HydrophobicContact CD2-CD1 3.35Å; L474-I507 HydrophobicContact CD2-CG1 3.8Å; L474-I507 HydrophobicContact CG-CD1 4.5Å; L474-L697 HydrophobicContact CD2-CD2 3.36Å; L474-L697 HydrophobicContact CD2-CG 4.07Å; L474-L697 HydrophobicContact CG-CD2 4.13Å
475	D	86.9	Confident	86.2	Confident	71 Å²	71	70.6 Å²	70.6	38%	0.38	35%	0.349	S	S	.	.	H	α-helix	trans	-58.9	-47.2	172.1	-166.9	32	0	0	0	111.1	M471 I472 F477 V478 E479 C694	M471-D475 PolarHBondContact O-N 2.63Å; I472-D475 PolarHBondContact O-N 2.94Å; D475-F477 VanDerWaalsContact C-N 3.34Å; D475-F477 PolarHBondContact O-N 2.87Å; D475-V478 PolarHBondContact O-N 3.12Å; D475-E479 WeakPolarHBondContact O-CB 3.18Å; D475-E479 PolarHBondContact O-N 3.33Å; D475-C694 VanDerWaalsContact OD1-CB 3.31Å; D475-C694 WeakPolarHBondContact OD1-CB 3.21Å; D475-C694 PolarHBondContact OD1-SG 3.16Å
476	N	87.1	Confident	85.7	Confident	78 Å²	78	66 Å²	66	42%	0.417	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-38.9	174	-72.1	-50.7	0	0	0	113	I472 R473 H480	I472-N476 PolarHBondContact O-N 3.22Å; I472-N476 PolarHBondContact O-ND2 3Å; R473-N476 PolarHBondContact O-N 2.97Å; N476-H480 PolarHBondContact O-N 3.34Å; N476-H480 PolarHBondContact O-ND1 3.49Å
477	F	89.3	Confident	85	Confident	71 Å²	71	67.7 Å²	67.7	31%	0.311	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-46.6	177.4	172.8	-99.2	0	0	0	111.4	R473 L474 D475 H480 Y481 Q502 V503 V506	R473-F477 PolarHBondContact O-N 2.77Å; L474-F477 HydrophobicContact CD1-CD1 4.35Å; L474-F477 WeakPolarHBondContact O-CB 2.93Å; L474-F477 PolarHBondContact O-N 3.02Å; D475-F477 VanDerWaalsContact C-N 3.34Å; D475-F477 PolarHBondContact O-N 2.87Å; F477-H480 PolarHBondContact O-N 2.83Å; F477-Y481 PolarHBondContact O-N 2.65Å; F477-Y481 VanDerWaalsContact O-N 3.15Å; F477-Q502 HydrophobicContact CE1-CB 4.43Å; F477-Q502 HydrophobicContact CZ-CB 4.33Å; F477-V503 HydrophobicContact CD1-CG2 4.45Å; F477-V503 HydrophobicContact CE1-CG2 4.27Å; F477-V506 HydrophobicContact CE1-CG2 4.33Å; F477-V506 HydrophobicContact CE2-CG2 4.18Å; F477-V506 HydrophobicContact CZ-CG2 3.96Å
478	V	88.5	Confident	84.6	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-66.2	-39	178.2	174.1	0	0	0	0	110.8	L474 D475 H480 Y481 L499 V503 K690 F693	L474-V478 VanDerWaalsContact O-CG2 3.31Å; L474-V478 WeakPolarHBondContact O-CG2 3.22Å; L474-V478 PolarHBondContact O-N 2.94Å; D475-V478 PolarHBondContact O-N 3.12Å; V478-H480 VanDerWaalsContact C-N 3.3Å; V478-H480 PolarHBondContact O-N 2.93Å; V478-Y481 WeakPolarHBondContact O-CB 3.37Å; V478-Y481 PolarHBondContact O-N 3.09Å; V478-L499 HydrophobicContact CG1-CD2 4.29Å; V478-L499 HydrophobicContact CG2-CD1 4.4Å; V478-V503 HydrophobicContact CG2-CG2 4.1Å; V478-K690 HydrophobicContact CG1-CB 4.02Å; V478-K690 HydrophobicContact CG1-CG 3.94Å; V478-K690 VanDerWaalsContact O-CD 3.31Å; V478-K690 WeakPolarHBondContact O-CD 3.42Å; V478-K690 WeakPolarHBondContact O-CE 3.49Å; V478-K690 PolarHBondContact O-NZ 2.94Å; V478-F693 HydrophobicContact CG1-CD1 4.05Å; V478-F693 HydrophobicContact CG2-CD1 4.16Å; V478-F693 HydrophobicContact CG2-CE1 4Å
479	E	86	Confident	84.1	Confident	114 Å²	114	71.9 Å²	71.9	53%	0.533	37%	0.371	S	S	.	.	H	α-helix	trans	-57.4	-43.9	176.6	-169.7	174.8	-168.4	0	0	111.7	D475 K690	D475-E479 WeakPolarHBondContact O-CB 3.18Å; D475-E479 PolarHBondContact O-N 3.33Å; E479-K690 PolarHBondContact O-NZ 3.07Å
480	H	86.2	Confident	83.6	Confident	143 Å²	143	72.7 Å²	72.7	66%	0.662	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	6.8	-178.2	-65.4	81.9	0	0	0	114.5	N476 F477 V478 A482	N476-H480 PolarHBondContact O-N 3.34Å; N476-H480 PolarHBondContact O-ND1 3.49Å; F477-H480 PolarHBondContact O-N 2.83Å; V478-H480 VanDerWaalsContact C-N 3.3Å; V478-H480 PolarHBondContact O-N 2.93Å; H480-A482 PolarHBondContact O-N 3.07Å; H480-A482 VanDerWaalsContact O-N 3.16Å
481	Y	88	Confident	83.4	Confident	26 Å²	26	76.2 Å²	76.2	10%	0.102	40%	0.401	C	S	.	.			trans	-60	120	177.2	-171.6	-108	0	0	0	110.6	F477 V478 E483 Y495 E498 L499 Q502 K690	F477-Y481 PolarHBondContact O-N 2.65Å; F477-Y481 VanDerWaalsContact O-N 3.15Å; V478-Y481 WeakPolarHBondContact O-CB 3.37Å; V478-Y481 PolarHBondContact O-N 3.09Å; Y481-E483 HydrophobicContact CD1-CB 4.15Å; Y481-E483 HydrophobicContact CE1-CB 3.55Å; Y481-E483 HydrophobicContact CE1-CG 3.67Å; Y481-E483 HydrophobicContact CE2-CG 4.47Å; Y481-E483 WeakPolarHBondContact OH-CG 3.34Å; Y481-E483 PolarHBondContact OH-OE2 3.07Å; Y481-Y495 AromaticContact CD1-CE2 3.72Å; Y481-Y495 HydrophobicContact CD1-CE2 3.72Å; Y481-Y495 AromaticContact CD1-CZ 3.72Å; Y481-Y495 WeakPolarHBondContact CD1-OH 3.3Å; Y481-Y495 HydrophobicContact CE1-CD2 4.18Å; Y481-Y495 AromaticContact CE1-CE2 3.6Å; Y481-Y495 HydrophobicContact CE1-CE2 3.6Å; Y481-Y495 AromaticContact CE1-CZ 3.94Å; Y481-E498 WeakPolarHBondContact OH-CG 3.27Å; Y481-L499 HydrophobicContact CD1-CD1 3.97Å; Y481-L499 HydrophobicContact CD2-CD1 3.92Å; Y481-L499 HydrophobicContact CE1-CB 4.48Å; Y481-L499 HydrophobicContact CE1-CD1 4.23Å; Y481-L499 HydrophobicContact CE2-CD1 4.22Å; Y481-L499 HydrophobicContact CG-CD1 3.79Å; Y481-Q502 HydrophobicContact CE2-CG 4.21Å; Y481-K690 PolarHBondContact O-NZ 3.32Å
482	A	79.5	Confident	83.3	Confident	100 Å²	100	74.2 Å²	74.2	83%	0.826	39%	0.391	S	S	*	.			trans	-93.6	2.4	-160.5	0	0	0	0	0	115.1	H480	H480-A482 PolarHBondContact O-N 3.07Å; H480-A482 VanDerWaalsContact O-N 3.16Å
483	E	80.5	Confident	83.1	Confident	93 Å²	93	73.8 Å²	73.8	44%	0.435	39%	0.39	S	S	.	.	S	Bend	trans	-74.7	153.6	178.5	-67.3	-158.9	140.5	0	0	112.9	Y481 F485 Y495	Y481-E483 HydrophobicContact CD1-CB 4.15Å; Y481-E483 HydrophobicContact CE1-CB 3.55Å; Y481-E483 HydrophobicContact CE1-CG 3.67Å; Y481-E483 HydrophobicContact CE2-CG 4.47Å; Y481-E483 WeakPolarHBondContact OH-CG 3.34Å; Y481-E483 PolarHBondContact OH-OE2 3.07Å; E483-F485 PolarHBondContact O-N 2.89Å; E483-Y495 HydrophobicContact CB-CD2 4.16Å; E483-Y495 HydrophobicContact CB-CE2 3.96Å
484	K	78.8	Confident	83	Confident	180 Å²	180	72.4 Å²	72.4	78%	0.783	40%	0.397	S	S	*	.			trans	-71.5	113.1	-174	-172.8	-178.6	178.7	-176.4	0	111.4	T486	K484-T486 HydrophobicContact CG-CG2 4.37Å
485	F	82.3	Confident	83.1	Confident	20 Å²	20	72.4 Å²	72.4	9%	0.088	40%	0.397	C	S	.	.			trans	-74.2	130.5	173.7	-170.7	-99.1	0	0	0	111.9	E483 V487 M492 Y495 L575 K685 E686 F689	E483-F485 PolarHBondContact O-N 2.89Å; F485-V487 HydrophobicContact CE1-CG2 4.24Å; F485-M492 HydrophobicContact CE1-CE 4.2Å; F485-M492 HydrophobicContact CE2-CE 3.75Å; F485-M492 HydrophobicContact CE2-SD 3.79Å; F485-M492 HydrophobicContact CZ-CE 3.52Å; F485-M492 HydrophobicContact CZ-SD 4.17Å; F485-Y495 HydrophobicContact CD2-CD1 4.45Å; F485-Y495 HydrophobicContact CD2-CE1 4.1Å; F485-L575 HydrophobicContact CZ-CD1 4.21Å; F485-K685 HydrophobicContact CE1-CB 3.89Å; F485-K685 HydrophobicContact CZ-CB 4.36Å; F485-E686 HydrophobicContact CB-CB 4.08Å; F485-E686 HydrophobicContact CB-CG 3.74Å; F485-E686 HydrophobicContact CD1-CB 3.58Å; F485-E686 HydrophobicContact CD1-CG 4.15Å; F485-E686 HydrophobicContact CD2-CB 4.03Å; F485-E686 HydrophobicContact CD2-CG 3.81Å; F485-E686 HydrophobicContact CE1-CB 3.93Å; F485-E686 HydrophobicContact CE2-CB 4.34Å; F485-E686 HydrophobicContact CE2-CG 4.42Å; F485-E686 HydrophobicContact CG-CB 3.63Å; F485-E686 HydrophobicContact CG-CG 3.64Å; F485-E686 HydrophobicContact CZ-CB 4.28Å; F485-F689 HydrophobicContact CE2-CB 3.86Å; F485-F689 HydrophobicContact CE2-CD1 4.26Å; F485-F689 HydrophobicContact CE2-CD2 4.41Å; F485-F689 AromaticContact CE2-CG 3.92Å; F485-F689 HydrophobicContact CE2-CG 3.92Å; F485-F689 HydrophobicContact CZ-CB 4.04Å; F485-F689 HydrophobicContact CZ-CG 4.48Å
486	T	78	Confident	83.1	Confident	37 Å²	37	70.3 Å²	70.3	23%	0.227	38%	0.384	C	S	.	.			trans	-140.2	144	175.3	57.8	0	0	0	0	110.3	K484 D488 L491 M492	K484-T486 HydrophobicContact CG-CG2 4.37Å; T486-D488 VanDerWaalsContact C-N 3.27Å; T486-D488 PolarHBondContact O-N 3.12Å; T486-L491 VanDerWaalsContact OG1-CB 3.29Å; T486-L491 WeakPolarHBondContact OG1-CB 3.13Å; T486-M492 WeakPolarHBondContact O-CE 3.32Å
487	V	75.2	Confident	83.1	Confident	55 Å²	55	73.4 Å²	73.4	33%	0.333	39%	0.394	S	S	.	.			trans	-86.6	5.3	-173.9	-164	0	0	0	0	112.7	F485 D682 K685	F485-V487 HydrophobicContact CE1-CG2 4.24Å; V487-D682 WeakPolarHBondContact CG2-OD1 3.47Å; V487-K685 HydrophobicContact CG1-CD 4.2Å; V487-K685 HydrophobicContact CG2-CD 3.8Å
488	D	79.5	Confident	83.1	Confident	82 Å²	82	73.3 Å²	73.3	44%	0.439	40%	0.395	S	S	.	.			trans	-74.2	125.8	178.7	-179	31.6	0	0	0	110.7	T486 C490 L491 M492	T486-D488 VanDerWaalsContact C-N 3.27Å; T486-D488 PolarHBondContact O-N 3.12Å; D488-C490 VanDerWaalsContact C-N 3.26Å; D488-C490 PolarHBondContact O-N 3.23Å; D488-C490 VanDerWaalsContact O-N 3.11Å; D488-L491 HydrophobicContact CB-CB 4.38Å; D488-L491 HydrophobicContact CB-CD1 4.27Å; D488-L491 HydrophobicContact CB-CG 4.5Å; D488-L491 PolarHBondContact O-N 3.47Å; D488-L491 VanDerWaalsContact O-N 3.1Å; D488-M492 WeakPolarHBondContact O-CB 3.09Å; D488-M492 PolarHBondContact O-N 2.9Å
489	P	77.6	Confident	83.2	Confident	87 Å²	87	73.3 Å²	73.3	57%	0.565	40%	0.395	S	S	*	.	H	α-helix	trans	-54.6	-33.9	-173.3	-30.1	36	0	0	0	115.4	N493	P489-N493 PolarHBondContact O-N 3.32Å; P489-N493 PolarHBondContact O-ND2 3.46Å
490	C	78.4	Confident	83.4	Confident	103 Å²	103	68.5 Å²	68.5	70%	0.696	37%	0.373	S	S	*	.	H	α-helix	trans	-72	-43.3	178.3	-70.8	0	0	0	0	112.3	D488 A494	D488-C490 VanDerWaalsContact C-N 3.26Å; D488-C490 PolarHBondContact O-N 3.23Å; D488-C490 VanDerWaalsContact O-N 3.11Å; C490-A494 PolarHBondContact O-N 3.34Å
491	L	82.5	Confident	83.6	Confident	93 Å²	93	64.4 Å²	64.4	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-74.6	-30.4	179	-65.6	173.3	0	0	0	112.1	T486 D488 A494 Y495	T486-L491 VanDerWaalsContact OG1-CB 3.29Å; T486-L491 WeakPolarHBondContact OG1-CB 3.13Å; D488-L491 HydrophobicContact CB-CB 4.38Å; D488-L491 HydrophobicContact CB-CD1 4.27Å; D488-L491 HydrophobicContact CB-CG 4.5Å; D488-L491 PolarHBondContact O-N 3.47Å; D488-L491 VanDerWaalsContact O-N 3.1Å; L491-A494 PolarHBondContact O-N 2.94Å; L491-Y495 WeakPolarHBondContact O-CB 3.4Å; L491-Y495 PolarHBondContact O-N 2.88Å
492	M	82.6	Confident	83.7	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.02	37%	0.367	C	S	.	.	H	α-helix	trans	-62.1	-44.5	174.9	-170.8	63.6	72.8	0	0	112	F485 T486 D488 A494 Y495 K496 E573 L575 F689	F485-M492 HydrophobicContact CE1-CE 4.2Å; F485-M492 HydrophobicContact CE2-CE 3.75Å; F485-M492 HydrophobicContact CE2-SD 3.79Å; F485-M492 HydrophobicContact CZ-CE 3.52Å; F485-M492 HydrophobicContact CZ-SD 4.17Å; T486-M492 WeakPolarHBondContact O-CE 3.32Å; D488-M492 WeakPolarHBondContact O-CB 3.09Å; D488-M492 PolarHBondContact O-N 2.9Å; M492-A494 VanDerWaalsContact C-N 3.31Å; M492-A494 PolarHBondContact O-N 3.08Å; M492-Y495 PolarHBondContact O-N 2.93Å; M492-K496 WeakPolarHBondContact O-CB 3.22Å; M492-K496 PolarHBondContact O-N 3.31Å; M492-E573 HydrophobicContact CG-CG 4.46Å; M492-E573 WeakPolarHBondContact CG-OE1 3.22Å; M492-L575 HydrophobicContact CE-CD1 3.73Å; M492-F689 HydrophobicContact SD-CD2 4.15Å; M492-F689 HydrophobicContact SD-CE2 4.05Å
493	N	84.2	Confident	84.2	Confident	94 Å²	94	62 Å²	62	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-37.2	177.2	-79	-54.4	0	0	0	112.4	P489 K497	P489-N493 PolarHBondContact O-N 3.32Å; P489-N493 PolarHBondContact O-ND2 3.46Å; N493-K497 WeakPolarHBondContact O-CB 3.3Å; N493-K497 PolarHBondContact O-N 3.44Å
494	A	85	Confident	84.7	Confident	59 Å²	59	59.2 Å²	59.2	49%	0.488	32%	0.316	S	S	.	.	H	α-helix	trans	-66.5	-47.6	174.9	0	0	0	0	0	111.6	C490 L491 M492 K496 K497 E498	C490-A494 PolarHBondContact O-N 3.34Å; L491-A494 PolarHBondContact O-N 2.94Å; M492-A494 VanDerWaalsContact C-N 3.31Å; M492-A494 PolarHBondContact O-N 3.08Å; A494-K496 PolarHBondContact O-N 3.06Å; A494-K497 PolarHBondContact O-N 2.86Å; A494-E498 PolarHBondContact O-N 2.99Å
495	Y	88	Confident	85.2	Confident	11 Å²	11	54.4 Å²	54.4	4%	0.043	30%	0.304	C	S	.	.	H	α-helix	trans	-57.9	-46.3	175.6	177.7	-88.7	0	0	0	111.9	Y481 E483 F485 L491 M492 K497 E498 L499 F689 K690	Y481-Y495 AromaticContact CD1-CE2 3.72Å; Y481-Y495 HydrophobicContact CD1-CE2 3.72Å; Y481-Y495 AromaticContact CD1-CZ 3.72Å; Y481-Y495 WeakPolarHBondContact CD1-OH 3.3Å; Y481-Y495 HydrophobicContact CE1-CD2 4.18Å; Y481-Y495 AromaticContact CE1-CE2 3.6Å; Y481-Y495 HydrophobicContact CE1-CE2 3.6Å; Y481-Y495 AromaticContact CE1-CZ 3.94Å; E483-Y495 HydrophobicContact CB-CD2 4.16Å; E483-Y495 HydrophobicContact CB-CE2 3.96Å; F485-Y495 HydrophobicContact CD2-CD1 4.45Å; F485-Y495 HydrophobicContact CD2-CE1 4.1Å; L491-Y495 WeakPolarHBondContact O-CB 3.4Å; L491-Y495 PolarHBondContact O-N 2.88Å; M492-Y495 PolarHBondContact O-N 2.93Å; Y495-K497 PolarHBondContact O-N 3.21Å; Y495-E498 PolarHBondContact O-N 3.48Å; Y495-L499 HydrophobicContact CE1-CD2 4.32Å; Y495-L499 WeakPolarHBondContact O-CB 3.1Å; Y495-L499 PolarHBondContact O-N 3.34Å; Y495-F689 HydrophobicContact CD1-CE1 4.09Å; Y495-F689 HydrophobicContact CD1-CZ 4.34Å; Y495-F689 HydrophobicContact CE1-CD1 4.08Å; Y495-F689 AromaticContact CE1-CE1 3.69Å; Y495-F689 HydrophobicContact CE1-CE1 3.69Å; Y495-F689 HydrophobicContact CE1-CZ 4.39Å; Y495-K690 VanDerWaalsContact OH-CE 3.32Å; Y495-K690 WeakPolarHBondContact OH-CE 3.4Å
496	K	88.2	Confident	85.6	Confident	27 Å²	27	55 Å²	55	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-58.9	-46.9	176.1	176.8	-177	162.8	-172	0	111.6	M492 A494 L499 I500 F571 F689	M492-K496 WeakPolarHBondContact O-CB 3.22Å; M492-K496 PolarHBondContact O-N 3.31Å; A494-K496 PolarHBondContact O-N 3.06Å; K496-L499 PolarHBondContact O-N 3.27Å; K496-I500 HydrophobicContact CG-CD1 3.85Å; K496-I500 WeakPolarHBondContact O-CB 3.37Å; K496-I500 WeakPolarHBondContact O-CG1 3.15Å; K496-I500 PolarHBondContact O-N 3.01Å; K496-F571 HydrophobicContact CD-CD1 4.02Å; K496-F571 PolarHBondContact NZ-O 3.11Å; K496-F689 HydrophobicContact CB-CZ 4.23Å; K496-F689 HydrophobicContact CG-CZ 4.47Å
497	K	87.5	Confident	86.2	Confident	143 Å²	143	53.9 Å²	53.9	62%	0.622	30%	0.302	S	S	*	.	H	α-helix	trans	-64.3	-42.2	-178.6	-172.4	176.9	179.2	-179.2	0	111.8	N493 A494 Y495 I500 N501	N493-K497 WeakPolarHBondContact O-CB 3.3Å; N493-K497 PolarHBondContact O-N 3.44Å; A494-K497 PolarHBondContact O-N 2.86Å; Y495-K497 PolarHBondContact O-N 3.21Å; K497-I500 PolarHBondContact O-N 3.49Å; K497-N501 VanDerWaalsContact O-CG 3.32Å; K497-N501 PolarHBondContact O-N 3.39Å; K497-N501 VanDerWaalsContact O-N 3.1Å; K497-N501 PolarHBondContact O-ND2 3.03Å
498	E	88.5	Confident	86.9	Confident	69 Å²	69	53.3 Å²	53.3	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-44.8	177.7	-169.2	56.9	-149.4	0	0	111.3	Y481 A494 Y495 I500 N501 Q502	Y481-E498 WeakPolarHBondContact OH-CG 3.27Å; A494-E498 PolarHBondContact O-N 2.99Å; Y495-E498 PolarHBondContact O-N 3.48Å; E498-I500 VanDerWaalsContact C-N 3.31Å; E498-I500 PolarHBondContact O-N 2.72Å; E498-N501 PolarHBondContact O-N 3.37Å; E498-N501 VanDerWaalsContact O-N 3.12Å; E498-Q502 HydrophobicContact CG-CG 4.5Å; E498-Q502 WeakPolarHBondContact O-CG 3.36Å; E498-Q502 PolarHBondContact O-N 2.69Å; E498-Q502 PolarHBondContact OE1-NE2 3.12Å
499	L	90	Very high	87.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.7	-43.6	175.5	-177.7	64	0	0	0	112.1	V478 Y481 Y495 K496 N501 Q502 V503 F689 F693	V478-L499 HydrophobicContact CG1-CD2 4.29Å; V478-L499 HydrophobicContact CG2-CD1 4.4Å; Y481-L499 HydrophobicContact CD1-CD1 3.97Å; Y481-L499 HydrophobicContact CD2-CD1 3.92Å; Y481-L499 HydrophobicContact CE1-CB 4.48Å; Y481-L499 HydrophobicContact CE1-CD1 4.23Å; Y481-L499 HydrophobicContact CE2-CD1 4.22Å; Y481-L499 HydrophobicContact CG-CD1 3.79Å; Y495-L499 HydrophobicContact CE1-CD2 4.32Å; Y495-L499 WeakPolarHBondContact O-CB 3.1Å; Y495-L499 PolarHBondContact O-N 3.34Å; K496-L499 PolarHBondContact O-N 3.27Å; L499-N501 PolarHBondContact O-N 3.44Å; L499-Q502 PolarHBondContact O-N 3.26Å; L499-V503 HydrophobicContact CD1-CG2 4.32Å; L499-V503 HydrophobicContact CG-CG2 4.49Å; L499-V503 WeakPolarHBondContact O-CB 3.24Å; L499-V503 VanDerWaalsContact O-CG2 3.22Å; L499-V503 WeakPolarHBondContact O-CG2 3.35Å; L499-V503 PolarHBondContact O-N 3.46Å; L499-F689 HydrophobicContact CD2-CE1 3.99Å; L499-F693 HydrophobicContact CD2-CD1 3.97Å; L499-F693 HydrophobicContact CD2-CD2 4.2Å; L499-F693 HydrophobicContact CD2-CE1 3.9Å; L499-F693 HydrophobicContact CD2-CE2 4.13Å; L499-F693 HydrophobicContact CD2-CG 4.11Å; L499-F693 HydrophobicContact CD2-CZ 3.98Å; L499-F693 HydrophobicContact CG-CE1 4.08Å; L499-F693 HydrophobicContact CG-CE2 4.43Å; L499-F693 HydrophobicContact CG-CZ 3.96Å
500	I	91	Very high	87.9	Confident	13 Å²	13	51.2 Å²	51.2	7%	0.067	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-44.9	176.2	-71.4	169.9	0	0	0	111.2	K496 K497 E498 V503 D504 V565 L568 F693	K496-I500 HydrophobicContact CG-CD1 3.85Å; K496-I500 WeakPolarHBondContact O-CB 3.37Å; K496-I500 WeakPolarHBondContact O-CG1 3.15Å; K496-I500 PolarHBondContact O-N 3.01Å; K497-I500 PolarHBondContact O-N 3.49Å; E498-I500 VanDerWaalsContact C-N 3.31Å; E498-I500 PolarHBondContact O-N 2.72Å; I500-V503 PolarHBondContact O-N 3.41Å; I500-D504 WeakPolarHBondContact O-CB 3.48Å; I500-D504 PolarHBondContact O-N 3Å; I500-V565 HydrophobicContact CG2-CB 4.32Å; I500-V565 HydrophobicContact CG2-CG2 4.06Å; I500-L568 HydrophobicContact CB-CD1 4.43Å; I500-L568 HydrophobicContact CD1-CB 3.86Å; I500-L568 HydrophobicContact CD1-CD1 4.46Å; I500-L568 HydrophobicContact CG1-CB 4.11Å; I500-L568 HydrophobicContact CG1-CD1 3.78Å; I500-L568 HydrophobicContact CG2-CD1 4.2Å; I500-F693 HydrophobicContact CG1-CE2 3.8Å; I500-F693 HydrophobicContact CG1-CZ 4.17Å
501	N	90.1	Very high	88.4	Confident	57 Å²	57	46.5 Å²	46.5	31%	0.305	26%	0.256	S	S	.	.	H	α-helix	trans	-65.3	-41.3	179.5	-70	-22.3	0	0	0	112.2	K497 E498 L499 D504 C505	K497-N501 VanDerWaalsContact O-CG 3.32Å; K497-N501 PolarHBondContact O-N 3.39Å; K497-N501 VanDerWaalsContact O-N 3.1Å; K497-N501 PolarHBondContact O-ND2 3.03Å; E498-N501 PolarHBondContact O-N 3.37Å; E498-N501 VanDerWaalsContact O-N 3.12Å; L499-N501 PolarHBondContact O-N 3.44Å; N501-D504 PolarHBondContact O-N 3.29Å; N501-C505 PolarHBondContact O-N 2.88Å; N501-C505 PolarHBondContact O-SG 3.46Å
502	Q	90.5	Very high	88.7	Confident	74 Å²	74	42.7 Å²	42.7	35%	0.346	24%	0.236	S	C	.	.	H	α-helix	trans	-65.4	-43.1	177.6	-66.5	-64	-20.6	0	0	111.2	F477 Y481 E498 L499 C505 V506	F477-Q502 HydrophobicContact CE1-CB 4.43Å; F477-Q502 HydrophobicContact CZ-CB 4.33Å; Y481-Q502 HydrophobicContact CE2-CG 4.21Å; E498-Q502 HydrophobicContact CG-CG 4.5Å; E498-Q502 WeakPolarHBondContact O-CG 3.36Å; E498-Q502 PolarHBondContact O-N 2.69Å; E498-Q502 PolarHBondContact OE1-NE2 3.12Å; L499-Q502 PolarHBondContact O-N 3.26Å; Q502-C505 PolarHBondContact O-N 3.37Å; Q502-V506 WeakPolarHBondContact O-CG2 3.19Å; Q502-V506 PolarHBondContact O-N 2.85Å
503	V	90.6	Very high	88.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-43.4	174.8	163.9	0	0	0	0	111.7	L474 F477 V478 L499 I500 C505 V506 I507 F693 L697	L474-V503 HydrophobicContact CD1-CG1 4.21Å; L474-V503 HydrophobicContact CD1-CG2 4.37Å; L474-V503 HydrophobicContact CD2-CG1 4.11Å; L474-V503 HydrophobicContact CG-CG1 4.5Å; F477-V503 HydrophobicContact CD1-CG2 4.45Å; F477-V503 HydrophobicContact CE1-CG2 4.27Å; V478-V503 HydrophobicContact CG2-CG2 4.1Å; L499-V503 HydrophobicContact CD1-CG2 4.32Å; L499-V503 HydrophobicContact CG-CG2 4.49Å; L499-V503 WeakPolarHBondContact O-CB 3.24Å; L499-V503 VanDerWaalsContact O-CG2 3.22Å; L499-V503 WeakPolarHBondContact O-CG2 3.35Å; L499-V503 PolarHBondContact O-N 3.46Å; I500-V503 PolarHBondContact O-N 3.41Å; V503-C505 VanDerWaalsContact C-N 3.34Å; V503-C505 PolarHBondContact O-N 3.44Å; V503-V506 PolarHBondContact O-N 2.84Å; V503-I507 HydrophobicContact CG1-CD1 3.89Å; V503-I507 HydrophobicContact CG1-CG1 4.49Å; V503-I507 WeakPolarHBondContact O-CG1 3.41Å; V503-I507 PolarHBondContact O-N 3.23Å; V503-F693 HydrophobicContact CG2-CE1 4.05Å; V503-F693 HydrophobicContact CG2-CZ 4.26Å; V503-L697 HydrophobicContact CG1-CD1 4.4Å; V503-L697 HydrophobicContact CG1-CD2 3.72Å
504	D	90.6	Very high	89.1	Confident	35 Å²	35	48 Å²	48	19%	0.187	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-44.5	176.6	-166.9	90.8	0	0	0	111.4	I500 N501 N508 C564 V565	I500-D504 WeakPolarHBondContact O-CB 3.48Å; I500-D504 PolarHBondContact O-N 3Å; N501-D504 PolarHBondContact O-N 3.29Å; D504-N508 VanDerWaalsContact O-CB 3.31Å; D504-N508 WeakPolarHBondContact O-CB 3.44Å; D504-N508 PolarHBondContact O-N 3.43Å; D504-N508 VanDerWaalsContact O-N 3.09Å; D504-N508 PolarHBondContact O-ND2 3.31Å; D504-N508 PolarHBondContact OD2-ND2 3.34Å; D504-C564 HydrophobicContact CB-CB 3.88Å; D504-C564 WeakPolarHBondContact OD1-CA 3.48Å; D504-C564 VanDerWaalsContact OD1-CB 3.28Å; D504-C564 WeakPolarHBondContact OD1-CB 3.34Å; D504-C564 PolarHBondContact OD1-N 3.16Å; D504-V565 HydrophobicContact CB-CG2 4.27Å; D504-V565 PolarHBondContact OD1-N 3.43Å
505	C	90	Very high	89.3	Confident	79 Å²	79	45.3 Å²	45.3	53%	0.534	23%	0.232	S	C	.	.	H	α-helix	trans	-63.6	-46.5	176.9	-67.4	0	0	0	0	112.2	N501 Q502 V503 A509	N501-C505 PolarHBondContact O-N 2.88Å; N501-C505 PolarHBondContact O-SG 3.46Å; Q502-C505 PolarHBondContact O-N 3.37Å; V503-C505 VanDerWaalsContact C-N 3.34Å; V503-C505 PolarHBondContact O-N 3.44Å; C505-A509 WeakPolarHBondContact O-CB 3.43Å; C505-A509 PolarHBondContact O-N 2.92Å; C505-A509 VanDerWaalsContact O-N 3.07Å
506	V	90.4	Very high	89.3	Confident	34 Å²	34	45.1 Å²	45.1	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-46.1	-177.7	172.2	0	0	0	0	111.2	L474 F477 Q502 V503 A509 E510	L474-V506 HydrophobicContact CD1-CG1 4.43Å; F477-V506 HydrophobicContact CE1-CG2 4.33Å; F477-V506 HydrophobicContact CE2-CG2 4.18Å; F477-V506 HydrophobicContact CZ-CG2 3.96Å; Q502-V506 WeakPolarHBondContact O-CG2 3.19Å; Q502-V506 PolarHBondContact O-N 2.85Å; V503-V506 PolarHBondContact O-N 2.84Å; V506-A509 PolarHBondContact O-N 3.33Å; V506-E510 HydrophobicContact CG1-CG 4.37Å; V506-E510 WeakPolarHBondContact O-CB 3.37Å; V506-E510 WeakPolarHBondContact O-CG 3.46Å; V506-E510 PolarHBondContact O-N 3.49Å
507	I	89.9	Confident	89.3	Confident	13 Å²	13	47.5 Å²	47.5	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-47.6	179	-70.3	175.2	0	0	0	110.6	L474 V503 A509 L511 V562 C564	L474-I507 HydrophobicContact CD1-CD1 4.35Å; L474-I507 HydrophobicContact CD1-CG1 3.98Å; L474-I507 HydrophobicContact CD2-CD1 3.35Å; L474-I507 HydrophobicContact CD2-CG1 3.8Å; L474-I507 HydrophobicContact CG-CD1 4.5Å; V503-I507 HydrophobicContact CG1-CD1 3.89Å; V503-I507 HydrophobicContact CG1-CG1 4.49Å; V503-I507 WeakPolarHBondContact O-CG1 3.41Å; V503-I507 PolarHBondContact O-N 3.23Å; I507-A509 VanDerWaalsContact C-N 3.27Å; I507-A509 PolarHBondContact O-N 2.93Å; I507-L511 HydrophobicContact CG2-CB 4.27Å; I507-L511 HydrophobicContact CG2-CD2 3.97Å; I507-L511 WeakPolarHBondContact O-CB 3.34Å; I507-L511 PolarHBondContact O-N 2.85Å; I507-V562 HydrophobicContact CG2-CB 3.81Å; I507-V562 HydrophobicContact CG2-CG1 4.23Å; I507-V562 HydrophobicContact CG2-CG2 3.69Å; I507-C564 VanDerWaalsContact CD1-SG 3.54Å
508	N	90.1	Very high	89.3	Confident	43 Å²	43	48.5 Å²	48.5	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-71.6	-20.1	-175.5	-73.9	-48	0	0	0	113.6	D504 P512 T561 V562	D504-N508 VanDerWaalsContact O-CB 3.31Å; D504-N508 WeakPolarHBondContact O-CB 3.44Å; D504-N508 PolarHBondContact O-N 3.43Å; D504-N508 VanDerWaalsContact O-N 3.09Å; D504-N508 PolarHBondContact O-ND2 3.31Å; D504-N508 PolarHBondContact OD2-ND2 3.34Å; N508-P512 WeakPolarHBondContact O-CD 3.2Å; N508-P512 WeakPolarHBondContact O-CG 3.48Å; N508-T561 WeakPolarHBondContact OD1-CA 3.09Å; N508-V562 PolarHBondContact ND2-O 3.42Å; N508-V562 PolarHBondContact OD1-N 3.27Å; N508-V562 PolarHBondContact OD1-O 2.76Å
509	A	88.2	Confident	89.2	Confident	63 Å²	63	45.3 Å²	45.3	52%	0.521	24%	0.237	S	C	.	.	H	α-helix	trans	-83.7	-49.7	171.3	0	0	0	0	0	112.2	C505 V506 I507	C505-A509 WeakPolarHBondContact O-CB 3.43Å; C505-A509 PolarHBondContact O-N 2.92Å; C505-A509 VanDerWaalsContact O-N 3.07Å; V506-A509 PolarHBondContact O-N 3.33Å; I507-A509 VanDerWaalsContact C-N 3.27Å; I507-A509 PolarHBondContact O-N 2.93Å
510	E	89.1	Confident	89.1	Confident	62 Å²	62	48 Å²	48	29%	0.29	25%	0.251	S	S	.	.	H	α-helix	trans	-84.5	-34.4	-168.4	-63.3	-166.3	-179.4	0	0	114	R473 V506 R514	R473-E510 IonicContact CZ-OE2 3.82Å; R473-E510 IonicContact NH1-OE2 2.67Å; R473-E510 PolarHBondContact NH1-OE2 3.24Å; R473-E510 IonicContact NH2-OE1 2.71Å; R473-E510 IonicContact NH2-OE2 3.84Å; R473-E510 PolarHBondContact NH2-OE2 3.33Å; V506-E510 HydrophobicContact CG1-CG 4.37Å; V506-E510 WeakPolarHBondContact O-CB 3.37Å; V506-E510 WeakPolarHBondContact O-CG 3.46Å; V506-E510 PolarHBondContact O-N 3.49Å; E510-R514 VanDerWaalsContact O-CB 3.32Å; E510-R514 WeakPolarHBondContact O-CB 3.38Å; E510-R514 VanDerWaalsContact O-CG 3.29Å; E510-R514 WeakPolarHBondContact O-CG 3.37Å; E510-R514 PolarHBondContact O-N 3.42Å; E510-R514 VanDerWaalsContact O-N 3.1Å
511	L	88.6	Confident	88.8	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-71.8	-46.6	-172.2	-178.2	65.5	0	0	0	112.6	E466 F467 Q470 I507 R514 C515 F560 V562	E466-L511 HydrophobicContact CG-CD1 4.48Å; F467-L511 HydrophobicContact CD2-CD1 4.12Å; F467-L511 HydrophobicContact CD2-CD2 4.39Å; F467-L511 HydrophobicContact CE1-CD2 3.98Å; F467-L511 HydrophobicContact CE2-CD1 4.27Å; F467-L511 HydrophobicContact CE2-CD2 3.84Å; F467-L511 HydrophobicContact CE2-CG 4.43Å; F467-L511 HydrophobicContact CG-CD1 4.48Å; F467-L511 HydrophobicContact CZ-CD2 3.62Å; Q470-L511 HydrophobicContact CB-CD1 4.19Å; Q470-L511 HydrophobicContact CG-CB 4.25Å; Q470-L511 HydrophobicContact CG-CD1 3.43Å; Q470-L511 VanDerWaalsContact CG-CD1 3.43Å; Q470-L511 HydrophobicContact CG-CG 4.37Å; I507-L511 HydrophobicContact CG2-CB 4.27Å; I507-L511 HydrophobicContact CG2-CD2 3.97Å; I507-L511 WeakPolarHBondContact O-CB 3.34Å; I507-L511 PolarHBondContact O-N 2.85Å; L511-R514 PolarHBondContact O-N 3.09Å; L511-C515 WeakPolarHBondContact O-CB 3.44Å; L511-C515 PolarHBondContact O-N 2.82Å; L511-C515 PolarHBondContact O-SG 2.9Å; L511-F560 HydrophobicContact CD2-CE2 3.83Å; L511-F560 HydrophobicContact CD2-CZ 4.29Å; L511-F560 HydrophobicContact CG-CE2 3.94Å; L511-F560 HydrophobicContact CG-CZ 3.92Å; L511-V562 HydrophobicContact CD2-CG2 4Å
512	P	88.7	Confident	88.6	Confident	12 Å²	12	56.2 Å²	56.2	8%	0.078	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-42.9	175.5	-23.5	35.6	0	0	0	113.2	N508 R514 C515 S516 F560	N508-P512 WeakPolarHBondContact O-CD 3.2Å; N508-P512 WeakPolarHBondContact O-CG 3.48Å; P512-R514 PolarHBondContact O-N 2.66Å; P512-C515 PolarHBondContact O-N 3.23Å; P512-S516 VanDerWaalsContact O-CB 3.3Å; P512-S516 WeakPolarHBondContact O-CB 3.41Å; P512-S516 PolarHBondContact O-N 2.67Å; P512-S516 PolarHBondContact O-OG 3.02Å; P512-F560 HydrophobicContact CB-CE1 4.19Å; P512-F560 HydrophobicContact CB-CZ 4.21Å; P512-F560 HydrophobicContact CG-CE1 4.33Å; P512-F560 HydrophobicContact CG-CE2 4.09Å; P512-F560 HydrophobicContact CG-CZ 3.97Å
513	E	87.7	Confident	88.4	Confident	127 Å²	127	52.9 Å²	52.9	59%	0.593	26%	0.264	S	S	*	.	H	α-helix	trans	-62.3	-44.7	179.6	-171.5	-169.8	168.1	0	0	111.4	S516 S517	E513-S516 PolarHBondContact O-N 3.13Å; E513-S517 WeakPolarHBondContact O-CB 3.48Å; E513-S517 PolarHBondContact O-N 3.28Å; E513-S517 PolarHBondContact O-OG 3.09Å
514	R	87.8	Confident	88.2	Confident	84 Å²	84	56.1 Å²	56.1	32%	0.317	28%	0.281	S	S	.	.	H	α-helix	trans	-69.3	-43.2	179.3	-76	179.9	141.4	-134.2	5	112.8	E466 R473 E510 L511 P512 S516 S517 R518	E466-R514 HydrophobicContact CG-CB 3.83Å; E466-R514 VanDerWaalsContact OE1-CD 3.32Å; E466-R514 WeakPolarHBondContact OE1-CD 3.41Å; E466-R514 IonicContact OE1-CZ 2.73Å; E466-R514 IonicContact OE1-NE 3.34Å; E466-R514 IonicContact OE1-NH1 3.19Å; E466-R514 PolarHBondContact OE1-NH1 2.94Å; R473-R514 VanDerWaalsContact NH1-NE 3.16Å; E510-R514 VanDerWaalsContact O-CB 3.32Å; E510-R514 WeakPolarHBondContact O-CB 3.38Å; E510-R514 VanDerWaalsContact O-CG 3.29Å; E510-R514 WeakPolarHBondContact O-CG 3.37Å; E510-R514 PolarHBondContact O-N 3.42Å; E510-R514 VanDerWaalsContact O-N 3.1Å; L511-R514 PolarHBondContact O-N 3.09Å; P512-R514 PolarHBondContact O-N 2.66Å; R514-S516 VanDerWaalsContact C-N 3.28Å; R514-S516 PolarHBondContact O-N 3.05Å; R514-S517 WeakPolarHBondContact CA-OG 3.34Å; R514-S517 PolarHBondContact O-OG 2.98Å; R514-S517 VanDerWaalsContact O-OG 3.05Å; R514-R518 WeakPolarHBondContact O-CB 2.95Å; R514-R518 PolarHBondContact O-N 3.35Å
515	C	89.4	Confident	88	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-44.4	172.3	-73.7	0	0	0	0	110.9	I463 L511 P512 V519 F558 F560	I463-C515 HydrophobicContact CG1-CB 4.44Å; L511-C515 WeakPolarHBondContact O-CB 3.44Å; L511-C515 PolarHBondContact O-N 2.82Å; L511-C515 PolarHBondContact O-SG 2.9Å; P512-C515 PolarHBondContact O-N 3.23Å; C515-V519 WeakPolarHBondContact O-CB 3.35Å; C515-V519 VanDerWaalsContact O-CG2 3.3Å; C515-V519 WeakPolarHBondContact O-CG2 3.15Å; C515-V519 PolarHBondContact O-N 2.95Å; C515-F558 HydrophobicContact CB-CD2 3.85Å; C515-F558 HydrophobicContact CB-CE2 4.23Å; C515-F560 HydrophobicContact CB-CE1 4.46Å
516	S	89.5	Confident	87.9	Confident	7 Å²	7	54.1 Å²	54.1	5%	0.049	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-51.9	-178.1	-57.3	0	0	0	0	111.4	P512 E513 R514 R518 V519 L520 F558	P512-S516 VanDerWaalsContact O-CB 3.3Å; P512-S516 WeakPolarHBondContact O-CB 3.41Å; P512-S516 PolarHBondContact O-N 2.67Å; P512-S516 PolarHBondContact O-OG 3.02Å; E513-S516 PolarHBondContact O-N 3.13Å; R514-S516 VanDerWaalsContact C-N 3.28Å; R514-S516 PolarHBondContact O-N 3.05Å; S516-R518 VanDerWaalsContact C-N 3.28Å; S516-R518 PolarHBondContact O-N 3.2Å; S516-V519 PolarHBondContact O-N 3.16Å; S516-L520 WeakPolarHBondContact O-CB 3.41Å; S516-L520 PolarHBondContact O-N 2.84Å; S516-F558 WeakPolarHBondContact OG-CD2 3.47Å; S516-F558 PolarHBondContact OG-N 3.32Å
517	S	86.7	Confident	87.7	Confident	78 Å²	78	53.2 Å²	53.2	55%	0.545	26%	0.261	S	S	.	.	H	α-helix	trans	-61.3	-34.5	-179.6	59.4	0	0	0	0	113	E513 R514	E513-S517 WeakPolarHBondContact O-CB 3.48Å; E513-S517 PolarHBondContact O-N 3.28Å; E513-S517 PolarHBondContact O-OG 3.09Å; R514-S517 WeakPolarHBondContact CA-OG 3.34Å; R514-S517 PolarHBondContact O-OG 2.98Å; R514-S517 VanDerWaalsContact O-OG 3.05Å
518	R	87.3	Confident	87.5	Confident	164 Å²	164	59.6 Å²	59.6	62%	0.619	28%	0.284	S	S	*	.	H	α-helix	trans	-69.7	-40.6	179.8	-166	60.4	169.2	-172.2	-2.8	112.7	Q462 R514 S516	Q462-R518 PolarHBondContact OE1-O 3.38Å; R514-R518 WeakPolarHBondContact O-CB 2.95Å; R514-R518 PolarHBondContact O-N 3.35Å; S516-R518 VanDerWaalsContact C-N 3.28Å; S516-R518 PolarHBondContact O-N 3.2Å
519	V	87.9	Confident	87.3	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-86.5	-26.2	-173.8	175.3	0	0	0	0	112.2	V459 Q462 C515 S516 R521 Q522 I523 F558 V716	V459-V519 HydrophobicContact CG1-CG1 4.39Å; V459-V519 HydrophobicContact CG1-CG2 4.29Å; V459-V519 HydrophobicContact CG2-CG1 3.6Å; Q462-V519 HydrophobicContact CB-CG2 4.45Å; C515-V519 WeakPolarHBondContact O-CB 3.35Å; C515-V519 VanDerWaalsContact O-CG2 3.3Å; C515-V519 WeakPolarHBondContact O-CG2 3.15Å; C515-V519 PolarHBondContact O-N 2.95Å; S516-V519 PolarHBondContact O-N 3.16Å; V519-R521 VanDerWaalsContact C-N 3.26Å; V519-R521 PolarHBondContact O-N 3.37Å; V519-R521 VanDerWaalsContact O-N 3.09Å; V519-Q522 WeakPolarHBondContact O-CB 3.45Å; V519-Q522 PolarHBondContact O-N 3.48Å; V519-I523 HydrophobicContact CG1-CD1 3.66Å; V519-I523 HydrophobicContact CG1-CG1 3.86Å; V519-I523 PolarHBondContact O-N 3.19Å; V519-F558 HydrophobicContact CB-CE2 4.01Å; V519-F558 HydrophobicContact CB-CZ 4.34Å; V519-F558 HydrophobicContact CG1-CE2 4.34Å; V519-F558 HydrophobicContact CG1-CZ 4.19Å; V519-F558 HydrophobicContact CG2-CE2 4.03Å; V519-F558 HydrophobicContact CG2-CZ 4.35Å; V519-V716 HydrophobicContact CG1-CG2 4.43Å
520	L	86.2	Confident	87.3	Confident	56 Å²	56	61.1 Å²	61.1	29%	0.293	28%	0.277	S	S	.	.	H	α-helix	trans	-49.2	-43.6	-174.7	-178.8	63.5	0	0	0	113.4	S516 Q522 I523 L524 F556	S516-L520 WeakPolarHBondContact O-CB 3.41Å; S516-L520 PolarHBondContact O-N 2.84Å; L520-Q522 VanDerWaalsContact C-N 3.3Å; L520-Q522 PolarHBondContact O-N 2.84Å; L520-I523 PolarHBondContact O-N 2.74Å; L520-L524 HydrophobicContact CD1-CD1 4.04Å; L520-L524 HydrophobicContact CD1-CG 4.13Å; L520-L524 HydrophobicContact CG-CD1 3.91Å; L520-L524 HydrophobicContact CG-CG 4.4Å; L520-L524 VanDerWaalsContact O-CG 3.31Å; L520-L524 WeakPolarHBondContact O-CG 3.45Å; L520-L524 PolarHBondContact O-N 2.79Å; L520-F556 HydrophobicContact CD1-CB 4.26Å
521	R	85.4	Confident	87.1	Confident	201 Å²	201	58.4 Å²	58.4	76%	0.758	27%	0.265	S	S	*	.	H	α-helix	trans	-62.4	-37.5	-179.9	-175.4	177.2	175.3	128.4	-0.5	112.4	V519 T525	V519-R521 VanDerWaalsContact C-N 3.26Å; V519-R521 PolarHBondContact O-N 3.37Å; V519-R521 VanDerWaalsContact O-N 3.09Å; R521-T525 VanDerWaalsContact O-CB 3.31Å; R521-T525 WeakPolarHBondContact O-CB 3.41Å; R521-T525 PolarHBondContact O-N 2.71Å; R521-T525 VanDerWaalsContact O-N 3.1Å; R521-T525 PolarHBondContact O-OG1 2.78Å
522	Q	86.5	Confident	87	Confident	43 Å²	43	59.5 Å²	59.5	20%	0.201	28%	0.278	C	S	.	.	H	α-helix	trans	-73.3	-40.4	180	-70.9	-177.6	-42.3	0	0	111.7	L455 E458 Q462 V519 L520 T525 T526	L455-Q522 HydrophobicContact CD1-CB 3.73Å; E458-Q522 PolarHBondContact OE2-NE2 3.43Å; Q462-Q522 VanDerWaalsContact CD-OE1 3.25Å; V519-Q522 WeakPolarHBondContact O-CB 3.45Å; V519-Q522 PolarHBondContact O-N 3.48Å; L520-Q522 VanDerWaalsContact C-N 3.3Å; L520-Q522 PolarHBondContact O-N 2.84Å; Q522-T525 PolarHBondContact O-N 3.38Å; Q522-T526 WeakPolarHBondContact O-CB 2.99Å; Q522-T526 PolarHBondContact O-N 3.46Å; Q522-T526 PolarHBondContact O-OG1 3.15Å
523	I	86.4	Confident	86.8	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-57.8	-57.3	174	-64.9	170	0	0	0	109.4	L455 V519 L520 T525 T526 E527 F556 V716 I720	L455-I523 HydrophobicContact CD2-CG1 4.12Å; V519-I523 HydrophobicContact CG1-CD1 3.66Å; V519-I523 HydrophobicContact CG1-CG1 3.86Å; V519-I523 PolarHBondContact O-N 3.19Å; L520-I523 PolarHBondContact O-N 2.74Å; I523-T525 PolarHBondContact O-N 2.87Å; I523-T525 VanDerWaalsContact O-N 3.15Å; I523-T526 WeakPolarHBondContact O-CA 3.46Å; I523-T526 WeakPolarHBondContact O-CB 3.49Å; I523-T526 PolarHBondContact O-N 2.84Å; I523-E527 HydrophobicContact CG2-CG 4.22Å; I523-E527 WeakPolarHBondContact O-CG 3.42Å; I523-E527 PolarHBondContact O-N 2.94Å; I523-F556 HydrophobicContact CD1-CD1 3.34Å; I523-F556 HydrophobicContact CD1-CE1 3.42Å; I523-F556 VanDerWaalsContact CD1-CE1 3.42Å; I523-F556 HydrophobicContact CD1-CG 3.98Å; I523-F556 HydrophobicContact CD1-CZ 4.12Å; I523-V716 HydrophobicContact CD1-CG1 4.27Å; I523-V716 HydrophobicContact CD1-CG2 3.97Å; I523-V716 HydrophobicContact CG1-CG1 4.06Å; I523-I720 HydrophobicContact CG2-CD1 4.5Å
524	L	85.5	Confident	86.6	Confident	69 Å²	69	55.5 Å²	55.5	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-58.7	-33.8	-178.8	-68.1	173.7	0	0	0	113.2	L520 R528	L520-L524 HydrophobicContact CD1-CD1 4.04Å; L520-L524 HydrophobicContact CD1-CG 4.13Å; L520-L524 HydrophobicContact CG-CD1 3.91Å; L520-L524 HydrophobicContact CG-CG 4.4Å; L520-L524 VanDerWaalsContact O-CG 3.31Å; L520-L524 WeakPolarHBondContact O-CG 3.45Å; L520-L524 PolarHBondContact O-N 2.79Å; L524-R528 WeakPolarHBondContact O-CB 3.34Å; L524-R528 PolarHBondContact O-N 2.88Å; L524-R528 VanDerWaalsContact O-N 3.13Å
525	T	87.3	Confident	86.4	Confident	46 Å²	46	51.6 Å²	51.6	28%	0.282	25%	0.247	S	C	.	.	H	α-helix	trans	-72.1	-37	177.1	-58.4	0	0	0	0	111.5	R521 Q522 I523 K529	R521-T525 VanDerWaalsContact O-CB 3.31Å; R521-T525 WeakPolarHBondContact O-CB 3.41Å; R521-T525 PolarHBondContact O-N 2.71Å; R521-T525 VanDerWaalsContact O-N 3.1Å; R521-T525 PolarHBondContact O-OG1 2.78Å; Q522-T525 PolarHBondContact O-N 3.38Å; I523-T525 PolarHBondContact O-N 2.87Å; I523-T525 VanDerWaalsContact O-N 3.15Å; T525-K529 WeakPolarHBondContact O-CG 3.44Å; T525-K529 PolarHBondContact O-N 2.72Å
526	T	87.9	Confident	86	Confident	25 Å²	25	56.9 Å²	56.9	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-70.8	-44.1	177.8	-55.9	0	0	0	0	110.8	A451 L455 Q522 I523 R528 K529 L530 I720	A451-T526 HydrophobicContact CB-CG2 4.02Å; L455-T526 HydrophobicContact CD2-CG2 4.26Å; Q522-T526 WeakPolarHBondContact O-CB 2.99Å; Q522-T526 PolarHBondContact O-N 3.46Å; Q522-T526 PolarHBondContact O-OG1 3.15Å; I523-T526 WeakPolarHBondContact O-CA 3.46Å; I523-T526 WeakPolarHBondContact O-CB 3.49Å; I523-T526 PolarHBondContact O-N 2.84Å; T526-R528 PolarHBondContact O-N 3.12Å; T526-K529 WeakPolarHBondContact O-CB 3.04Å; T526-K529 PolarHBondContact O-N 3.42Å; T526-L530 HydrophobicContact CG2-CD1 4.49Å; T526-L530 WeakPolarHBondContact O-CG 3.36Å; T526-L530 PolarHBondContact O-N 2.68Å; T526-I720 HydrophobicContact CG2-CD1 4.3Å
527	E	86	Confident	85.6	Confident	15 Å²	15	58.3 Å²	58.3	7%	0.07	28%	0.281	C	S	.	.	H	α-helix	trans	-58.6	-48.1	175.4	-68.9	-176.7	144.7	0	0	112	I523 K529 L530 A531 R553 I720 L723	I523-E527 HydrophobicContact CG2-CG 4.22Å; I523-E527 WeakPolarHBondContact O-CG 3.42Å; I523-E527 PolarHBondContact O-N 2.94Å; E527-K529 VanDerWaalsContact C-N 3.28Å; E527-K529 PolarHBondContact O-N 2.91Å; E527-L530 PolarHBondContact O-N 3.39Å; E527-L530 VanDerWaalsContact O-N 3.15Å; E527-A531 PolarHBondContact O-N 2.71Å; E527-R553 IonicContact OE1-NH1 2.64Å; E527-I720 HydrophobicContact CG-CD1 3.76Å; E527-L723 HydrophobicContact CB-CD2 3.52Å; E527-L723 HydrophobicContact CG-CD2 3.51Å
528	R	85.1	Confident	85.2	Confident	148 Å²	148	55.6 Å²	55.6	56%	0.558	26%	0.26	S	S	*	.	H	α-helix	trans	-59.3	-37.5	175.4	-86.9	-174.5	-97.9	106.3	-0.6	113	L524 T526 G532	L524-R528 WeakPolarHBondContact O-CB 3.34Å; L524-R528 PolarHBondContact O-N 2.88Å; L524-R528 VanDerWaalsContact O-N 3.13Å; T526-R528 PolarHBondContact O-N 3.12Å; R528-G532 PolarHBondContact O-N 2.85Å
529	K	87	Confident	84.6	Confident	137 Å²	137	50.6 Å²	50.6	60%	0.596	25%	0.249	S	C	*	.	H	α-helix	trans	-65.4	-44	175.3	-76.9	176.1	179.5	-178.7	0	111.6	T525 T526 E527 G532 T533	T525-K529 WeakPolarHBondContact O-CG 3.44Å; T525-K529 PolarHBondContact O-N 2.72Å; T526-K529 WeakPolarHBondContact O-CB 3.04Å; T526-K529 PolarHBondContact O-N 3.42Å; E527-K529 VanDerWaalsContact C-N 3.28Å; E527-K529 PolarHBondContact O-N 2.91Å; K529-G532 PolarHBondContact O-N 3.49Å; K529-T533 PolarHBondContact O-N 3.08Å; K529-T533 PolarHBondContact O-OG1 3.06Å
530	L	87.4	Confident	83.8	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-44.3	177.8	-67.9	175.6	0	0	0	111.7	F444 I448 A451 T526 E527 G532 T533 I534 I720	F444-L530 HydrophobicContact CE2-CD2 4.28Å; F444-L530 WeakPolarHBondContact CE2-O 3.35Å; I448-L530 HydrophobicContact CG1-CD1 4.49Å; I448-L530 HydrophobicContact CG1-CD2 3.93Å; A451-L530 HydrophobicContact CB-CD2 4.24Å; T526-L530 HydrophobicContact CG2-CD1 4.49Å; T526-L530 WeakPolarHBondContact O-CG 3.36Å; T526-L530 PolarHBondContact O-N 2.68Å; E527-L530 PolarHBondContact O-N 3.39Å; E527-L530 VanDerWaalsContact O-N 3.15Å; L530-G532 VanDerWaalsContact C-N 3.34Å; L530-G532 PolarHBondContact O-N 3.46Å; L530-T533 PolarHBondContact O-N 2.93Å; L530-I534 PolarHBondContact O-N 3.04Å; L530-I534 VanDerWaalsContact O-N 3.13Å; L530-I720 HydrophobicContact CD1-CG2 3.75Å
531	A	85.3	Confident	83.1	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.033	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-41.1	174.7	0	0	0	0	0	112	E527 I534 A535 A550	E527-A531 PolarHBondContact O-N 2.71Å; A531-I534 WeakPolarHBondContact O-CG2 3.23Å; A531-I534 PolarHBondContact O-N 3.5Å; A531-A535 WeakPolarHBondContact O-CB 3.21Å; A531-A535 PolarHBondContact O-N 3.29Å; A531-A550 HydrophobicContact CB-CB 3.69Å
532	G	85.2	Confident	82.6	Confident	28 Å²	28	52.9 Å²	52.9	29%	0.289	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-42	174.7	0	0	0	0	0	112.9	R528 K529 L530 I534 A535 D536	R528-G532 PolarHBondContact O-N 2.85Å; K529-G532 PolarHBondContact O-N 3.49Å; L530-G532 VanDerWaalsContact C-N 3.34Å; L530-G532 PolarHBondContact O-N 3.46Å; G532-I534 VanDerWaalsContact C-N 3.34Å; G532-I534 PolarHBondContact O-N 2.88Å; G532-A535 PolarHBondContact O-N 3.12Å; G532-D536 PolarHBondContact O-N 2.67Å
533	T	85.1	Confident	82.3	Confident	55 Å²	55	55.3 Å²	55.3	34%	0.337	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-38.7	-179.6	-52.8	0	0	0	0	111.9	F444 K529 L530 F537	F444-T533 HydrophobicContact CD2-CG2 3.9Å; F444-T533 HydrophobicContact CE2-CG2 4.31Å; K529-T533 PolarHBondContact O-N 3.08Å; K529-T533 PolarHBondContact O-OG1 3.06Å; L530-T533 PolarHBondContact O-N 2.93Å; T533-F537 VanDerWaalsContact O-CD1 3.26Å; T533-F537 WeakPolarHBondContact O-CD1 3.37Å; T533-F537 WeakPolarHBondContact O-CE1 3.18Å
534	I	84.3	Confident	81.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-74.7	-37.5	177.4	-154.5	175.8	0	0	0	112.4	F444 L530 A531 G532 D536 F537 L538 A546 L727 A731	F444-I534 HydrophobicContact CD1-CD1 4.19Å; F444-I534 HydrophobicContact CD1-CG1 4.38Å; F444-I534 HydrophobicContact CE1-CB 4.13Å; F444-I534 HydrophobicContact CE1-CD1 3.64Å; F444-I534 HydrophobicContact CE1-CG1 4.05Å; F444-I534 HydrophobicContact CE2-CB 4.07Å; F444-I534 HydrophobicContact CZ-CB 3.8Å; F444-I534 HydrophobicContact CZ-CD1 4.13Å; F444-I534 HydrophobicContact CZ-CG1 4.25Å; L530-I534 PolarHBondContact O-N 3.04Å; L530-I534 VanDerWaalsContact O-N 3.13Å; A531-I534 WeakPolarHBondContact O-CG2 3.23Å; A531-I534 PolarHBondContact O-N 3.5Å; G532-I534 VanDerWaalsContact C-N 3.34Å; G532-I534 PolarHBondContact O-N 2.88Å; I534-D536 PolarHBondContact O-N 2.68Å; I534-F537 HydrophobicContact CB-CE1 4.25Å; I534-F537 HydrophobicContact CB-CZ 4.35Å; I534-F537 HydrophobicContact CD1-CZ 4.42Å; I534-F537 HydrophobicContact CG1-CE1 3.87Å; I534-F537 HydrophobicContact CG1-CE2 4.08Å; I534-F537 HydrophobicContact CG1-CZ 3.48Å; I534-F537 VanDerWaalsContact CG1-CZ 3.48Å; I534-F537 PolarHBondContact O-N 3.28Å; I534-L538 HydrophobicContact CD1-CD1 4.46Å; I534-L538 HydrophobicContact CG1-CD1 4Å; I534-L538 HydrophobicContact CG1-CG 4.48Å; I534-L538 HydrophobicContact CG2-CD1 4.41Å; I534-L538 WeakPolarHBondContact O-CG 3.29Å; I534-L538 PolarHBondContact O-N 2.73Å; I534-A546 HydrophobicContact CG2-CB 4.1Å; I534-L727 VanDerWaalsContact CD1-C 3.47Å; I534-L727 HydrophobicContact CD1-CB 3.7Å; I534-L727 WeakPolarHBondContact CD1-O 3.47Å; I534-L727 HydrophobicContact CG2-CB 4.37Å; I534-L727 HydrophobicContact CG2-CD1 4.19Å; I534-L727 HydrophobicContact CG2-CD2 4.06Å; I534-L727 HydrophobicContact CG2-CG 4.44Å; I534-A731 HydrophobicContact CD1-CB 3.74Å; I534-A731 HydrophobicContact CG1-CB 4.28Å
535	A	82.2	Confident	81.7	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-57.9	-32.5	176.6	0	0	0	0	0	113	A531 G532 F537 R543	A531-A535 WeakPolarHBondContact O-CB 3.21Å; A531-A535 PolarHBondContact O-N 3.29Å; G532-A535 PolarHBondContact O-N 3.12Å; A535-F537 VanDerWaalsContact C-N 3.31Å; A535-F537 PolarHBondContact O-N 2.93Å; A535-R543 HydrophobicContact CB-CG 3.67Å
536	D	81.6	Confident	81.3	Confident	113 Å²	113	59.7 Å²	59.7	60%	0.604	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.1	-176.4	-75.4	-20.5	0	0	0	114.6	G532 I534 R543	G532-D536 PolarHBondContact O-N 2.67Å; I534-D536 PolarHBondContact O-N 2.68Å; D536-R543 IonicContact OD1-CZ 2.68Å; D536-R543 IonicContact OD1-NH1 3.63Å; D536-R543 IonicContact OD1-NH2 3.76Å; D536-R543 PolarHBondContact OD1-NH2 3.26Å
537	F	80.5	Confident	80.8	Confident	36 Å²	36	62.3 Å²	62.3	16%	0.158	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-0.5	176	66.9	-99.7	0	0	0	114.5	M441 F444 T533 I534 A535 A731	M441-F537 HydrophobicContact CE-CE2 3.75Å; M441-F537 HydrophobicContact CE-CZ 3.89Å; F444-F537 HydrophobicContact CB-CE1 4.27Å; F444-F537 HydrophobicContact CB-CZ 4.33Å; F444-F537 HydrophobicContact CG-CE1 4.36Å; F444-F537 HydrophobicContact CG-CZ 4.42Å; T533-F537 VanDerWaalsContact O-CD1 3.26Å; T533-F537 WeakPolarHBondContact O-CD1 3.37Å; T533-F537 WeakPolarHBondContact O-CE1 3.18Å; I534-F537 HydrophobicContact CB-CE1 4.25Å; I534-F537 HydrophobicContact CB-CZ 4.35Å; I534-F537 HydrophobicContact CD1-CZ 4.42Å; I534-F537 HydrophobicContact CG1-CE1 3.87Å; I534-F537 HydrophobicContact CG1-CE2 4.08Å; I534-F537 HydrophobicContact CG1-CZ 3.48Å; I534-F537 VanDerWaalsContact CG1-CZ 3.48Å; I534-F537 PolarHBondContact O-N 3.28Å; A535-F537 VanDerWaalsContact C-N 3.31Å; A535-F537 PolarHBondContact O-N 2.93Å; F537-A731 HydrophobicContact CE2-CB 4.46Å
538	L	78.3	Confident	80.6	Confident	21 Å²	21	66.5 Å²	66.5	11%	0.11	32%	0.319	C	S	.	.	S	Bend	trans	-87.7	151.5	175.3	-74.9	170.8	0	0	0	112.1	I534 A542 A546 L730 A731 E734	I534-L538 HydrophobicContact CD1-CD1 4.46Å; I534-L538 HydrophobicContact CG1-CD1 4Å; I534-L538 HydrophobicContact CG1-CG 4.48Å; I534-L538 HydrophobicContact CG2-CD1 4.41Å; I534-L538 WeakPolarHBondContact O-CG 3.29Å; I534-L538 PolarHBondContact O-N 2.73Å; L538-A542 HydrophobicContact CB-CB 4.05Å; L538-A542 HydrophobicContact CD1-CB 4.37Å; L538-A542 HydrophobicContact CD2-CB 4.22Å; L538-A542 HydrophobicContact CG-CB 4.45Å; L538-A546 HydrophobicContact CD1-CB 4.22Å; L538-L730 HydrophobicContact CD1-CD2 4.33Å; L538-A731 HydrophobicContact CD2-CB 3.82Å; L538-E734 HydrophobicContact CD2-CB 4.27Å; L538-E734 HydrophobicContact CD2-CG 4.12Å
539	P	74.8	Confident	80.4	Confident	60 Å²	60	61.7 Å²	61.7	39%	0.39	30%	0.304	S	S	.	.			trans	-58	156.3	168.1	-20.2	31.6	0	0	0	112	E541 A542 R543	P539-E541 VanDerWaalsContact C-N 3.27Å; P539-E541 PolarHBondContact O-N 2.83Å; P539-E541 VanDerWaalsContact O-N 3.16Å; P539-A542 PolarHBondContact O-N 3.1Å; P539-R543 PolarHBondContact O-N 3.05Å
540	Q	72.7	Confident	79.8	Confident	160 Å²	160	56.3 Å²	56.3	75%	0.748	29%	0.285	S	S	*	.	H	α-helix	trans	-55.2	-39.2	-172.2	-169.4	170.8	-2.7	0	0	113.5	R543	Q540-R543 WeakPolarHBondContact O-CB 3.25Å; Q540-R543 PolarHBondContact O-N 3.13Å
541	E	69.8	Low	79.1	Confident	145 Å²	145	63 Å²	63	68%	0.678	32%	0.317	S	S	*	.	H	α-helix	trans	-68	-35	178.1	-63.9	-175.8	-178.4	0	0	113.3	P539	P539-E541 VanDerWaalsContact C-N 3.27Å; P539-E541 PolarHBondContact O-N 2.83Å; P539-E541 VanDerWaalsContact O-N 3.16Å
542	A	74.9	Confident	78.1	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-79.2	-25.3	176.8	0	0	0	0	0	112	L538 P539 K545 A546 E734	L538-A542 HydrophobicContact CB-CB 4.05Å; L538-A542 HydrophobicContact CD1-CB 4.37Å; L538-A542 HydrophobicContact CD2-CB 4.22Å; L538-A542 HydrophobicContact CG-CB 4.45Å; P539-A542 PolarHBondContact O-N 3.1Å; A542-K545 PolarHBondContact O-N 3.21Å; A542-A546 PolarHBondContact O-N 2.97Å; A542-E734 HydrophobicContact CB-CG 3.75Å
543	R	80	Confident	77.1	Confident	95 Å²	95	70.8 Å²	70.8	36%	0.358	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-48.9	175.1	-164.9	-176.2	-179.5	128.1	13.7	111.9	A535 D536 P539 Q540 K545 A546 E547	A535-R543 HydrophobicContact CB-CG 3.67Å; D536-R543 IonicContact OD1-CZ 2.68Å; D536-R543 IonicContact OD1-NH1 3.63Å; D536-R543 IonicContact OD1-NH2 3.76Å; D536-R543 PolarHBondContact OD1-NH2 3.26Å; P539-R543 PolarHBondContact O-N 3.05Å; Q540-R543 WeakPolarHBondContact O-CB 3.25Å; Q540-R543 PolarHBondContact O-N 3.13Å; R543-K545 VanDerWaalsContact C-N 3.3Å; R543-K545 PolarHBondContact O-N 3.03Å; R543-A546 PolarHBondContact O-N 3.42Å; R543-E547 IonicContact NE-OE1 3.2Å; R543-E547 PolarHBondContact NE-OE1 3.09Å; R543-E547 PolarHBondContact O-N 3.14Å
544	E	80	Confident	76	Confident	128 Å²	128	76.9 Å²	76.9	60%	0.598	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-40	179.7	-66.8	-179.5	179.1	0	0	111.4	E547 M548	E544-E547 PolarHBondContact O-N 3.45Å; E544-M548 WeakPolarHBondContact O-CB 3.24Å; E544-M548 VanDerWaalsContact O-CG 3.26Å; E544-M548 WeakPolarHBondContact O-CG 3.25Å; E544-M548 PolarHBondContact O-N 3.44Å
545	K	79.4	Confident	75.2	Confident	81 Å²	81	81.3 Å²	81.3	35%	0.352	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-42.7	175.3	-67.6	177.4	-174.5	166.8	0	112.3	A542 R543 E547 M548 I549 L730	A542-K545 PolarHBondContact O-N 3.21Å; R543-K545 VanDerWaalsContact C-N 3.3Å; R543-K545 PolarHBondContact O-N 3.03Å; K545-E547 VanDerWaalsContact C-N 3.35Å; K545-E547 PolarHBondContact O-N 2.92Å; K545-M548 PolarHBondContact O-N 3.21Å; K545-I549 WeakPolarHBondContact O-CG1 3.36Å; K545-I549 PolarHBondContact O-N 3.36Å; K545-L730 HydrophobicContact CB-CD1 4.34Å; K545-L730 HydrophobicContact CB-CD2 4.06Å; K545-L730 HydrophobicContact CD-CD1 4.17Å
546	A	78.9	Confident	75	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-62.5	-42	178.3	0	0	0	0	0	112	I534 L538 A542 R543 I549 A550 L727 L730	I534-A546 HydrophobicContact CG2-CB 4.1Å; L538-A546 HydrophobicContact CD1-CB 4.22Å; A542-A546 PolarHBondContact O-N 2.97Å; R543-A546 PolarHBondContact O-N 3.42Å; A546-I549 PolarHBondContact O-N 3.4Å; A546-A550 PolarHBondContact O-N 3.29Å; A546-L727 HydrophobicContact CB-CD2 4.24Å; A546-L730 HydrophobicContact CB-CD2 3.84Å
547	E	79.2	Confident	75	Confident	80 Å²	80	83.4 Å²	83.4	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-67.5	-37.2	176.8	-70.7	179	-170.1	0	0	112	R543 E544 K545 A550 Q551	R543-E547 IonicContact NE-OE1 3.2Å; R543-E547 PolarHBondContact NE-OE1 3.09Å; R543-E547 PolarHBondContact O-N 3.14Å; E544-E547 PolarHBondContact O-N 3.45Å; K545-E547 VanDerWaalsContact C-N 3.35Å; K545-E547 PolarHBondContact O-N 2.92Å; E547-A550 PolarHBondContact O-N 2.84Å; E547-Q551 WeakPolarHBondContact O-CG 3.32Å; E547-Q551 PolarHBondContact O-N 3.17Å
548	M	81.4	Confident	75.2	Confident	103 Å²	103	81.9 Å²	81.9	51%	0.507	41%	0.409	S	S	.	.	H	α-helix	trans	-63.6	-43.9	174.9	-77.1	-65.3	-63.2	0	0	112.7	E544 K545 A550 Q551 T552	E544-M548 WeakPolarHBondContact O-CB 3.24Å; E544-M548 VanDerWaalsContact O-CG 3.26Å; E544-M548 WeakPolarHBondContact O-CG 3.25Å; E544-M548 PolarHBondContact O-N 3.44Å; K545-M548 PolarHBondContact O-N 3.21Å; M548-A550 PolarHBondContact O-N 3.05Å; M548-Q551 PolarHBondContact O-N 2.95Å; M548-T552 HydrophobicContact CE-CG2 4.4Å; M548-T552 PolarHBondContact O-N 3.28Å; M548-T552 PolarHBondContact O-OG1 3.03Å; M548-T552 VanDerWaalsContact O-OG1 3.11Å
549	I	79.8	Confident	75.4	Confident	47 Å²	47	85.9 Å²	85.9	24%	0.241	43%	0.434	C	S	.	.	H	α-helix	trans	-57.3	-35.5	178.5	-69.9	165.8	0	0	0	111.3	K545 A546 Q551 L723 R726 L727 L730	K545-I549 WeakPolarHBondContact O-CG1 3.36Å; K545-I549 PolarHBondContact O-N 3.36Å; A546-I549 PolarHBondContact O-N 3.4Å; I549-Q551 VanDerWaalsContact C-N 3.34Å; I549-L723 HydrophobicContact CG2-CD1 3.91Å; I549-R726 HydrophobicContact CG2-CB 4.31Å; I549-L727 HydrophobicContact CG2-CD2 4.35Å; I549-L730 HydrophobicContact CD1-CD2 4.27Å
550	A	74	Confident	76	Confident	24 Å²	24	84.2 Å²	84.2	20%	0.198	42%	0.421	C	S	.	.	H	α-helix	trans	-75.1	-18.4	179	0	0	0	0	0	114	A531 A546 E547 M548	A531-A550 HydrophobicContact CB-CB 3.69Å; A546-A550 PolarHBondContact O-N 3.29Å; E547-A550 PolarHBondContact O-N 2.84Å; M548-A550 PolarHBondContact O-N 3.05Å
551	Q	74	Confident	76.6	Confident	143 Å²	143	81.9 Å²	81.9	67%	0.668	42%	0.418	S	S	*	.	H	α-helix	trans	-95.8	-28.6	-175	-70	178.4	25.1	0	0	113.9	E547 M548 I549 R553	E547-Q551 WeakPolarHBondContact O-CG 3.32Å; E547-Q551 PolarHBondContact O-N 3.17Å; M548-Q551 PolarHBondContact O-N 2.95Å; I549-Q551 VanDerWaalsContact C-N 3.34Å; Q551-R553 PolarHBondContact O-N 3.13Å
552	T	63.7	Low	77.4	Confident	109 Å²	109	75 Å²	75	67%	0.669	39%	0.386	S	S	*	.	S	Bend	trans	-89.3	28	-168.1	41.7	0	0	0	0	115.8	M548	M548-T552 HydrophobicContact CE-CG2 4.4Å; M548-T552 PolarHBondContact O-N 3.28Å; M548-T552 PolarHBondContact O-OG1 3.03Å; M548-T552 VanDerWaalsContact O-OG1 3.11Å
553	R	63.8	Low	77.9	Confident	85 Å²	85	77.1 Å²	77.1	32%	0.321	40%	0.399	S	S	.	.			trans	-104.4	145.7	-171.8	-140.1	-179.9	177.2	-155.1	-9.4	114.7	E527 Q551 E719 E722	E527-R553 IonicContact OE1-NH1 2.64Å; Q551-R553 PolarHBondContact O-N 3.13Å; R553-E719 IonicContact CZ-OE2 2.76Å; R553-E719 IonicContact NH1-OE2 3.66Å; R553-E719 PolarHBondContact NH1-OE2 2.88Å; R553-E719 IonicContact NH2-OE2 3.83Å; R553-E719 PolarHBondContact NH2-OE2 3.22Å; R553-E722 IonicContact NH2-OE1 2.62Å; R553-E722 IonicContact NH2-OE2 2.83Å; R553-E722 PolarHBondContact NH2-OE2 3.48Å
554	E	62.1	Low	78.1	Confident	184 Å²	184	72.6 Å²	72.6	86%	0.86	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-63.7	153.4	174.8	-70.4	-177.9	162.8	0	0	111.9	F556	E554-F556 PolarHBondContact O-N 2.85Å
555	A	67	Low	78.4	Confident	93 Å²	93	69.9 Å²	69.9	77%	0.769	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-65.2	124.3	-177.1	0	0	0	0	0	111.1	E557	A555-E557 PolarHBondContact O-N 3.11Å
556	F	78.2	Confident	78.7	Confident	30 Å²	30	73.3 Å²	73.3	13%	0.132	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-68.3	127.5	177.7	174	-100	0	0	0	111.5	L520 I523 E554 F558 Q715 V716 E719	L520-F556 HydrophobicContact CD1-CB 4.26Å; I523-F556 HydrophobicContact CD1-CD1 3.34Å; I523-F556 HydrophobicContact CD1-CE1 3.42Å; I523-F556 VanDerWaalsContact CD1-CE1 3.42Å; I523-F556 HydrophobicContact CD1-CG 3.98Å; I523-F556 HydrophobicContact CD1-CZ 4.12Å; E554-F556 PolarHBondContact O-N 2.85Å; F556-F558 AromaticContact CE1-CD1 3.95Å; F556-F558 HydrophobicContact CE1-CD1 3.95Å; F556-F558 HydrophobicContact CE1-CD2 4.05Å; F556-F558 AromaticContact CE1-CE1 3.7Å; F556-F558 HydrophobicContact CE1-CE1 3.7Å; F556-F558 AromaticContact CE1-CE2 3.81Å; F556-F558 HydrophobicContact CE1-CE2 3.81Å; F556-F558 HydrophobicContact CE1-CG 4.11Å; F556-F558 AromaticContact CE1-CZ 3.62Å; F556-F558 HydrophobicContact CE1-CZ 3.62Å; F556-F558 AromaticContact CZ-CD1 3.69Å; F556-F558 HydrophobicContact CZ-CD1 3.69Å; F556-F558 AromaticContact CZ-CE1 3.51Å; F556-F558 HydrophobicContact CZ-CE1 3.51Å; F556-F558 HydrophobicContact CZ-CE2 4.46Å; F556-F558 HydrophobicContact CZ-CG 4.24Å; F556-F558 AromaticContact CZ-CZ 3.93Å; F556-F558 HydrophobicContact CZ-CZ 3.93Å; F556-Q715 HydrophobicContact CZ-CB 4.49Å; F556-V716 HydrophobicContact CE1-CG2 4.25Å; F556-V716 HydrophobicContact CZ-CG2 3.96Å; F556-E719 HydrophobicContact CD2-CG 3.52Å; F556-E719 HydrophobicContact CE2-CG 3.39Å; F556-E719 HydrophobicContact CZ-CG 4.47Å
557	E	82.1	Confident	78.9	Confident	128 Å²	128	75 Å²	75	60%	0.598	40%	0.4	S	S	*	.			trans	-134.3	132	175.6	-167	173.9	-171.8	0	0	110.6	A555	A555-E557 PolarHBondContact O-N 3.11Å
558	F	84.8	Confident	79.2	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.018	38%	0.382	C	S	.	.			trans	-69.6	136.4	177	-75.6	-67	0	0	0	111.2	V459 I463 C515 S516 V519 F556 F560 C712 Q715 V716	V459-F558 HydrophobicContact CG1-CZ 4.09Å; I463-F558 HydrophobicContact CD1-CE2 4.3Å; I463-F558 HydrophobicContact CD1-CZ 4.04Å; C515-F558 HydrophobicContact CB-CD2 3.85Å; C515-F558 HydrophobicContact CB-CE2 4.23Å; S516-F558 WeakPolarHBondContact OG-CD2 3.47Å; S516-F558 PolarHBondContact OG-N 3.32Å; V519-F558 HydrophobicContact CB-CE2 4.01Å; V519-F558 HydrophobicContact CB-CZ 4.34Å; V519-F558 HydrophobicContact CG1-CE2 4.34Å; V519-F558 HydrophobicContact CG1-CZ 4.19Å; V519-F558 HydrophobicContact CG2-CE2 4.03Å; V519-F558 HydrophobicContact CG2-CZ 4.35Å; F556-F558 AromaticContact CE1-CD1 3.95Å; F556-F558 HydrophobicContact CE1-CD1 3.95Å; F556-F558 HydrophobicContact CE1-CD2 4.05Å; F556-F558 AromaticContact CE1-CE1 3.7Å; F556-F558 HydrophobicContact CE1-CE1 3.7Å; F556-F558 AromaticContact CE1-CE2 3.81Å; F556-F558 HydrophobicContact CE1-CE2 3.81Å; F556-F558 HydrophobicContact CE1-CG 4.11Å; F556-F558 AromaticContact CE1-CZ 3.62Å; F556-F558 HydrophobicContact CE1-CZ 3.62Å; F556-F558 AromaticContact CZ-CD1 3.69Å; F556-F558 HydrophobicContact CZ-CD1 3.69Å; F556-F558 AromaticContact CZ-CE1 3.51Å; F556-F558 HydrophobicContact CZ-CE1 3.51Å; F556-F558 HydrophobicContact CZ-CE2 4.46Å; F556-F558 HydrophobicContact CZ-CG 4.24Å; F556-F558 AromaticContact CZ-CZ 3.93Å; F556-F558 HydrophobicContact CZ-CZ 3.93Å; F558-F560 HydrophobicContact CB-CD1 3.94Å; F558-F560 HydrophobicContact CB-CE1 3.82Å; F558-F560 HydrophobicContact CG-CE1 4.48Å; F558-C712 HydrophobicContact CD1-CB 3.82Å; F558-C712 HydrophobicContact CE1-CB 3.48Å; F558-C712 VanDerWaalsContact CE1-CB 3.48Å; F558-C712 HydrophobicContact CZ-CB 4.09Å; F558-Q715 HydrophobicContact CD1-CB 4.36Å; F558-Q715 HydrophobicContact CE1-CB 4.43Å; F558-V716 HydrophobicContact CE1-CG2 3.69Å; F558-V716 HydrophobicContact CZ-CG2 3.66Å
559	T	82.8	Confident	79.3	Confident	105 Å²	105	72.6 Å²	72.6	64%	0.644	39%	0.392	S	S	*	.			trans	-113.9	98.4	176.5	43.6	0	0	0	0	110.3	Q715	T559-Q715 VanDerWaalsContact N-OE1 3.09Å; T559-Q715 PolarHBondContact O-NE2 2.62Å; T559-Q715 PolarHBondContact OG1-NE2 3.07Å
560	F	87.1	Confident	79.6	Confident	25 Å²	25	74.4 Å²	74.4	11%	0.11	40%	0.402	C	S	.	.			trans	-149.5	158.1	170.7	64.2	-91.8	0	0	0	110.7	L511 P512 C515 F558 V562 I708	L511-F560 HydrophobicContact CD2-CE2 3.83Å; L511-F560 HydrophobicContact CD2-CZ 4.29Å; L511-F560 HydrophobicContact CG-CE2 3.94Å; L511-F560 HydrophobicContact CG-CZ 3.92Å; P512-F560 HydrophobicContact CB-CE1 4.19Å; P512-F560 HydrophobicContact CB-CZ 4.21Å; P512-F560 HydrophobicContact CG-CE1 4.33Å; P512-F560 HydrophobicContact CG-CE2 4.09Å; P512-F560 HydrophobicContact CG-CZ 3.97Å; C515-F560 HydrophobicContact CB-CE1 4.46Å; F558-F560 HydrophobicContact CB-CD1 3.94Å; F558-F560 HydrophobicContact CB-CE1 3.82Å; F558-F560 HydrophobicContact CG-CE1 4.48Å; F560-V562 HydrophobicContact CE2-CG2 4.44Å; F560-I708 HydrophobicContact CB-CG2 4.48Å; F560-I708 HydrophobicContact CD1-CG2 4.13Å; F560-I708 HydrophobicContact CD2-CD1 4.16Å; F560-I708 HydrophobicContact CD2-CG1 4.39Å; F560-I708 HydrophobicContact CD2-CG2 3.6Å; F560-I708 HydrophobicContact CE1-CG2 4.27Å; F560-I708 HydrophobicContact CE2-CG2 3.75Å; F560-I708 HydrophobicContact CG-CG2 3.81Å; F560-I708 HydrophobicContact CZ-CG2 4.09Å
561	T	85.5	Confident	80.3	Confident	111 Å²	111	73.7 Å²	73.7	68%	0.681	40%	0.395	S	S	*	.			trans	-130.3	136.5	178.8	55.6	0	0	0	0	110.3	N508 P563	N508-T561 WeakPolarHBondContact OD1-CA 3.09Å; T561-P563 WeakPolarHBondContact O-CD 3.42Å
562	V	86.1	Confident	80.7	Confident	1 Å²	1	75 Å²	75	1%	0.006	40%	0.401	C	S	.	.			trans	-97.5	109.3	172.7	-173.7	0	0	0	0	107.9	I507 N508 L511 F560 C564 L567 V701 L704 I708	I507-V562 HydrophobicContact CG2-CB 3.81Å; I507-V562 HydrophobicContact CG2-CG1 4.23Å; I507-V562 HydrophobicContact CG2-CG2 3.69Å; N508-V562 PolarHBondContact ND2-O 3.42Å; N508-V562 PolarHBondContact OD1-N 3.27Å; N508-V562 PolarHBondContact OD1-O 2.76Å; L511-V562 HydrophobicContact CD2-CG2 4Å; F560-V562 HydrophobicContact CE2-CG2 4.44Å; V562-C564 VanDerWaalsContact C-N 3.29Å; V562-C564 PolarHBondContact O-N 3.16Å; V562-L567 HydrophobicContact CG1-CD1 4.04Å; V562-V701 HydrophobicContact CG1-CG2 4.49Å; V562-L704 HydrophobicContact CG1-CD2 4.19Å; V562-I708 HydrophobicContact CG2-CD1 3.76Å
563	P	86.5	Confident	81.6	Confident	44 Å²	44	72.9 Å²	72.9	29%	0.286	38%	0.383	S	S	.	.			trans	-82	70.8	-176.8	33.4	-35.4	0	0	0	111.1	T561 V565 Q566 L567	T561-P563 WeakPolarHBondContact O-CD 3.42Å; P563-V565 PolarHBondContact O-N 3.49Å; P563-Q566 HydrophobicContact CB-CB 4.35Å; P563-Q566 HydrophobicContact CB-CG 4.42Å; P563-Q566 PolarHBondContact O-N 3.38Å; P563-Q566 VanDerWaalsContact O-N 3.08Å; P563-L567 HydrophobicContact CG-CD1 4.18Å; P563-L567 WeakPolarHBondContact O-CD1 3.33Å; P563-L567 WeakPolarHBondContact O-CG 3.34Å; P563-L567 PolarHBondContact O-N 3.45Å
564	C	84	Confident	82.5	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-59	-34.4	-175.7	-67.6	0	0	0	0	112.2	D504 I507 V562 Q566 L567 L568	D504-C564 HydrophobicContact CB-CB 3.88Å; D504-C564 WeakPolarHBondContact OD1-CA 3.48Å; D504-C564 VanDerWaalsContact OD1-CB 3.28Å; D504-C564 WeakPolarHBondContact OD1-CB 3.34Å; D504-C564 PolarHBondContact OD1-N 3.16Å; I507-C564 VanDerWaalsContact CD1-SG 3.54Å; V562-C564 VanDerWaalsContact C-N 3.29Å; V562-C564 PolarHBondContact O-N 3.16Å; C564-Q566 VanDerWaalsContact C-N 3.3Å; C564-Q566 PolarHBondContact O-N 3.46Å; C564-L567 PolarHBondContact O-N 2.91Å; C564-L568 HydrophobicContact CB-CD1 4.35Å; C564-L568 WeakPolarHBondContact O-CB 3.44Å; C564-L568 VanDerWaalsContact O-CG 3.31Å; C564-L568 WeakPolarHBondContact O-CG 3.47Å; C564-L568 PolarHBondContact O-N 3.37Å
565	V	85.6	Confident	83.4	Confident	70 Å²	70	63.8 Å²	63.8	42%	0.424	35%	0.347	S	S	.	.	H	α-helix	trans	-58.2	-41.3	176.3	-177.3	0	0	0	0	112.2	I500 D504 P563	I500-V565 HydrophobicContact CG2-CB 4.32Å; I500-V565 HydrophobicContact CG2-CG2 4.06Å; D504-V565 HydrophobicContact CB-CG2 4.27Å; D504-V565 PolarHBondContact OD1-N 3.43Å; P563-V565 PolarHBondContact O-N 3.49Å
566	Q	85.5	Confident	84.1	Confident	154 Å²	154	65.1 Å²	65.1	72%	0.72	34%	0.341	S	S	*	.	H	α-helix	trans	-79	-39.2	179.9	-63.1	176.9	3.2	0	0	111.2	P563 C564 L568	P563-Q566 HydrophobicContact CB-CB 4.35Å; P563-Q566 HydrophobicContact CB-CG 4.42Å; P563-Q566 PolarHBondContact O-N 3.38Å; P563-Q566 VanDerWaalsContact O-N 3.08Å; C564-Q566 VanDerWaalsContact C-N 3.3Å; C564-Q566 PolarHBondContact O-N 3.46Å; Q566-L568 VanDerWaalsContact C-N 3.3Å; Q566-L568 PolarHBondContact O-N 2.99Å
567	L	83.7	Confident	84.2	Confident	34 Å²	34	65.3 Å²	65.3	18%	0.178	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-31.7	-178.8	-76.7	154.8	0	0	0	113.3	V562 P563 C564 K700 L704	V562-L567 HydrophobicContact CG1-CD1 4.04Å; P563-L567 HydrophobicContact CG-CD1 4.18Å; P563-L567 WeakPolarHBondContact O-CD1 3.33Å; P563-L567 WeakPolarHBondContact O-CG 3.34Å; P563-L567 PolarHBondContact O-N 3.45Å; C564-L567 PolarHBondContact O-N 2.91Å; L567-K700 HydrophobicContact CB-CB 4.38Å; L567-K700 HydrophobicContact CD2-CB 4.13Å; L567-L704 HydrophobicContact CD1-CD2 4.05Å
568	L	86	Confident	83.9	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	5.2	-174.3	-61.9	170.4	0	0	0	113.8	I500 C564 Q566 D570 F571 F693 L697	I500-L568 HydrophobicContact CB-CD1 4.43Å; I500-L568 HydrophobicContact CD1-CB 3.86Å; I500-L568 HydrophobicContact CD1-CD1 4.46Å; I500-L568 HydrophobicContact CG1-CB 4.11Å; I500-L568 HydrophobicContact CG1-CD1 3.78Å; I500-L568 HydrophobicContact CG2-CD1 4.2Å; C564-L568 HydrophobicContact CB-CD1 4.35Å; C564-L568 WeakPolarHBondContact O-CB 3.44Å; C564-L568 VanDerWaalsContact O-CG 3.31Å; C564-L568 WeakPolarHBondContact O-CG 3.47Å; C564-L568 PolarHBondContact O-N 3.37Å; Q566-L568 VanDerWaalsContact C-N 3.3Å; Q566-L568 PolarHBondContact O-N 2.99Å; L568-D570 PolarHBondContact O-N 3.2Å; L568-F571 VanDerWaalsContact O-CB 3.28Å; L568-F571 WeakPolarHBondContact O-CB 3.39Å; L568-F571 PolarHBondContact O-N 3.38Å; L568-F571 VanDerWaalsContact O-N 3.15Å; L568-F693 HydrophobicContact CD1-CE2 3.95Å; L568-F693 HydrophobicContact CD1-CZ 3.78Å; L568-L697 HydrophobicContact CD1-CD1 4.03Å; L568-L697 HydrophobicContact CD2-CB 4.05Å; L568-L697 HydrophobicContact CD2-CD1 4.01Å; L568-L697 HydrophobicContact CG-CD1 4.32Å
569	N	83.3	Confident	83.7	Confident	134 Å²	134	65.7 Å²	65.7	72%	0.717	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-30.3	-177.9	-165.6	26.6	0	0	0	112.4
570	D	86.7	Confident	83.5	Confident	85 Å²	85	63.3 Å²	63.3	46%	0.455	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.7	178.8	68.8	-22.4	0	0	0	114.3	L568 Q572 H696 K700	L568-D570 PolarHBondContact O-N 3.2Å; D570-Q572 PolarHBondContact O-N 3.3Å; D570-H696 IonicContact OD1-CE1 3Å; D570-H696 PolarHBondContact OD1-CE1 3.34Å; D570-H696 IonicContact OD1-NE2 3.65Å; D570-H696 PolarHBondContact OD1-NE2 3.48Å; D570-H696 IonicContact OD2-CE1 2.78Å; D570-H696 IonicContact OD2-NE2 3.84Å; D570-K700 IonicContact OD1-NZ 3.6Å; D570-K700 WeakPolarHBondContact OD2-CE 3.41Å; D570-K700 IonicContact OD2-NZ 2.88Å; D570-K700 PolarHBondContact OD2-NZ 2.9Å
571	F	86.9	Confident	82.8	Confident	9 Å²	9	65.7 Å²	65.7	4%	0.039	34%	0.339	C	S	.	.			trans	-62	128.9	179.5	179.5	-113.6	0	0	0	110.6	K496 L568 F689 Q692 F693 H696	K496-F571 HydrophobicContact CD-CD1 4.02Å; K496-F571 PolarHBondContact NZ-O 3.11Å; L568-F571 VanDerWaalsContact O-CB 3.28Å; L568-F571 WeakPolarHBondContact O-CB 3.39Å; L568-F571 PolarHBondContact O-N 3.38Å; L568-F571 VanDerWaalsContact O-N 3.15Å; F571-F689 HydrophobicContact CE1-CD2 4.39Å; F571-F689 AromaticContact CE1-CE2 3.72Å; F571-F689 HydrophobicContact CE1-CE2 3.72Å; F571-F689 AromaticContact CE1-CZ 3.86Å; F571-F689 HydrophobicContact CE1-CZ 3.86Å; F571-F689 HydrophobicContact CZ-CE2 4.41Å; F571-Q692 HydrophobicContact CE2-CB 4.13Å; F571-Q692 WeakPolarHBondContact CE2-O 3.31Å; F571-Q692 HydrophobicContact CZ-CB 4.13Å; F571-F693 HydrophobicContact CD1-CD2 4.09Å; F571-F693 HydrophobicContact CE1-CB 4.19Å; F571-F693 AromaticContact CE1-CD2 3.91Å; F571-F693 HydrophobicContact CE1-CD2 3.91Å; F571-F693 HydrophobicContact CE2-CB 4.37Å; F571-F693 HydrophobicContact CZ-CB 3.82Å; F571-F693 HydrophobicContact CZ-CD2 4.3Å; F571-H696 HydrophobicContact CD2-CB 3.68Å; F571-H696 AromaticContact CD2-CD2 3.71Å; F571-H696 AromaticContact CD2-CG 3.74Å; F571-H696 HydrophobicContact CE2-CB 4.01Å
572	Q	82.6	Confident	82.2	Confident	170 Å²	170	61 Å²	61	79%	0.794	31%	0.312	S	S	*	.			trans	-129.4	129.6	172.4	-68.3	-173.1	-3.8	0	0	109.3	D570	D570-Q572 PolarHBondContact O-N 3.3Å
573	E	84.1	Confident	81.3	Confident	64 Å²	64	66.9 Å²	66.9	30%	0.299	34%	0.343	S	S	.	.			trans	-77.5	132.6	179.9	65.2	-79.9	-171.5	0	0	112.6	M492 L575 F689	M492-E573 HydrophobicContact CG-CG 4.46Å; M492-E573 WeakPolarHBondContact CG-OE1 3.22Å; E573-L575 HydrophobicContact CB-CD1 4.48Å; E573-L575 HydrophobicContact CB-CG 4.18Å; E573-L575 HydrophobicContact CG-CD1 4.07Å; E573-L575 HydrophobicContact CG-CG 4.14Å; E573-F689 HydrophobicContact CB-CD2 3.69Å; E573-F689 HydrophobicContact CB-CE2 3.92Å; E573-F689 HydrophobicContact CG-CD2 4.3Å; E573-F689 HydrophobicContact CG-CE2 4.37Å
574	D	81.8	Confident	80.4	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	36%	0.36	S	S	.	.			trans	-110.6	88.7	173.7	-173.9	0.8	0	0	0	109.1	R578 Q692	D574-R578 IonicContact OD1-CZ 3.91Å; D574-R578 IonicContact OD1-NH2 3.35Å; D574-R578 PolarHBondContact OD1-NH2 3.42Å; D574-R578 IonicContact OD2-CZ 3.61Å; D574-R578 IonicContact OD2-NH1 2.78Å; D574-R578 PolarHBondContact OD2-NH1 2.99Å; D574-R578 IonicContact OD2-NH2 3.38Å; D574-R578 PolarHBondContact OD2-NH2 3.41Å; D574-Q692 PolarHBondContact O-NE2 3.26Å
575	L	82.2	Confident	79.5	Confident	26 Å²	26	74.7 Å²	74.7	14%	0.136	38%	0.381	C	S	.	.			trans	-100	9.1	-176.1	-58.1	179.9	0	0	0	113.5	F485 M492 E573 W680 K685 F689	F485-L575 HydrophobicContact CZ-CD1 4.21Å; M492-L575 HydrophobicContact CE-CD1 3.73Å; E573-L575 HydrophobicContact CB-CD1 4.48Å; E573-L575 HydrophobicContact CB-CG 4.18Å; E573-L575 HydrophobicContact CG-CD1 4.07Å; E573-L575 HydrophobicContact CG-CG 4.14Å; L575-W680 PolarHBondContact O-NE1 2.77Å; L575-K685 HydrophobicContact CD2-CB 4.43Å; L575-F689 HydrophobicContact CD2-CB 4.07Å
576	D	80.7	Confident	78.4	Confident	121 Å²	121	75.8 Å²	75.8	65%	0.647	38%	0.384	S	S	*	.			trans	-70.8	133.5	176.8	-78.7	-23.6	0	0	0	110.6	R578	D576-R578 PolarHBondContact O-N 3.3Å
577	F	79.7	Confident	77.3	Confident	34 Å²	34	74 Å²	74	15%	0.149	38%	0.379	C	S	.	.			trans	-64.1	122.2	176	172.4	-92.1	0	0	0	110.4	F579 Y673 E676 R677 W680	F577-F579 HydrophobicContact CE1-CB 4.29Å; F577-F579 HydrophobicContact CZ-CB 4.44Å; F577-Y673 HydrophobicContact CE1-CD2 4.39Å; F577-Y673 AromaticContact CE1-CE2 3.73Å; F577-Y673 HydrophobicContact CE1-CE2 3.73Å; F577-Y673 AromaticContact CE1-CZ 3.91Å; F577-Y673 HydrophobicContact CZ-CE2 4.38Å; F577-E676 VanDerWaalsContact CE2-C 3.49Å; F577-E676 HydrophobicContact CE2-CB 3.96Å; F577-E676 HydrophobicContact CZ-CB 4.08Å; F577-R677 HydrophobicContact CE1-CB 4.24Å; F577-R677 HydrophobicContact CE1-CG 4.48Å; F577-R677 VanDerWaalsContact CE2-CA 3.41Å; F577-R677 HydrophobicContact CE2-CB 4.03Å; F577-R677 HydrophobicContact CZ-CB 3.74Å; F577-R677 HydrophobicContact CZ-CG 4.39Å; F577-W680 HydrophobicContact CB-CG 4.26Å; F577-W680 HydrophobicContact CD2-CB 3.75Å; F577-W680 HydrophobicContact CD2-CD2 4Å; F577-W680 HydrophobicContact CD2-CE3 4.44Å; F577-W680 AromaticContact CD2-CG 3.69Å; F577-W680 HydrophobicContact CD2-CG 3.69Å; F577-W680 HydrophobicContact CE2-CB 4.29Å; F577-W680 HydrophobicContact CG-CG 4.47Å
578	R	77.4	Confident	76.4	Confident	125 Å²	125	74.9 Å²	74.9	47%	0.472	39%	0.388	S	S	.	.			trans	-124.9	122	170.6	-66	-176.1	-178.2	144.4	12.8	109.4	D574 D576 S580	D574-R578 IonicContact OD1-CZ 3.91Å; D574-R578 IonicContact OD1-NH2 3.35Å; D574-R578 PolarHBondContact OD1-NH2 3.42Å; D574-R578 IonicContact OD2-CZ 3.61Å; D574-R578 IonicContact OD2-NH1 2.78Å; D574-R578 PolarHBondContact OD2-NH1 2.99Å; D574-R578 IonicContact OD2-NH2 3.38Å; D574-R578 PolarHBondContact OD2-NH2 3.41Å; D576-R578 PolarHBondContact O-N 3.3Å; R578-S580 PolarHBondContact O-N 2.84Å
579	F	80.2	Confident	75.1	Confident	15 Å²	15	77.7 Å²	77.7	7%	0.066	41%	0.411	C	S	.	.			trans	-60.8	132	178.7	-174.9	-135.3	0	0	0	111.3	F577 L581 G582 Y669 V672 Y673 E676	F577-F579 HydrophobicContact CE1-CB 4.29Å; F577-F579 HydrophobicContact CZ-CB 4.44Å; F579-L581 VanDerWaalsContact C-N 3.26Å; F579-L581 HydrophobicContact CD1-CB 4.04Å; F579-L581 HydrophobicContact CE1-CB 3.52Å; F579-L581 HydrophobicContact CZ-CB 3.84Å; F579-L581 HydrophobicContact CZ-CD1 4.12Å; F579-L581 HydrophobicContact CZ-CG 4.44Å; F579-L581 PolarHBondContact O-N 3.47Å; F579-G582 PolarHBondContact O-N 3.37Å; F579-Y669 HydrophobicContact CD1-CE1 4.36Å; F579-Y669 HydrophobicContact CD1-CE2 4.34Å; F579-Y669 AromaticContact CD1-CZ 3.88Å; F579-Y669 HydrophobicContact CE1-CD1 4.34Å; F579-Y669 HydrophobicContact CE1-CD2 4.1Å; F579-Y669 AromaticContact CE1-CE1 3.85Å; F579-Y669 HydrophobicContact CE1-CE1 3.85Å; F579-Y669 AromaticContact CE1-CE2 3.59Å; F579-Y669 HydrophobicContact CE1-CE2 3.59Å; F579-Y669 HydrophobicContact CE1-CG 4.45Å; F579-Y669 AromaticContact CE1-CZ 3.44Å; F579-Y669 VanDerWaalsContact CE1-CZ 3.44Å; F579-V672 HydrophobicContact CE2-CB 4.39Å; F579-V672 HydrophobicContact CE2-CG1 3.87Å; F579-V672 HydrophobicContact CZ-CB 4.15Å; F579-V672 HydrophobicContact CZ-CG1 3.92Å; F579-Y673 HydrophobicContact CB-CD2 3.74Å; F579-Y673 HydrophobicContact CB-CE2 3.95Å; F579-Y673 AromaticContact CD1-CD2 3.78Å; F579-Y673 HydrophobicContact CD1-CD2 3.78Å; F579-Y673 AromaticContact CD2-CD2 3.72Å; F579-Y673 HydrophobicContact CD2-CD2 3.72Å; F579-Y673 HydrophobicContact CD2-CG 4.27Å; F579-Y673 HydrophobicContact CE1-CD2 4.27Å; F579-Y673 HydrophobicContact CE2-CD2 4.3Å; F579-Y673 HydrophobicContact CE2-CG 4.49Å; F579-Y673 VanDerWaalsContact CE2-N 3.29Å; F579-Y673 AromaticContact CG-CD2 3.48Å; F579-Y673 HydrophobicContact CG-CD2 3.48Å; F579-Y673 VanDerWaalsContact CG-CD2 3.48Å; F579-Y673 HydrophobicContact CG-CE2 4.2Å; F579-Y673 HydrophobicContact CG-CG 4.4Å; F579-E676 HydrophobicContact CD2-CB 4.28Å; F579-E676 HydrophobicContact CD2-CG 4.48Å; F579-E676 WeakPolarHBondContact CD2-OE2 2.98Å; F579-E676 HydrophobicContact CE2-CB 4.41Å; F579-E676 HydrophobicContact CE2-CG 4.3Å; F579-E676 WeakPolarHBondContact CE2-OE2 3.2Å
580	S	77.8	Confident	73.9	Confident	55 Å²	55	76 Å²	76	39%	0.385	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.7	-176.7	71.6	0	0	0	0	112.6	R578 G582 E676	R578-S580 PolarHBondContact O-N 2.84Å; S580-G582 VanDerWaalsContact C-N 3.35Å; S580-E676 WeakPolarHBondContact CB-OE1 3.43Å; S580-E676 WeakPolarHBondContact CB-OE2 3.34Å; S580-E676 PolarHBondContact N-OE2 3.07Å; S580-E676 PolarHBondContact OG-OE1 3.08Å; S580-E676 PolarHBondContact OG-OE2 3.27Å
581	L	72.8	Confident	72.6	Confident	75 Å²	75	75.3 Å²	75.3	39%	0.393	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	22.4	176.4	-63.9	160.6	0	0	0	112.3	F579 I583 Y669 V672	F579-L581 VanDerWaalsContact C-N 3.26Å; F579-L581 HydrophobicContact CD1-CB 4.04Å; F579-L581 HydrophobicContact CE1-CB 3.52Å; F579-L581 HydrophobicContact CZ-CB 3.84Å; F579-L581 HydrophobicContact CZ-CD1 4.12Å; F579-L581 HydrophobicContact CZ-CG 4.44Å; F579-L581 PolarHBondContact O-N 3.47Å; L581-I583 PolarHBondContact O-N 3.29Å; L581-Y669 HydrophobicContact CB-CE2 3.98Å; L581-Y669 WeakPolarHBondContact O-CE2 3.46Å; L581-Y669 PolarHBondContact O-OH 3.33Å; L581-V672 HydrophobicContact CD1-CG1 4.05Å
582	G	73.2	Confident	71	Confident	11 Å²	11	82.2 Å²	82.2	11%	0.113	43%	0.432	C	S	.	.			trans	-60.8	135.6	173.1	0	0	0	0	0	111	F579 S580 S584 R585 L586	F579-G582 PolarHBondContact O-N 3.37Å; S580-G582 VanDerWaalsContact C-N 3.35Å; G582-S584 PolarHBondContact O-N 3.12Å; G582-S584 VanDerWaalsContact O-N 3.1Å; G582-R585 PolarHBondContact O-N 3.15Å; G582-L586 PolarHBondContact O-N 2.83Å
583	I	67.8	Low	69.5	Low	125 Å²	125	80.2 Å²	80.2	64%	0.641	42%	0.423	S	S	*	.	H	α-helix	trans	-56	-33.4	-176.6	-56.6	163.2	0	0	0	111.3	L581 L586 L587	L581-I583 PolarHBondContact O-N 3.29Å; I583-L586 PolarHBondContact O-N 3.23Å; I583-L587 HydrophobicContact CG2-CD1 3.98Å; I583-L587 WeakPolarHBondContact O-CB 3.25Å; I583-L587 WeakPolarHBondContact O-CD1 3.49Å; I583-L587 VanDerWaalsContact O-CG 3.31Å; I583-L587 WeakPolarHBondContact O-CG 3.35Å; I583-L587 PolarHBondContact O-N 3.4Å
584	S	67.5	Low	68.1	Low	92 Å²	92	86.5 Å²	86.5	64%	0.643	44%	0.444	S	S	*	.	H	α-helix	trans	-65.6	-40.4	175.1	57.8	0	0	0	0	113.6	G582 S588	G582-S584 PolarHBondContact O-N 3.12Å; G582-S584 VanDerWaalsContact O-N 3.1Å; S584-S588 WeakPolarHBondContact O-CB 3.08Å; S584-S588 PolarHBondContact O-N 2.77Å; S584-S588 PolarHBondContact O-OG 2.96Å
585	R	63.5	Low	66.5	Low	116 Å²	116	90.5 Å²	90.5	44%	0.438	46%	0.459	S	S	.	.	H	α-helix	trans	-71.1	-40	175.7	-86.1	-168.3	172.5	168.2	-0.4	111.7	G582 L587 S588 A589	G582-R585 PolarHBondContact O-N 3.15Å; R585-L587 VanDerWaalsContact C-N 3.32Å; R585-L587 PolarHBondContact O-N 2.95Å; R585-S588 WeakPolarHBondContact CA-OG 3.43Å; R585-S588 CarbonylContact O-C 3.56Å; R585-S588 PolarHBondContact O-N 2.85Å; R585-S588 VanDerWaalsContact O-N 3.14Å; R585-S588 PolarHBondContact O-OG 2.95Å; R585-A589 WeakPolarHBondContact O-CB 2.9Å; R585-A589 PolarHBondContact O-N 2.76Å
586	L	63.6	Low	64.8	Low	94 Å²	94	96 Å²	96	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-63.1	-39.6	177.7	-140.8	134.2	0	0	0	111.5	G582 I583 I590	G582-L586 PolarHBondContact O-N 2.83Å; I583-L586 PolarHBondContact O-N 3.23Å; L586-I590 HydrophobicContact CD2-CD1 4.36Å; L586-I590 WeakPolarHBondContact O-CD1 3.34Å; L586-I590 WeakPolarHBondContact O-CG1 3.42Å; L586-I590 PolarHBondContact O-N 2.83Å
587	L	62.5	Low	63.5	Low	117 Å²	117	99 Å²	99	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-68.6	-37.1	172	-73.9	165.7	0	0	0	112.9	I583 R585 S591	I583-L587 HydrophobicContact CG2-CD1 3.98Å; I583-L587 WeakPolarHBondContact O-CB 3.25Å; I583-L587 WeakPolarHBondContact O-CD1 3.49Å; I583-L587 VanDerWaalsContact O-CG 3.31Å; I583-L587 WeakPolarHBondContact O-CG 3.35Å; I583-L587 PolarHBondContact O-N 3.4Å; R585-L587 VanDerWaalsContact C-N 3.32Å; R585-L587 PolarHBondContact O-N 2.95Å; L587-S591 PolarHBondContact O-N 2.9Å
588	S	65.2	Low	62.1	Low	52 Å²	52	104.5 Å²	104.5	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-74.6	-27.6	177.5	75.8	0	0	0	0	114.3	S584 R585 S591 K592	S584-S588 WeakPolarHBondContact O-CB 3.08Å; S584-S588 PolarHBondContact O-N 2.77Å; S584-S588 PolarHBondContact O-OG 2.96Å; R585-S588 WeakPolarHBondContact CA-OG 3.43Å; R585-S588 CarbonylContact O-C 3.56Å; R585-S588 PolarHBondContact O-N 2.85Å; R585-S588 VanDerWaalsContact O-N 3.14Å; R585-S588 PolarHBondContact O-OG 2.95Å; S588-S591 PolarHBondContact O-N 3.33Å; S588-S591 PolarHBondContact O-OG 3.45Å; S588-K592 PolarHBondContact O-N 3.16Å; S588-K592 VanDerWaalsContact O-N 3.07Å
589	A	58.7	Low	61	Low	59 Å²	59	104.1 Å²	104.1	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-70.1	-38.6	175.2	0	0	0	0	0	110.9	R585 S591 K592 E593	R585-A589 WeakPolarHBondContact O-CB 2.9Å; R585-A589 PolarHBondContact O-N 2.76Å; A589-S591 VanDerWaalsContact C-N 3.3Å; A589-S591 PolarHBondContact O-N 2.94Å; A589-K592 PolarHBondContact O-N 3.08Å; A589-E593 PolarHBondContact O-N 2.98Å
590	I	57.9	Low	59.5	Low	98 Å²	98	109.7 Å²	109.7	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-68.1	-29.3	175.4	-65.2	166.7	0	0	0	111.6	L586	L586-I590 HydrophobicContact CD2-CD1 4.36Å; L586-I590 WeakPolarHBondContact O-CD1 3.34Å; L586-I590 WeakPolarHBondContact O-CG1 3.42Å; L586-I590 PolarHBondContact O-N 2.83Å
591	S	58.9	Low	57.8	Low	71 Å²	71	115.4 Å²	115.4	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-78.9	-38.3	175.9	79.1	0	0	0	0	113.3	L587 S588 A589 E593 R594 F595	L587-S591 PolarHBondContact O-N 2.9Å; S588-S591 PolarHBondContact O-N 3.33Å; S588-S591 PolarHBondContact O-OG 3.45Å; A589-S591 VanDerWaalsContact C-N 3.3Å; A589-S591 PolarHBondContact O-N 2.94Å; S591-E593 VanDerWaalsContact C-N 3.34Å; S591-E593 PolarHBondContact O-N 3.41Å; S591-R594 PolarHBondContact O-N 2.89Å; S591-F595 PolarHBondContact O-N 3.32Å; S591-F595 VanDerWaalsContact O-N 3.15Å
592	K	53.7	Low	56	Low	153 Å²	153	114.7 Å²	114.7	67%	0.665	58%	0.58	S	S	*	*	H	α-helix	trans	-62.8	-36.7	178.4	-83.6	-176.1	174.5	-175.3	0	112.9	S588 A589 R594 F595 F596	S588-K592 PolarHBondContact O-N 3.16Å; S588-K592 VanDerWaalsContact O-N 3.07Å; A589-K592 PolarHBondContact O-N 3.08Å; K592-R594 VanDerWaalsContact C-N 3.35Å; K592-R594 PolarHBondContact O-N 3.31Å; K592-F595 PolarHBondContact O-N 3.41Å; K592-F596 PolarHBondContact O-N 3.06Å
593	E	51.5	Low	54.2	Low	129 Å²	129	123.1 Å²	123.1	60%	0.603	62%	0.617	S	S	*	*	H	α-helix	trans	-70.3	-29.4	-178.8	-147.4	-178.1	170.8	0	0	113.1	A589 S591 R597	A589-E593 PolarHBondContact O-N 2.98Å; S591-E593 VanDerWaalsContact C-N 3.34Å; S591-E593 PolarHBondContact O-N 3.41Å; E593-R597 PolarHBondContact O-N 2.95Å
594	R	53.4	Low	52.3	Low	195 Å²	195	128.7 Å²	128.7	74%	0.736	63%	0.63	S	S	*	*	H	α-helix	trans	-78.9	-34	172.4	-77.1	-174.9	-172	167.9	4.1	113.1	S591 K592 R597 M598	S591-R594 PolarHBondContact O-N 2.89Å; K592-R594 VanDerWaalsContact C-N 3.35Å; K592-R594 PolarHBondContact O-N 3.31Å; R594-R597 PolarHBondContact O-N 2.97Å; R594-M598 PolarHBondContact O-N 3.06Å
595	F	49	Very low	50.6	Low	138 Å²	138	135.1 Å²	135.1	61%	0.605	64%	0.64	S	S	*	*	H	α-helix	trans	-67.1	-39.4	174.7	-173.3	-107.5	0	0	0	111.7	S591 K592 M598 L599	S591-F595 PolarHBondContact O-N 3.32Å; S591-F595 VanDerWaalsContact O-N 3.15Å; K592-F595 PolarHBondContact O-N 3.41Å; F595-M598 PolarHBondContact O-N 2.89Å; F595-L599 HydrophobicContact CD1-CD1 3.76Å; F595-L599 HydrophobicContact CE1-CD1 3.29Å; F595-L599 HydrophobicContact CE1-CG 4.47Å; F595-L599 HydrophobicContact CE2-CD1 4.44Å; F595-L599 HydrophobicContact CZ-CD1 3.68Å; F595-L599 PolarHBondContact O-N 2.84Å; F595-L599 VanDerWaalsContact O-N 3.08Å
596	F	46.4	Very low	49.1	Very low	142 Å²	142	135.4 Å²	135.4	62%	0.623	66%	0.657	S	S	*	*	H	α-helix	trans	-67.5	-35.4	176.2	-130.9	-89.3	0	0	0	112.8	K592 M598 L600	K592-F596 PolarHBondContact O-N 3.06Å; F596-M598 VanDerWaalsContact C-N 3.31Å; F596-M598 PolarHBondContact O-N 2.82Å; F596-L600 HydrophobicContact CD1-CD1 3.81Å; F596-L600 HydrophobicContact CE1-CD1 4.24Å; F596-L600 WeakPolarHBondContact O-CD1 3.19Å; F596-L600 PolarHBondContact O-N 3.26Å
597	R	52.3	Low	47.6	Very low	182 Å²	182	138.7 Å²	138.7	69%	0.687	67%	0.67	S	S	*	*	H	α-helix	trans	-69	-26.2	172.3	-76.3	-171.5	-167.5	-164.8	5	113.6	E593 R594	E593-R597 PolarHBondContact O-N 2.95Å; R594-R597 PolarHBondContact O-N 2.97Å
598	M	52.1	Low	46.2	Very low	151 Å²	151	141.3 Å²	141.3	74%	0.744	68%	0.683	S	S	*	*	H	α-helix	trans	-81.6	-31.1	177.9	-163.7	170.9	-77.1	0	0	112.5	R594 F595 F596	R594-M598 PolarHBondContact O-N 3.06Å; F595-M598 PolarHBondContact O-N 2.89Å; F596-M598 VanDerWaalsContact C-N 3.31Å; F596-M598 PolarHBondContact O-N 2.82Å
599	L	53	Low	44.5	Very low	116 Å²	116	144.8 Å²	144.8	61%	0.607	70%	0.702	S	S	*	*	H	α-helix	trans	-75.4	-21.3	173.9	-87.1	160.2	0	0	0	114.3	F595	F595-L599 HydrophobicContact CD1-CD1 3.76Å; F595-L599 HydrophobicContact CE1-CD1 3.29Å; F595-L599 HydrophobicContact CE1-CG 4.47Å; F595-L599 HydrophobicContact CE2-CD1 4.44Å; F595-L599 HydrophobicContact CZ-CD1 3.68Å; F595-L599 PolarHBondContact O-N 2.84Å; F595-L599 VanDerWaalsContact O-N 3.08Å
600	L	49.8	Very low	43.1	Very low	133 Å²	133	145.9 Å²	145.9	70%	0.696	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-5.4	176.8	-77.2	159.9	0	0	0	113.5	F596	F596-L600 HydrophobicContact CD1-CD1 3.81Å; F596-L600 HydrophobicContact CE1-CD1 4.24Å; F596-L600 WeakPolarHBondContact O-CD1 3.19Å; F596-L600 PolarHBondContact O-N 3.26Å
601	Q	41.3	Very low	41.7	Very low	174 Å²	174	150 Å²	150	81%	0.813	73%	0.728	S	S	*	*	S	Bend	trans	-120.4	70.2	174.9	-77.2	-174.9	-13	0	0	110.4
602	G	35.8	Very low	40.3	Very low	60 Å²	60	151 Å²	151	62%	0.619	74%	0.74	S	S	*	*			trans	-153.9	91.9	175.3	0	0	0	0	0	111.8
603	E	34	Very low	39.1	Very low	189 Å²	189	151 Å²	151	88%	0.883	75%	0.747	S	S	*	*			trans	41.9	108.6	149.6	-67.6	177	126.5	0	0	119.6
604	R	28.4	Very low	38	Very low	241 Å²	241	151.2 Å²	151.2	91%	0.909	75%	0.753	S	S	*	*				43.8	107.2	86.1	-79.8	-172.9	176	173.2	-0.4	114.7
605	R	31.3	Very low	37	Very low	227 Å²	227	147.9 Å²	147.9	86%	0.857	75%	0.754	S	S	*	*			trans	-29.8	151	158	-117.3	175.6	-179.3	160.4	0.7	114.3
606	P	32.5	Very low	36	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	76%	0.762	S	S	*	*				-140	154.3	104.6	32.7	-16.8	0	0	0	115.5
607	Q	32.3	Very low	35.3	Very low	163 Å²	163	149.1 Å²	149.1	76%	0.762	78%	0.776	S	S	*	*			trans	-65.3	153.3	165.6	-69.4	168.5	-38.3	0	0	111.2
608	I	33.8	Very low	34.2	Very low	172 Å²	172	145.9 Å²	145.9	88%	0.882	78%	0.781	S	S	*	*			trans	-158.6	150.3	132.9	-90.7	147.8	0	0	0	109.1
609	T	29.2	Very low	33.1	Very low	125 Å²	125	144.3 Å²	144.3	77%	0.767	79%	0.785	S	S	*	*			trans	-80.2	148	-165.2	40.7	0	0	0	0	117.9
610	A	27.8	Very low	31.9	Very low	82 Å²	82	145.2 Å²	145.2	68%	0.678	80%	0.795	S	S	*	*				93.6	130.2	128.4	0	0	0	0	0	123.7
611	H	29	Very low	30.7	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.856	80%	0.801	S	S	*	*			trans	102.4	111	143.4	-73.1	-58.7	0	0	0	122.4
612	A	30.3	Very low	30.3	Very low	90 Å²	90	148.3 Å²	148.3	74%	0.744	81%	0.805	S	S	*	*				87	115.1	125	0	0	0	0	0	121.6
613	D	28.1	Very low	30.2	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	81%	0.806	S	S	*	*			trans	57.5	141.4	140.9	-85.1	-11.1	0	0	0	125
614	D	28.3	Very low	29.9	Very low	134 Å²	134	149.2 Å²	149.2	72%	0.717	81%	0.806	S	S	*	*			trans	81.2	109.3	153.6	-71.9	-12.5	0	0	0	121.8
615	T	31.8	Very low	30.2	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	80%	0.796	S	S	*	*			trans	20.5	112.7	135.1	44.2	0	0	0	0	117.8
616	S	29.4	Very low	30.4	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	79%	0.791	S	S	*	*				-176.2	147.6	123.3	21.8	0	0	0	0	111.1
617	E	31.1	Very low	30.5	Very low	195 Å²	195	134.6 Å²	134.6	91%	0.911	78%	0.779	S	S	*	*			trans	-40.7	136.9	171.6	-62.8	170.2	143.9	0	0	112.6
618	S	29.6	Very low	31	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	78%	0.781	S	S	*	*			trans	-150.4	114.4	159.4	-8.5	0	0	0	0	111.7
619	S	27.6	Very low	31.3	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	77%	0.767	S	S	*	*			trans	-53.1	146.2	164.9	49.7	0	0	0	0	113.3
620	V	29.5	Very low	31.8	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	76%	0.763	S	S	*	*			trans	-56.8	137.3	173.5	179.7	0	0	0	0	112.2
621	M	24.8	Very low	32.3	Very low	166 Å²	166	128.5 Å²	128.5	82%	0.818	76%	0.761	S	S	*	*			trans	-146	107.9	154.7	-163.8	175.8	176.1	0	0	109.2	T623	M621-T623 HydrophobicContact CE-CG2 4.15Å
622	F	32.5	Very low	32.9	Very low	206 Å²	206	126.5 Å²	126.5	90%	0.904	76%	0.756	S	S	*	*			trans	-96.1	112.8	162.7	-109.3	-89.1	0	0	0	107.6
623	T	32.9	Very low	33.6	Very low	103 Å²	103	128.7 Å²	128.7	63%	0.632	75%	0.754	S	S	*	*			trans	-77.3	122.7	173.3	49.6	0	0	0	0	109.8	M621 S625	M621-T623 HydrophobicContact CE-CG2 4.15Å; T623-S625 PolarHBondContact O-N 3.35Å
624	D	27.8	Very low	34.1	Very low	166 Å²	166	131.7 Å²	131.7	89%	0.888	75%	0.754	S	S	*	*			trans	-59.1	116.7	163.2	-81.5	-36.5	0	0	0	109.7
625	S	34.3	Very low	34.8	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	75%	0.751	S	S	*	*			trans	-111.7	104	167.6	-167.7	0	0	0	0	109.4	T623 A627	T623-S625 PolarHBondContact O-N 3.35Å; S625-A627 PolarHBondContact O-N 2.95Å
626	P	35.6	Very low	35.2	Very low	114 Å²	114	127.4 Å²	127.4	74%	0.74	74%	0.743	S	S	*	*			trans	-87.1	79.5	177.5	34.7	-29.9	0	0	0	108.7
627	A	35.2	Very low	35.8	Very low	68 Å²	68	125.7 Å²	125.7	56%	0.562	73%	0.732	S	S	*	*			trans	-131.3	0.9	-178.7	0	0	0	0	0	115.6	S625	S625-A627 PolarHBondContact O-N 2.95Å
628	I	42.1	Very low	36.4	Very low	156 Å²	156	122.3 Å²	122.3	80%	0.8	72%	0.724	S	S	*	*	S	Bend	trans	-112.7	-4.7	-177.1	-53.9	-179.3	0	0	0	112.7	S630	I628-S630 PolarHBondContact O-N 3.34Å
629	S	40.6	Very low	37.2	Very low	85 Å²	85	123 Å²	123	59%	0.594	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-5.3	-179.6	38.4	0	0	0	0	115.3
630	S	39.6	Very low	38.1	Very low	95 Å²	95	121.4 Å²	121.4	66%	0.664	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-10.8	-176.2	61.6	0	0	0	0	115.4	I628	I628-S630 PolarHBondContact O-N 3.34Å
631	A	38.8	Very low	38.6	Very low	79 Å²	79	122.5 Å²	122.5	65%	0.653	72%	0.718	S	S	*	*	S	Bend	trans	-89.4	-22.8	178.2	0	0	0	0	0	113.7
632	L	41.6	Very low	39.6	Very low	142 Å²	142	116.5 Å²	116.5	74%	0.743	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-16.2	-170.2	-136.7	136.8	0	0	0	113.6
633	I	44.6	Very low	40.6	Very low	136 Å²	136	109.1 Å²	109.1	70%	0.697	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-13.9	178.1	-63	176.5	0	0	0	112
634	R	39.5	Very low	41.6	Very low	218 Å²	218	109.4 Å²	109.4	82%	0.823	68%	0.682	S	S	*	*	S	Bend	trans	-90.8	-7.4	-173.8	-95	-179	175.5	165.3	-0.3	116.8
635	S	42.8	Very low	42.8	Very low	95 Å²	95	103.3 Å²	103.3	66%	0.664	66%	0.659	S	S	*	*	S	Bend	trans	-111.7	-8.1	-179.6	48.8	0	0	0	0	114.5
636	A	39.4	Very low	44.2	Very low	72 Å²	72	106 Å²	106	60%	0.595	66%	0.658	S	S	*	*	S	Bend	trans	-94.7	-12.4	177.9	0	0	0	0	0	114.3	V638	A636-V638 VanDerWaalsContact C-N 3.29Å; A636-V638 PolarHBondContact O-N 2.93Å
637	S	41.1	Very low	45.3	Very low	76 Å²	76	106 Å²	106	53%	0.531	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-3.9	-179.8	66	0	0	0	0	114.6
638	V	44.2	Very low	46.4	Very low	124 Å²	124	107.7 Å²	107.7	75%	0.752	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-8.5	-178.2	-180	0	0	0	0	112.8	A636	A636-V638 VanDerWaalsContact C-N 3.29Å; A636-V638 PolarHBondContact O-N 2.93Å
639	V	47.1	Very low	47.2	Very low	130 Å²	130	106 Å²	106	79%	0.788	64%	0.643	S	S	*	*	S	Bend	trans	-107	-7.1	179.8	-177.4	0	0	0	0	112.7
640	A	46.7	Very low	48.2	Very low	83 Å²	83	104.2 Å²	104.2	69%	0.686	63%	0.63	S	S	*	*	S	Bend	trans	-89.6	-15.6	-176.9	0	0	0	0	0	115.2
641	D	39.9	Very low	49.2	Very low	157 Å²	157	103 Å²	103	84%	0.84	62%	0.618	S	S	*	*	S	Bend	trans	-93.9	7.7	179.7	-81.1	-18.2	0	0	0	114.4	G643	D641-G643 PolarHBondContact O-N 3.02Å
642	G	44.9	Very low	50.4	Low	41 Å²	41	103.4 Å²	103.4	42%	0.423	61%	0.613	S	S	.	*			trans	-94.7	55.3	-176.1	0	0	0	0	0	114.5	V644 G645 F646	G642-V644 PolarHBondContact O-N 2.9Å; G642-G645 PolarHBondContact O-N 3.19Å; G642-F646 PolarHBondContact O-N 3.4Å
643	G	52.9	Low	51.3	Low	51 Å²	51	99.1 Å²	99.1	53%	0.526	59%	0.592	S	S	.	*	H	α-helix	trans	-53.1	-23.4	171	0	0	0	0	0	113.2	D641 L647	D641-G643 PolarHBondContact O-N 3.02Å; G643-L647 WeakPolarHBondContact O-CB 3.31Å; G643-L647 PolarHBondContact O-N 3.21Å
644	V	53.9	Low	52.2	Low	108 Å²	108	98.3 Å²	98.3	66%	0.655	58%	0.583	S	S	*	*	H	α-helix	trans	-73.5	-30.2	174.6	-171	0	0	0	0	112.5	G642 L648	G642-V644 PolarHBondContact O-N 2.9Å; V644-L648 HydrophobicContact CG1-CD1 4.08Å; V644-L648 WeakPolarHBondContact O-CB 3.35Å; V644-L648 VanDerWaalsContact O-CG 3.3Å; V644-L648 WeakPolarHBondContact O-CG 3.32Å; V644-L648 PolarHBondContact O-N 2.86Å
645	G	54.1	Low	53.4	Low	39 Å²	39	97.1 Å²	97.1	40%	0.402	58%	0.584	S	S	.	*	H	α-helix	trans	-73.9	-42.7	179.2	0	0	0	0	0	113.1	G642 L648 L649	G642-G645 PolarHBondContact O-N 3.19Å; G645-L648 PolarHBondContact O-N 2.99Å; G645-L649 PolarHBondContact O-N 3.49Å
646	F	62.8	Low	54.6	Low	157 Å²	157	98.1 Å²	98.1	69%	0.689	59%	0.586	S	S	*	*	H	α-helix	trans	-65.7	-39.4	171.6	-175.1	-100.4	0	0	0	111	G642 L648 L649 C650	G642-F646 PolarHBondContact O-N 3.4Å; F646-L648 PolarHBondContact O-N 3.24Å; F646-L649 PolarHBondContact O-N 2.87Å; F646-C650 WeakPolarHBondContact CE1-SG 3.39Å; F646-C650 VanDerWaalsContact O-CB 3.29Å; F646-C650 WeakPolarHBondContact O-CB 3.44Å; F646-C650 PolarHBondContact O-N 3.35Å; F646-C650 PolarHBondContact O-SG 3.49Å; F646-C650 VanDerWaalsContact O-SG 3.33Å
647	L	59.7	Low	55.8	Low	115 Å²	115	97.9 Å²	97.9	60%	0.602	58%	0.577	S	S	*	*	H	α-helix	trans	-64.7	-37	173.2	-114.6	111.1	0	0	0	112.7	G643 T651	G643-L647 WeakPolarHBondContact O-CB 3.31Å; G643-L647 PolarHBondContact O-N 3.21Å; L647-T651 WeakPolarHBondContact O-CB 3.22Å; L647-T651 VanDerWaalsContact O-CG2 3.28Å; L647-T651 WeakPolarHBondContact O-CG2 3.33Å; L647-T651 PolarHBondContact O-N 3.42Å; L647-T651 PolarHBondContact O-OG1 3.49Å
648	L	58.2	Low	57.2	Low	103 Å²	103	95.7 Å²	95.7	54%	0.539	57%	0.566	S	S	.	*	H	α-helix	trans	-68.3	-42.1	175	-82.4	165.6	0	0	0	111.7	V644 G645 F646 T651 V652	V644-L648 HydrophobicContact CG1-CD1 4.08Å; V644-L648 WeakPolarHBondContact O-CB 3.35Å; V644-L648 VanDerWaalsContact O-CG 3.3Å; V644-L648 WeakPolarHBondContact O-CG 3.32Å; V644-L648 PolarHBondContact O-N 2.86Å; G645-L648 PolarHBondContact O-N 2.99Å; F646-L648 PolarHBondContact O-N 3.24Å; L648-T651 VanDerWaalsContact CA-OG1 3.27Å; L648-T651 WeakPolarHBondContact CA-OG1 3.47Å; L648-T651 PolarHBondContact O-N 2.83Å; L648-T651 PolarHBondContact O-OG1 3.31Å; L648-V652 WeakPolarHBondContact O-CB 3.42Å; L648-V652 VanDerWaalsContact O-CG2 3.23Å; L648-V652 WeakPolarHBondContact O-CG2 3.37Å; L648-V652 PolarHBondContact O-N 3.47Å
649	L	58.8	Low	58.7	Low	120 Å²	120	97 Å²	97	63%	0.628	56%	0.558	S	S	*	*	H	α-helix	trans	-64.1	-44.6	173.7	-122.7	126	0	0	0	111.1	G645 F646 T651 V652 V653	G645-L649 PolarHBondContact O-N 3.49Å; F646-L649 PolarHBondContact O-N 2.87Å; L649-T651 VanDerWaalsContact C-N 3.34Å; L649-T651 PolarHBondContact O-N 2.89Å; L649-V652 PolarHBondContact O-N 3.3Å; L649-V653 HydrophobicContact CD2-CG2 4.49Å; L649-V653 VanDerWaalsContact O-CB 3.25Å; L649-V653 WeakPolarHBondContact O-CB 3.12Å; L649-V653 WeakPolarHBondContact O-CG2 2.92Å; L649-V653 PolarHBondContact O-N 3.47Å
650	C	61.6	Low	60.3	Low	48 Å²	48	95.3 Å²	95.3	32%	0.324	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-34.9	175.1	-74.5	0	0	0	0	112.6	F646 K654	F646-C650 WeakPolarHBondContact CE1-SG 3.39Å; F646-C650 VanDerWaalsContact O-CB 3.29Å; F646-C650 WeakPolarHBondContact O-CB 3.44Å; F646-C650 PolarHBondContact O-N 3.35Å; F646-C650 PolarHBondContact O-SG 3.49Å; F646-C650 VanDerWaalsContact O-SG 3.33Å; C650-K654 WeakPolarHBondContact O-CA 3.37Å; C650-K654 WeakPolarHBondContact O-CB 3.43Å; C650-K654 PolarHBondContact O-N 2.99Å
651	T	61.2	Low	61.8	Low	69 Å²	69	94.3 Å²	94.3	42%	0.423	53%	0.534	S	S	.	.	H	α-helix	trans	-77	-37.1	177.9	46.2	0	0	0	0	112.7	L647 L648 L649 K655	L647-T651 WeakPolarHBondContact O-CB 3.22Å; L647-T651 VanDerWaalsContact O-CG2 3.28Å; L647-T651 WeakPolarHBondContact O-CG2 3.33Å; L647-T651 PolarHBondContact O-N 3.42Å; L647-T651 PolarHBondContact O-OG1 3.49Å; L648-T651 VanDerWaalsContact CA-OG1 3.27Å; L648-T651 WeakPolarHBondContact CA-OG1 3.47Å; L648-T651 PolarHBondContact O-N 2.83Å; L648-T651 PolarHBondContact O-OG1 3.31Å; L649-T651 VanDerWaalsContact C-N 3.34Å; L649-T651 PolarHBondContact O-N 2.89Å; T651-K655 WeakPolarHBondContact O-CB 3.37Å; T651-K655 PolarHBondContact O-N 3.22Å
652	V	62.8	Low	63.7	Low	88 Å²	88	90.5 Å²	90.5	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-46.6	173	173.6	0	0	0	0	110.4	L648 L649 K654 K655 V656	L648-V652 WeakPolarHBondContact O-CB 3.42Å; L648-V652 VanDerWaalsContact O-CG2 3.23Å; L648-V652 WeakPolarHBondContact O-CG2 3.37Å; L648-V652 PolarHBondContact O-N 3.47Å; L649-V652 PolarHBondContact O-N 3.3Å; V652-K654 VanDerWaalsContact C-N 3.35Å; V652-K654 PolarHBondContact O-N 3.34Å; V652-K655 PolarHBondContact O-N 3.31Å; V652-K655 VanDerWaalsContact O-N 3.13Å; V652-V656 HydrophobicContact CG1-CG2 4.29Å; V652-V656 WeakPolarHBondContact O-CB 3.47Å; V652-V656 VanDerWaalsContact O-CG2 3.29Å; V652-V656 WeakPolarHBondContact O-CG2 3.47Å; V652-V656 PolarHBondContact O-N 3.4Å
653	V	61.9	Low	65.6	Low	51 Å²	51	93.4 Å²	93.4	31%	0.309	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-40.3	176.1	174.3	0	0	0	0	111	L649 K655 V656 V657 L662	L649-V653 HydrophobicContact CD2-CG2 4.49Å; L649-V653 VanDerWaalsContact O-CB 3.25Å; L649-V653 WeakPolarHBondContact O-CB 3.12Å; L649-V653 WeakPolarHBondContact O-CG2 2.92Å; L649-V653 PolarHBondContact O-N 3.47Å; V653-K655 VanDerWaalsContact C-N 3.27Å; V653-K655 PolarHBondContact O-N 3.05Å; V653-V656 PolarHBondContact O-N 3.36Å; V653-V657 HydrophobicContact CG1-CB 4.35Å; V653-V657 HydrophobicContact CG1-CG2 4.01Å; V653-V657 WeakPolarHBondContact O-CB 3.32Å; V653-V657 WeakPolarHBondContact O-CG2 3.15Å; V653-V657 PolarHBondContact O-N 3.04Å; V653-L662 HydrophobicContact CG1-CD1 3.87Å
654	K	62	Low	67.1	Low	119 Å²	119	94.6 Å²	94.6	52%	0.517	52%	0.516	S	S	.	.	H	α-helix	trans	-60.1	-35.7	173.6	175.7	172.9	171.1	170.6	0	112.3	C650 V652 W659	C650-K654 WeakPolarHBondContact O-CA 3.37Å; C650-K654 WeakPolarHBondContact O-CB 3.43Å; C650-K654 PolarHBondContact O-N 2.99Å; V652-K654 VanDerWaalsContact C-N 3.35Å; V652-K654 PolarHBondContact O-N 3.34Å; K654-W659 VanDerWaalsContact CE-NE1 3.26Å
655	K	66.2	Low	68.6	Low	193 Å²	193	94.6 Å²	94.6	84%	0.839	51%	0.511	S	S	*	.	H	α-helix	trans	-84	-28.1	-177.7	-151.5	178.1	-174.1	176.6	0	113.4	T651 V652 V653	T651-K655 WeakPolarHBondContact O-CB 3.37Å; T651-K655 PolarHBondContact O-N 3.22Å; V652-K655 PolarHBondContact O-N 3.31Å; V652-K655 VanDerWaalsContact O-N 3.13Å; V653-K655 VanDerWaalsContact C-N 3.27Å; V653-K655 PolarHBondContact O-N 3.05Å
656	V	66.7	Low	70.1	Confident	117 Å²	117	96.5 Å²	96.5	71%	0.709	51%	0.514	S	S	*	.	H	α-helix	trans	-94.1	-34	-176.4	176.1	0	0	0	0	112.5	V652 V653	V652-V656 HydrophobicContact CG1-CG2 4.29Å; V652-V656 WeakPolarHBondContact O-CB 3.47Å; V652-V656 VanDerWaalsContact O-CG2 3.29Å; V652-V656 WeakPolarHBondContact O-CG2 3.47Å; V652-V656 PolarHBondContact O-N 3.4Å; V653-V656 PolarHBondContact O-N 3.36Å
657	V	64.7	Low	71.3	Confident	67 Å²	67	91.6 Å²	91.6	41%	0.406	50%	0.503	S	S	.	.	H	α-helix	trans	-113.1	-19.7	-166	-160.3	0	0	0	0	112.9	V653 V661	V653-V657 HydrophobicContact CG1-CB 4.35Å; V653-V657 HydrophobicContact CG1-CG2 4.01Å; V653-V657 WeakPolarHBondContact O-CB 3.32Å; V653-V657 WeakPolarHBondContact O-CG2 3.15Å; V653-V657 PolarHBondContact O-N 3.04Å; V657-V661 HydrophobicContact CG1-CB 3.53Å; V657-V661 HydrophobicContact CG1-CG1 3.49Å; V657-V661 VanDerWaalsContact CG1-CG1 3.49Å; V657-V661 HydrophobicContact CG1-CG2 3.82Å; V657-V661 WeakPolarHBondContact O-CG2 3.27Å
658	G	69.9	Low	72.7	Confident	29 Å²	29	90.9 Å²	90.9	30%	0.299	50%	0.499	S	S	.	.	H	α-helix	trans	75.2	151	-177.7	0	0	0	0	0	113.4	P660 V661	G658-P660 VanDerWaalsContact C-N 3.33Å; G658-V661 PolarHBondContact O-N 3.47Å
659	W	77	Confident	74.2	Confident	153 Å²	153	89.9 Å²	89.9	58%	0.58	49%	0.488	S	S	*	.	H	α-helix	trans	-55.2	-33	179.2	-87.1	66.4	0	0	0	115.9	K654 V661 L662 I663	K654-W659 VanDerWaalsContact CE-NE1 3.26Å; W659-V661 VanDerWaalsContact C-N 3.33Å; W659-V661 PolarHBondContact O-N 3.41Å; W659-L662 PolarHBondContact O-N 3.38Å; W659-I663 HydrophobicContact CE3-CD1 4.31Å; W659-I663 WeakPolarHBondContact O-CG1 3.42Å; W659-I663 PolarHBondContact O-N 2.89Å
660	P	79.8	Confident	75.5	Confident	93 Å²	93	89.3 Å²	89.3	60%	0.604	48%	0.483	S	S	*	.	H	α-helix	trans	-59.1	-42.7	-179.1	-25.4	34.6	0	0	0	112.9	G658 L662 I663 T664	G658-P660 VanDerWaalsContact C-N 3.33Å; P660-L662 PolarHBondContact O-N 3.2Å; P660-I663 PolarHBondContact O-N 3.47Å; P660-T664 PolarHBondContact O-N 2.92Å; P660-T664 PolarHBondContact O-OG1 3.1Å
661	V	79.6	Confident	76.9	Confident	62 Å²	62	92.9 Å²	92.9	38%	0.376	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-37.1	-176	-179	0	0	0	0	111.8	V657 G658 W659 T664 I665	V657-V661 HydrophobicContact CG1-CB 3.53Å; V657-V661 HydrophobicContact CG1-CG1 3.49Å; V657-V661 VanDerWaalsContact CG1-CG1 3.49Å; V657-V661 HydrophobicContact CG1-CG2 3.82Å; V657-V661 WeakPolarHBondContact O-CG2 3.27Å; G658-V661 PolarHBondContact O-N 3.47Å; W659-V661 VanDerWaalsContact C-N 3.33Å; W659-V661 PolarHBondContact O-N 3.41Å; V661-T664 WeakPolarHBondContact O-CB 3.3Å; V661-T664 PolarHBondContact O-N 2.8Å; V661-I665 HydrophobicContact CG1-CD1 4.15Å; V661-I665 WeakPolarHBondContact O-CG1 3.4Å; V661-I665 PolarHBondContact O-N 3.19Å
662	L	78.8	Confident	78.1	Confident	78 Å²	78	91.6 Å²	91.6	41%	0.408	49%	0.49	S	S	.	.	H	α-helix	trans	-66.9	-39.8	178.8	-158.1	124.6	0	0	0	111.4	V653 W659 P660 I665 V666	V653-L662 HydrophobicContact CG1-CD1 3.87Å; W659-L662 PolarHBondContact O-N 3.38Å; P660-L662 PolarHBondContact O-N 3.2Å; L662-I665 PolarHBondContact O-N 3Å; L662-V666 WeakPolarHBondContact O-CG2 3.09Å; L662-V666 PolarHBondContact O-N 2.73Å; L662-V666 VanDerWaalsContact O-N 3.12Å
663	I	84.3	Confident	79.3	Confident	101 Å²	101	91.6 Å²	91.6	52%	0.518	48%	0.481	S	S	.	.	H	α-helix	trans	-63.9	-42.5	172.7	-66.6	169.8	0	0	0	110.3	W659 P660 I665 V666 A667	W659-I663 HydrophobicContact CE3-CD1 4.31Å; W659-I663 WeakPolarHBondContact O-CG1 3.42Å; W659-I663 PolarHBondContact O-N 2.89Å; P660-I663 PolarHBondContact O-N 3.47Å; I663-I665 VanDerWaalsContact C-N 3.34Å; I663-I665 PolarHBondContact O-N 3.44Å; I663-V666 PolarHBondContact O-N 2.94Å; I663-A667 VanDerWaalsContact O-CB 3.3Å; I663-A667 WeakPolarHBondContact O-CB 3.2Å; I663-A667 PolarHBondContact O-N 2.82Å
664	T	85.5	Confident	80.5	Confident	76 Å²	76	94.2 Å²	94.2	47%	0.466	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-41.8	176.9	-52.7	0	0	0	0	112	P660 V661 A667 I668	P660-T664 PolarHBondContact O-N 2.92Å; P660-T664 PolarHBondContact O-OG1 3.1Å; V661-T664 WeakPolarHBondContact O-CB 3.3Å; V661-T664 PolarHBondContact O-N 2.8Å; T664-A667 PolarHBondContact O-N 2.85Å; T664-I668 HydrophobicContact CG2-CD1 3.92Å; T664-I668 HydrophobicContact CG2-CG1 4.47Å; T664-I668 WeakPolarHBondContact O-CB 3.44Å; T664-I668 VanDerWaalsContact O-CG1 3.24Å; T664-I668 WeakPolarHBondContact O-CG1 3.4Å; T664-I668 PolarHBondContact O-N 3.24Å
665	I	85.1	Confident	81.8	Confident	108 Å²	108	96.1 Å²	96.1	55%	0.554	50%	0.498	S	S	*	.	H	α-helix	trans	-64.2	-45.4	177.6	-68.1	165.9	0	0	0	111.2	V661 L662 I663 I668 Y669	V661-I665 HydrophobicContact CG1-CD1 4.15Å; V661-I665 WeakPolarHBondContact O-CG1 3.4Å; V661-I665 PolarHBondContact O-N 3.19Å; L662-I665 PolarHBondContact O-N 3Å; I663-I665 VanDerWaalsContact C-N 3.34Å; I663-I665 PolarHBondContact O-N 3.44Å; I665-I668 PolarHBondContact O-N 2.9Å; I665-Y669 WeakPolarHBondContact O-CB 3.28Å; I665-Y669 PolarHBondContact O-N 3.17Å
666	V	85.6	Confident	82.7	Confident	79 Å²	79	89.2 Å²	89.2	48%	0.479	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-42.6	176.6	173.9	0	0	0	0	110.8	L662 I663 I668 Y669 E670	L662-V666 WeakPolarHBondContact O-CG2 3.09Å; L662-V666 PolarHBondContact O-N 2.73Å; L662-V666 VanDerWaalsContact O-N 3.12Å; I663-V666 PolarHBondContact O-N 2.94Å; V666-I668 PolarHBondContact O-N 2.97Å; V666-Y669 WeakPolarHBondContact O-CB 3.28Å; V666-Y669 PolarHBondContact O-N 3.41Å; V666-E670 HydrophobicContact CG1-CG 4.37Å; V666-E670 WeakPolarHBondContact O-CG 3.46Å; V666-E670 PolarHBondContact O-N 3.37Å
667	A	88.3	Confident	83.6	Confident	55 Å²	55	89.8 Å²	89.8	46%	0.455	46%	0.458	S	S	.	.	H	α-helix	trans	-62.9	-41	177.3	0	0	0	0	0	112.4	I663 T664 L671	I663-A667 VanDerWaalsContact O-CB 3.3Å; I663-A667 WeakPolarHBondContact O-CB 3.2Å; I663-A667 PolarHBondContact O-N 2.82Å; T664-A667 PolarHBondContact O-N 2.85Å; A667-L671 VanDerWaalsContact O-CB 3.23Å; A667-L671 WeakPolarHBondContact O-CB 3.45Å; A667-L671 PolarHBondContact O-N 3.28Å
668	I	89.4	Confident	84.4	Confident	100 Å²	100	92.8 Å²	92.8	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-64.2	-44.4	173.9	-68.8	166.5	0	0	0	110.4	T664 I665 V666 E670 L671 V672	T664-I668 HydrophobicContact CG2-CD1 3.92Å; T664-I668 HydrophobicContact CG2-CG1 4.47Å; T664-I668 WeakPolarHBondContact O-CB 3.44Å; T664-I668 VanDerWaalsContact O-CG1 3.24Å; T664-I668 WeakPolarHBondContact O-CG1 3.4Å; T664-I668 PolarHBondContact O-N 3.24Å; I665-I668 PolarHBondContact O-N 2.9Å; V666-I668 PolarHBondContact O-N 2.97Å; I668-E670 PolarHBondContact O-N 2.57Å; I668-L671 PolarHBondContact O-N 3.37Å; I668-V672 HydrophobicContact CG2-CG2 4.31Å; I668-V672 VanDerWaalsContact O-CG2 3.25Å; I668-V672 WeakPolarHBondContact O-CG2 3.48Å; I668-V672 PolarHBondContact O-N 3.49Å
669	Y	89	Confident	85.1	Confident	81 Å²	81	94.1 Å²	94.1	32%	0.318	48%	0.475	S	S	.	.	H	α-helix	trans	-58.9	-48.4	178.4	-174.2	-91.7	0	0	0	112.1	F579 L581 I665 V666 V672 Y673	F579-Y669 HydrophobicContact CD1-CE1 4.36Å; F579-Y669 HydrophobicContact CD1-CE2 4.34Å; F579-Y669 AromaticContact CD1-CZ 3.88Å; F579-Y669 HydrophobicContact CE1-CD1 4.34Å; F579-Y669 HydrophobicContact CE1-CD2 4.1Å; F579-Y669 AromaticContact CE1-CE1 3.85Å; F579-Y669 HydrophobicContact CE1-CE1 3.85Å; F579-Y669 AromaticContact CE1-CE2 3.59Å; F579-Y669 HydrophobicContact CE1-CE2 3.59Å; F579-Y669 HydrophobicContact CE1-CG 4.45Å; F579-Y669 AromaticContact CE1-CZ 3.44Å; F579-Y669 VanDerWaalsContact CE1-CZ 3.44Å; L581-Y669 HydrophobicContact CB-CE2 3.98Å; L581-Y669 WeakPolarHBondContact O-CE2 3.46Å; L581-Y669 PolarHBondContact O-OH 3.33Å; I665-Y669 WeakPolarHBondContact O-CB 3.28Å; I665-Y669 PolarHBondContact O-N 3.17Å; V666-Y669 WeakPolarHBondContact O-CB 3.28Å; V666-Y669 PolarHBondContact O-N 3.41Å; Y669-V672 PolarHBondContact O-N 3.19Å; Y669-Y673 PolarHBondContact O-N 3.42Å
670	E	85.8	Confident	85.6	Confident	108 Å²	108	90.7 Å²	90.7	51%	0.505	46%	0.462	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177	-70.7	-65.2	156.6	0	0	112.3	V666 I668 Y673 L674	V666-E670 HydrophobicContact CG1-CG 4.37Å; V666-E670 WeakPolarHBondContact O-CG 3.46Å; V666-E670 PolarHBondContact O-N 3.37Å; I668-E670 PolarHBondContact O-N 2.57Å; E670-Y673 PolarHBondContact O-N 3.22Å; E670-L674 WeakPolarHBondContact O-CB 3.42Å; E670-L674 PolarHBondContact O-N 3.21Å
671	L	90.7	Very high	85.8	Confident	124 Å²	124	90.2 Å²	90.2	65%	0.649	45%	0.454	S	S	*	.	H	α-helix	trans	-67.2	-39	178.3	-170	135	0	0	0	111.8	A667 I668 Y675	A667-L671 VanDerWaalsContact O-CB 3.23Å; A667-L671 WeakPolarHBondContact O-CB 3.45Å; A667-L671 PolarHBondContact O-N 3.28Å; I668-L671 PolarHBondContact O-N 3.37Å; L671-Y675 VanDerWaalsContact O-CB 3.28Å; L671-Y675 WeakPolarHBondContact O-CB 3.34Å; L671-Y675 PolarHBondContact O-N 3.18Å
672	V	87.6	Confident	85.9	Confident	41 Å²	41	91.7 Å²	91.7	25%	0.248	46%	0.46	C	S	.	.	H	α-helix	trans	-68.4	-38.9	174.1	178.7	0	0	0	0	110.7	F579 L581 I668 Y669 Y675 E676	F579-V672 HydrophobicContact CE2-CB 4.39Å; F579-V672 HydrophobicContact CE2-CG1 3.87Å; F579-V672 HydrophobicContact CZ-CB 4.15Å; F579-V672 HydrophobicContact CZ-CG1 3.92Å; L581-V672 HydrophobicContact CD1-CG1 4.05Å; I668-V672 HydrophobicContact CG2-CG2 4.31Å; I668-V672 VanDerWaalsContact O-CG2 3.25Å; I668-V672 WeakPolarHBondContact O-CG2 3.48Å; I668-V672 PolarHBondContact O-N 3.49Å; Y669-V672 PolarHBondContact O-N 3.19Å; V672-Y675 PolarHBondContact O-N 3.49Å; V672-E676 WeakPolarHBondContact O-CG 3.48Å; V672-E676 PolarHBondContact O-N 3.46Å
673	Y	87.7	Confident	86.1	Confident	88 Å²	88	96.8 Å²	96.8	35%	0.345	47%	0.474	S	S	.	.	H	α-helix	trans	-59.8	-48.9	173.2	179.7	-86.6	0	0	0	112.3	F577 F579 Y669 E670 E676 R677	F577-Y673 HydrophobicContact CE1-CD2 4.39Å; F577-Y673 AromaticContact CE1-CE2 3.73Å; F577-Y673 HydrophobicContact CE1-CE2 3.73Å; F577-Y673 AromaticContact CE1-CZ 3.91Å; F577-Y673 HydrophobicContact CZ-CE2 4.38Å; F579-Y673 HydrophobicContact CB-CD2 3.74Å; F579-Y673 HydrophobicContact CB-CE2 3.95Å; F579-Y673 AromaticContact CD1-CD2 3.78Å; F579-Y673 HydrophobicContact CD1-CD2 3.78Å; F579-Y673 AromaticContact CD2-CD2 3.72Å; F579-Y673 HydrophobicContact CD2-CD2 3.72Å; F579-Y673 HydrophobicContact CD2-CG 4.27Å; F579-Y673 HydrophobicContact CE1-CD2 4.27Å; F579-Y673 HydrophobicContact CE2-CD2 4.3Å; F579-Y673 HydrophobicContact CE2-CG 4.49Å; F579-Y673 VanDerWaalsContact CE2-N 3.29Å; F579-Y673 AromaticContact CG-CD2 3.48Å; F579-Y673 HydrophobicContact CG-CD2 3.48Å; F579-Y673 VanDerWaalsContact CG-CD2 3.48Å; F579-Y673 HydrophobicContact CG-CE2 4.2Å; F579-Y673 HydrophobicContact CG-CG 4.4Å; Y669-Y673 PolarHBondContact O-N 3.42Å; E670-Y673 PolarHBondContact O-N 3.22Å; Y673-E676 PolarHBondContact O-N 3.29Å; Y673-R677 WeakPolarHBondContact O-CB 3.44Å; Y673-R677 PolarHBondContact O-N 2.82Å
674	L	87.2	Confident	86.1	Confident	106 Å²	106	93 Å²	93	56%	0.555	46%	0.458	S	S	*	.	H	α-helix	trans	-63.9	-43	179	-161.8	82.4	0	0	0	111.1	E670 R677 L678	E670-L674 WeakPolarHBondContact O-CB 3.42Å; E670-L674 PolarHBondContact O-N 3.21Å; L674-R677 PolarHBondContact O-N 3.45Å; L674-L678 HydrophobicContact CD2-CD1 4.2Å; L674-L678 HydrophobicContact CG-CD1 3.99Å; L674-L678 HydrophobicContact CG-CG 4.45Å; L674-L678 WeakPolarHBondContact O-CB 3.27Å; L674-L678 VanDerWaalsContact O-CG 3.22Å; L674-L678 WeakPolarHBondContact O-CG 3.08Å; L674-L678 PolarHBondContact O-N 2.88Å
675	Y	88.7	Confident	86.1	Confident	159 Å²	159	91.6 Å²	91.6	62%	0.624	45%	0.445	S	S	*	.	H	α-helix	trans	-57.7	-51.1	175.7	176.6	-100.1	0	0	0	111.3	L671 V672 R677 L678 C679	L671-Y675 VanDerWaalsContact O-CB 3.28Å; L671-Y675 WeakPolarHBondContact O-CB 3.34Å; L671-Y675 PolarHBondContact O-N 3.18Å; V672-Y675 PolarHBondContact O-N 3.49Å; Y675-R677 PolarHBondContact O-N 2.97Å; Y675-L678 PolarHBondContact O-N 2.96Å; Y675-C679 WeakPolarHBondContact O-CB 3.25Å; Y675-C679 PolarHBondContact O-N 3.22Å; Y675-C679 PolarHBondContact O-SG 3.09Å
676	E	86.1	Confident	86.2	Confident	48 Å²	48	88.7 Å²	88.7	22%	0.224	43%	0.429	C	S	.	.	H	α-helix	trans	-63.1	-40.8	178.6	-75.2	-171.4	-176.7	0	0	112.6	F577 F579 S580 V672 Y673 L678 C679 W680	F577-E676 VanDerWaalsContact CE2-C 3.49Å; F577-E676 HydrophobicContact CE2-CB 3.96Å; F577-E676 HydrophobicContact CZ-CB 4.08Å; F579-E676 HydrophobicContact CD2-CB 4.28Å; F579-E676 HydrophobicContact CD2-CG 4.48Å; F579-E676 WeakPolarHBondContact CD2-OE2 2.98Å; F579-E676 HydrophobicContact CE2-CB 4.41Å; F579-E676 HydrophobicContact CE2-CG 4.3Å; F579-E676 WeakPolarHBondContact CE2-OE2 3.2Å; S580-E676 WeakPolarHBondContact CB-OE1 3.43Å; S580-E676 WeakPolarHBondContact CB-OE2 3.34Å; S580-E676 PolarHBondContact N-OE2 3.07Å; S580-E676 PolarHBondContact OG-OE1 3.08Å; S580-E676 PolarHBondContact OG-OE2 3.27Å; V672-E676 WeakPolarHBondContact O-CG 3.48Å; V672-E676 PolarHBondContact O-N 3.46Å; Y673-E676 PolarHBondContact O-N 3.29Å; E676-L678 PolarHBondContact O-N 3.3Å; E676-C679 PolarHBondContact O-N 3.26Å; E676-W680 PolarHBondContact O-N 3.3Å
677	R	83.9	Confident	86.3	Confident	129 Å²	129	93.7 Å²	93.7	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-65.9	-38.4	179.6	-171.4	68.7	179.8	-160	1.2	112	F577 Y673 L674 Y675 W680	F577-R677 HydrophobicContact CE1-CB 4.24Å; F577-R677 HydrophobicContact CE1-CG 4.48Å; F577-R677 VanDerWaalsContact CE2-CA 3.41Å; F577-R677 HydrophobicContact CE2-CB 4.03Å; F577-R677 HydrophobicContact CZ-CB 3.74Å; F577-R677 HydrophobicContact CZ-CG 4.39Å; Y673-R677 WeakPolarHBondContact O-CB 3.44Å; Y673-R677 PolarHBondContact O-N 2.82Å; L674-R677 PolarHBondContact O-N 3.45Å; Y675-R677 PolarHBondContact O-N 2.97Å; R677-W680 PolarHBondContact O-N 3.32Å
678	L	83.3	Confident	86.2	Confident	130 Å²	130	92 Å²	92	68%	0.681	43%	0.426	S	S	*	.	H	α-helix	trans	-73	-35.2	176.4	-70.6	171.8	0	0	0	112.1	L674 Y675 E676 W680	L674-L678 HydrophobicContact CD2-CD1 4.2Å; L674-L678 HydrophobicContact CG-CD1 3.99Å; L674-L678 HydrophobicContact CG-CG 4.45Å; L674-L678 WeakPolarHBondContact O-CB 3.27Å; L674-L678 VanDerWaalsContact O-CG 3.22Å; L674-L678 WeakPolarHBondContact O-CG 3.08Å; L674-L678 PolarHBondContact O-N 2.88Å; Y675-L678 PolarHBondContact O-N 2.96Å; E676-L678 PolarHBondContact O-N 3.3Å; L678-W680 PolarHBondContact O-N 2.83Å
679	C	84.3	Confident	86.2	Confident	57 Å²	57	87.2 Å²	87.2	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-72.5	-13.8	174.6	-71.1	0	0	0	0	113.3	Y675 E676 N681 A684	Y675-C679 WeakPolarHBondContact O-CB 3.25Å; Y675-C679 PolarHBondContact O-N 3.22Å; Y675-C679 PolarHBondContact O-SG 3.09Å; E676-C679 PolarHBondContact O-N 3.26Å; C679-N681 PolarHBondContact O-N 2.88Å; C679-A684 WeakPolarHBondContact O-CB 3.33Å
680	W	85.8	Confident	86.3	Confident	81 Å²	81	84.1 Å²	84.1	31%	0.307	39%	0.39	S	S	.	.			trans	-77.2	65.5	178	-158.6	-105.3	0	0	0	113	L575 F577 E676 R677 L678 A684 K685 A688	L575-W680 PolarHBondContact O-NE1 2.77Å; F577-W680 HydrophobicContact CB-CG 4.26Å; F577-W680 HydrophobicContact CD2-CB 3.75Å; F577-W680 HydrophobicContact CD2-CD2 4Å; F577-W680 HydrophobicContact CD2-CE3 4.44Å; F577-W680 AromaticContact CD2-CG 3.69Å; F577-W680 HydrophobicContact CD2-CG 3.69Å; F577-W680 HydrophobicContact CE2-CB 4.29Å; F577-W680 HydrophobicContact CG-CG 4.47Å; E676-W680 PolarHBondContact O-N 3.3Å; R677-W680 PolarHBondContact O-N 3.32Å; L678-W680 PolarHBondContact O-N 2.83Å; W680-A684 HydrophobicContact CE3-CB 4.22Å; W680-K685 HydrophobicContact CZ2-CG 4.45Å; W680-A688 HydrophobicContact CH2-CB 3.92Å; W680-A688 HydrophobicContact CZ2-CB 4.47Å
681	N	84.9	Confident	86.4	Confident	83 Å²	83	84.3 Å²	84.3	44%	0.444	39%	0.39	S	S	.	.	S	Bend	trans	-93.1	179.2	175.5	64.5	20.3	0	0	0	112.4	C679 R683 A684 K685	C679-N681 PolarHBondContact O-N 2.88Å; N681-R683 PolarHBondContact O-N 3.34Å; N681-R683 WeakPolarHBondContact OD1-CB 3.33Å; N681-R683 PolarHBondContact OD1-N 2.79Å; N681-A684 WeakPolarHBondContact O-CB 3.27Å; N681-A684 PolarHBondContact O-N 2.79Å; N681-A684 PolarHBondContact OD1-N 2.85Å; N681-K685 PolarHBondContact O-N 2.85Å
682	D	81.8	Confident	86.4	Confident	93 Å²	93	81 Å²	81	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-60.4	-30.3	-179.1	-65.6	-20.7	0	0	0	113.2	V487 K685 E686	V487-D682 WeakPolarHBondContact CG2-OD1 3.47Å; D682-K685 PolarHBondContact O-N 2.9Å; D682-E686 WeakPolarHBondContact O-CB 3.45Å; D682-E686 PolarHBondContact O-N 3.3Å
683	R	83.5	Confident	86.5	Confident	185 Å²	185	79.1 Å²	79.1	70%	0.698	36%	0.36	S	S	*	.	H	α-helix	trans	-69.6	-36.8	173	-70.1	-177	176.3	174.4	-1.5	112.5	N681 E686 R687	N681-R683 PolarHBondContact O-N 3.34Å; N681-R683 WeakPolarHBondContact OD1-CB 3.33Å; N681-R683 PolarHBondContact OD1-N 2.79Å; R683-E686 PolarHBondContact O-N 3.47Å; R683-R687 WeakPolarHBondContact O-CG 3.49Å; R683-R687 PolarHBondContact O-N 2.82Å
684	A	83.9	Confident	86.6	Confident	23 Å²	23	75.5 Å²	75.5	19%	0.19	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-39.2	174.3	0	0	0	0	0	111	C679 W680 N681 R687 A688	C679-A684 WeakPolarHBondContact O-CB 3.33Å; W680-A684 HydrophobicContact CE3-CB 4.22Å; N681-A684 WeakPolarHBondContact O-CB 3.27Å; N681-A684 PolarHBondContact O-N 2.79Å; N681-A684 PolarHBondContact OD1-N 2.85Å; A684-R687 PolarHBondContact O-N 3.24Å; A684-A688 WeakPolarHBondContact O-CB 3.33Å; A684-A688 PolarHBondContact O-N 2.76Å
685	K	86	Confident	86.6	Confident	45 Å²	45	75 Å²	75	20%	0.196	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-40.9	172.8	-69.2	177.6	-178.3	173.9	0	112.4	F485 V487 L575 W680 N681 D682 A688 F689	F485-K685 HydrophobicContact CE1-CB 3.89Å; F485-K685 HydrophobicContact CZ-CB 4.36Å; V487-K685 HydrophobicContact CG1-CD 4.2Å; V487-K685 HydrophobicContact CG2-CD 3.8Å; L575-K685 HydrophobicContact CD2-CB 4.43Å; W680-K685 HydrophobicContact CZ2-CG 4.45Å; N681-K685 PolarHBondContact O-N 2.85Å; D682-K685 PolarHBondContact O-N 2.9Å; K685-A688 PolarHBondContact O-N 3.4Å; K685-F689 WeakPolarHBondContact O-CB 3.49Å; K685-F689 PolarHBondContact O-N 3.02Å
686	E	86.8	Confident	86.6	Confident	47 Å²	47	69.3 Å²	69.3	22%	0.22	32%	0.324	C	S	.	.	H	α-helix	trans	-60.5	-47.6	174.9	-174.1	-172.3	158.5	0	0	111.3	F485 D682 R683 A688 F689 K690	F485-E686 HydrophobicContact CB-CB 4.08Å; F485-E686 HydrophobicContact CB-CG 3.74Å; F485-E686 HydrophobicContact CD1-CB 3.58Å; F485-E686 HydrophobicContact CD1-CG 4.15Å; F485-E686 HydrophobicContact CD2-CB 4.03Å; F485-E686 HydrophobicContact CD2-CG 3.81Å; F485-E686 HydrophobicContact CE1-CB 3.93Å; F485-E686 HydrophobicContact CE2-CB 4.34Å; F485-E686 HydrophobicContact CE2-CG 4.42Å; F485-E686 HydrophobicContact CG-CB 3.63Å; F485-E686 HydrophobicContact CG-CG 3.64Å; F485-E686 HydrophobicContact CZ-CB 4.28Å; D682-E686 WeakPolarHBondContact O-CB 3.45Å; D682-E686 PolarHBondContact O-N 3.3Å; R683-E686 PolarHBondContact O-N 3.47Å; E686-A688 VanDerWaalsContact C-N 3.34Å; E686-A688 PolarHBondContact O-N 2.89Å; E686-F689 WeakPolarHBondContact O-CB 3.47Å; E686-F689 PolarHBondContact O-N 3.48Å; E686-K690 HydrophobicContact CG-CD 4.14Å; E686-K690 WeakPolarHBondContact O-CB 3.43Å; E686-K690 WeakPolarHBondContact O-CG 3.49Å; E686-K690 PolarHBondContact O-N 3.45Å; E686-K690 WeakPolarHBondContact OE1-CE 3.36Å; E686-K690 IonicContact OE1-NZ 3.05Å; E686-K690 PolarHBondContact OE1-NZ 3.21Å
687	R	86.6	Confident	86.7	Confident	184 Å²	184	67.1 Å²	67.1	69%	0.694	31%	0.314	S	S	*	.	H	α-helix	trans	-61.9	-41.8	176.1	-72.8	178	-174.7	168	-0.8	112	R683 A684 H691	R683-R687 WeakPolarHBondContact O-CG 3.49Å; R683-R687 PolarHBondContact O-N 2.82Å; A684-R687 PolarHBondContact O-N 3.24Å; R687-H691 VanDerWaalsContact O-CB 3.26Å; R687-H691 WeakPolarHBondContact O-CB 3.25Å; R687-H691 PolarHBondContact O-N 3.13Å
688	A	86.2	Confident	86.9	Confident	20 Å²	20	61.7 Å²	61.7	17%	0.165	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-42.7	176.4	0	0	0	0	0	111.8	W680 A684 K685 E686 H691 Q692	W680-A688 HydrophobicContact CH2-CB 3.92Å; W680-A688 HydrophobicContact CZ2-CB 4.47Å; A684-A688 WeakPolarHBondContact O-CB 3.33Å; A684-A688 PolarHBondContact O-N 2.76Å; K685-A688 PolarHBondContact O-N 3.4Å; E686-A688 VanDerWaalsContact C-N 3.34Å; E686-A688 PolarHBondContact O-N 2.89Å; A688-H691 PolarHBondContact O-N 3.17Å; A688-Q692 WeakPolarHBondContact O-CB 3.49Å; A688-Q692 VanDerWaalsContact O-CG 3.24Å; A688-Q692 WeakPolarHBondContact O-CG 3.31Å; A688-Q692 PolarHBondContact O-N 3.35Å
689	F	90.2	Very high	87.1	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-53.7	174.3	178.1	-87.1	0	0	0	111.2	F485 M492 Y495 K496 L499 F571 E573 L575 K685 E686 H691 Q692 F693	F485-F689 HydrophobicContact CE2-CB 3.86Å; F485-F689 HydrophobicContact CE2-CD1 4.26Å; F485-F689 HydrophobicContact CE2-CD2 4.41Å; F485-F689 AromaticContact CE2-CG 3.92Å; F485-F689 HydrophobicContact CE2-CG 3.92Å; F485-F689 HydrophobicContact CZ-CB 4.04Å; F485-F689 HydrophobicContact CZ-CG 4.48Å; M492-F689 HydrophobicContact SD-CD2 4.15Å; M492-F689 HydrophobicContact SD-CE2 4.05Å; Y495-F689 HydrophobicContact CD1-CE1 4.09Å; Y495-F689 HydrophobicContact CD1-CZ 4.34Å; Y495-F689 HydrophobicContact CE1-CD1 4.08Å; Y495-F689 AromaticContact CE1-CE1 3.69Å; Y495-F689 HydrophobicContact CE1-CE1 3.69Å; Y495-F689 HydrophobicContact CE1-CZ 4.39Å; K496-F689 HydrophobicContact CB-CZ 4.23Å; K496-F689 HydrophobicContact CG-CZ 4.47Å; L499-F689 HydrophobicContact CD2-CE1 3.99Å; F571-F689 HydrophobicContact CE1-CD2 4.39Å; F571-F689 AromaticContact CE1-CE2 3.72Å; F571-F689 HydrophobicContact CE1-CE2 3.72Å; F571-F689 AromaticContact CE1-CZ 3.86Å; F571-F689 HydrophobicContact CE1-CZ 3.86Å; F571-F689 HydrophobicContact CZ-CE2 4.41Å; E573-F689 HydrophobicContact CB-CD2 3.69Å; E573-F689 HydrophobicContact CB-CE2 3.92Å; E573-F689 HydrophobicContact CG-CD2 4.3Å; E573-F689 HydrophobicContact CG-CE2 4.37Å; L575-F689 HydrophobicContact CD2-CB 4.07Å; K685-F689 WeakPolarHBondContact O-CB 3.49Å; K685-F689 PolarHBondContact O-N 3.02Å; E686-F689 WeakPolarHBondContact O-CB 3.47Å; E686-F689 PolarHBondContact O-N 3.48Å; F689-H691 VanDerWaalsContact C-N 3.3Å; F689-H691 PolarHBondContact O-N 3.22Å; F689-Q692 PolarHBondContact O-N 3.04Å; F689-F693 HydrophobicContact CE1-CB 4.39Å; F689-F693 VanDerWaalsContact O-CB 3.29Å; F689-F693 WeakPolarHBondContact O-CB 3.34Å; F689-F693 PolarHBondContact O-N 3.27Å
690	K	90.4	Very high	87.3	Confident	16 Å²	16	62 Å²	62	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-58.2	-43.7	-179.4	-75.8	176.9	167.9	177.3	0	110.8	V478 E479 Y481 Y495 E686 F693 C694	V478-K690 HydrophobicContact CG1-CB 4.02Å; V478-K690 HydrophobicContact CG1-CG 3.94Å; V478-K690 VanDerWaalsContact O-CD 3.31Å; V478-K690 WeakPolarHBondContact O-CD 3.42Å; V478-K690 WeakPolarHBondContact O-CE 3.49Å; V478-K690 PolarHBondContact O-NZ 2.94Å; E479-K690 PolarHBondContact O-NZ 3.07Å; Y481-K690 PolarHBondContact O-NZ 3.32Å; Y495-K690 VanDerWaalsContact OH-CE 3.32Å; Y495-K690 WeakPolarHBondContact OH-CE 3.4Å; E686-K690 HydrophobicContact CG-CD 4.14Å; E686-K690 WeakPolarHBondContact O-CB 3.43Å; E686-K690 WeakPolarHBondContact O-CG 3.49Å; E686-K690 PolarHBondContact O-N 3.45Å; E686-K690 WeakPolarHBondContact OE1-CE 3.36Å; E686-K690 IonicContact OE1-NZ 3.05Å; E686-K690 PolarHBondContact OE1-NZ 3.21Å; K690-F693 PolarHBondContact O-N 3.17Å; K690-C694 WeakPolarHBondContact O-CB 3.34Å; K690-C694 PolarHBondContact O-N 3.4Å; K690-C694 PolarHBondContact O-SG 3.46Å
691	H	89.1	Confident	87.2	Confident	112 Å²	112	58.4 Å²	58.4	52%	0.519	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-46.5	177	-167.9	60.1	0	0	0	112.7	R687 A688 F689 F693 C694 D695	R687-H691 VanDerWaalsContact O-CB 3.26Å; R687-H691 WeakPolarHBondContact O-CB 3.25Å; R687-H691 PolarHBondContact O-N 3.13Å; A688-H691 PolarHBondContact O-N 3.17Å; F689-H691 VanDerWaalsContact C-N 3.3Å; F689-H691 PolarHBondContact O-N 3.22Å; H691-F693 VanDerWaalsContact C-N 3.28Å; H691-F693 PolarHBondContact O-N 3.16Å; H691-C694 PolarHBondContact O-N 3.15Å; H691-D695 IonicContact CD2-OD2 2.75Å; H691-D695 IonicContact NE2-OD2 2.72Å; H691-D695 WeakPolarHBondContact O-CB 3.36Å; H691-D695 PolarHBondContact O-N 3.13Å
692	Q	89.6	Confident	87.2	Confident	55 Å²	55	60.8 Å²	60.8	26%	0.257	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-39.1	175	-73.6	173.3	20.1	0	0	111.9	F571 D574 A688 F689 H696	F571-Q692 HydrophobicContact CE2-CB 4.13Å; F571-Q692 WeakPolarHBondContact CE2-O 3.31Å; F571-Q692 HydrophobicContact CZ-CB 4.13Å; D574-Q692 PolarHBondContact O-NE2 3.26Å; A688-Q692 WeakPolarHBondContact O-CB 3.49Å; A688-Q692 VanDerWaalsContact O-CG 3.24Å; A688-Q692 WeakPolarHBondContact O-CG 3.31Å; A688-Q692 PolarHBondContact O-N 3.35Å; F689-Q692 PolarHBondContact O-N 3.04Å; Q692-H696 WeakPolarHBondContact O-CB 3.48Å; Q692-H696 PolarHBondContact O-N 2.83Å
693	F	91	Very high	87.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-48.8	177.3	179.6	-90.1	0	0	0	111.1	V478 L499 I500 V503 L568 F571 F689 K690 H691 D695 H696 L697	V478-F693 HydrophobicContact CG1-CD1 4.05Å; V478-F693 HydrophobicContact CG2-CD1 4.16Å; V478-F693 HydrophobicContact CG2-CE1 4Å; L499-F693 HydrophobicContact CD2-CD1 3.97Å; L499-F693 HydrophobicContact CD2-CD2 4.2Å; L499-F693 HydrophobicContact CD2-CE1 3.9Å; L499-F693 HydrophobicContact CD2-CE2 4.13Å; L499-F693 HydrophobicContact CD2-CG 4.11Å; L499-F693 HydrophobicContact CD2-CZ 3.98Å; L499-F693 HydrophobicContact CG-CE1 4.08Å; L499-F693 HydrophobicContact CG-CE2 4.43Å; L499-F693 HydrophobicContact CG-CZ 3.96Å; I500-F693 HydrophobicContact CG1-CE2 3.8Å; I500-F693 HydrophobicContact CG1-CZ 4.17Å; V503-F693 HydrophobicContact CG2-CE1 4.05Å; V503-F693 HydrophobicContact CG2-CZ 4.26Å; L568-F693 HydrophobicContact CD1-CE2 3.95Å; L568-F693 HydrophobicContact CD1-CZ 3.78Å; F571-F693 HydrophobicContact CD1-CD2 4.09Å; F571-F693 HydrophobicContact CE1-CB 4.19Å; F571-F693 AromaticContact CE1-CD2 3.91Å; F571-F693 HydrophobicContact CE1-CD2 3.91Å; F571-F693 HydrophobicContact CE2-CB 4.37Å; F571-F693 HydrophobicContact CZ-CB 3.82Å; F571-F693 HydrophobicContact CZ-CD2 4.3Å; F689-F693 HydrophobicContact CE1-CB 4.39Å; F689-F693 VanDerWaalsContact O-CB 3.29Å; F689-F693 WeakPolarHBondContact O-CB 3.34Å; F689-F693 PolarHBondContact O-N 3.27Å; K690-F693 PolarHBondContact O-N 3.17Å; H691-F693 VanDerWaalsContact C-N 3.28Å; H691-F693 PolarHBondContact O-N 3.16Å; F693-D695 PolarHBondContact O-N 3.04Å; F693-H696 PolarHBondContact O-N 3.02Å; F693-L697 HydrophobicContact CD1-CD2 4.44Å; F693-L697 HydrophobicContact CE1-CD2 3.8Å; F693-L697 HydrophobicContact CZ-CD2 4.41Å; F693-L697 WeakPolarHBondContact O-CB 3.4Å; F693-L697 PolarHBondContact O-N 3.42Å
694	C	89.8	Confident	87.6	Confident	13 Å²	13	55 Å²	55	9%	0.088	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-40.8	176.3	-68.3	0	0	0	0	112.3	D475 K690 H691 G698	D475-C694 VanDerWaalsContact OD1-CB 3.31Å; D475-C694 WeakPolarHBondContact OD1-CB 3.21Å; D475-C694 PolarHBondContact OD1-SG 3.16Å; K690-C694 WeakPolarHBondContact O-CB 3.34Å; K690-C694 PolarHBondContact O-N 3.4Å; K690-C694 PolarHBondContact O-SG 3.46Å; H691-C694 PolarHBondContact O-N 3.15Å; C694-G698 PolarHBondContact O-N 3.15Å
695	D	87.4	Confident	87.8	Confident	94 Å²	94	55 Å²	55	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-45.2	176	-80.3	-13.7	0	0	0	111.7	H691 F693 G698 Y699	H691-D695 IonicContact CD2-OD2 2.75Å; H691-D695 IonicContact NE2-OD2 2.72Å; H691-D695 WeakPolarHBondContact O-CB 3.36Å; H691-D695 PolarHBondContact O-N 3.13Å; F693-D695 PolarHBondContact O-N 3.04Å; D695-G698 PolarHBondContact O-N 3.22Å; D695-Y699 WeakPolarHBondContact O-CB 3.34Å; D695-Y699 PolarHBondContact O-N 2.88Å
696	H	88.6	Confident	87.8	Confident	41 Å²	41	56.8 Å²	56.8	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-44.2	179	-170.7	72	0	0	0	111.7	D570 F571 Q692 F693 Y699 K700	D570-H696 IonicContact OD1-CE1 3Å; D570-H696 PolarHBondContact OD1-CE1 3.34Å; D570-H696 IonicContact OD1-NE2 3.65Å; D570-H696 PolarHBondContact OD1-NE2 3.48Å; D570-H696 IonicContact OD2-CE1 2.78Å; D570-H696 IonicContact OD2-NE2 3.84Å; F571-H696 HydrophobicContact CD2-CB 3.68Å; F571-H696 AromaticContact CD2-CD2 3.71Å; F571-H696 AromaticContact CD2-CG 3.74Å; F571-H696 HydrophobicContact CE2-CB 4.01Å; Q692-H696 WeakPolarHBondContact O-CB 3.48Å; Q692-H696 PolarHBondContact O-N 2.83Å; F693-H696 PolarHBondContact O-N 3.02Å; H696-Y699 PolarHBondContact O-N 3.14Å; H696-K700 VanDerWaalsContact CE1-CE 3.43Å; H696-K700 WeakPolarHBondContact CE1-CE 3.08Å; H696-K700 WeakPolarHBondContact O-CB 3.5Å; H696-K700 VanDerWaalsContact O-CG 3.3Å; H696-K700 WeakPolarHBondContact O-CG 3.35Å; H696-K700 PolarHBondContact O-N 3.4Å
697	L	88.4	Confident	87.9	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-45.9	174.7	177.6	56.7	0	0	0	111.4	L474 V503 L568 F693 Y699 K700 V701	L474-L697 HydrophobicContact CD2-CD2 3.36Å; L474-L697 HydrophobicContact CD2-CG 4.07Å; L474-L697 HydrophobicContact CG-CD2 4.13Å; V503-L697 HydrophobicContact CG1-CD1 4.4Å; V503-L697 HydrophobicContact CG1-CD2 3.72Å; L568-L697 HydrophobicContact CD1-CD1 4.03Å; L568-L697 HydrophobicContact CD2-CB 4.05Å; L568-L697 HydrophobicContact CD2-CD1 4.01Å; L568-L697 HydrophobicContact CG-CD1 4.32Å; F693-L697 HydrophobicContact CD1-CD2 4.44Å; F693-L697 HydrophobicContact CE1-CD2 3.8Å; F693-L697 HydrophobicContact CZ-CD2 4.41Å; F693-L697 WeakPolarHBondContact O-CB 3.4Å; F693-L697 PolarHBondContact O-N 3.42Å; L697-Y699 PolarHBondContact O-N 2.93Å; L697-K700 PolarHBondContact O-N 3.44Å; L697-V701 HydrophobicContact CD1-CG2 3.53Å; L697-V701 HydrophobicContact CG-CG2 4.27Å; L697-V701 VanDerWaalsContact O-CB 3.29Å; L697-V701 WeakPolarHBondContact O-CB 3.42Å; L697-V701 VanDerWaalsContact O-CG2 3.25Å; L697-V701 WeakPolarHBondContact O-CG2 3.42Å; L697-V701 PolarHBondContact O-N 3.49Å
698	G	87.3	Confident	88	Confident	15 Å²	15	50 Å²	50	16%	0.155	26%	0.256	C	S	.	.	H	α-helix	trans	-57.7	-46.1	175.2	0	0	0	0	0	112.4	M471 C694 D695 K702	M471-G698 WeakPolarHBondContact SD-CA 3.43Å; C694-G698 PolarHBondContact O-N 3.15Å; D695-G698 PolarHBondContact O-N 3.22Å; G698-K702 WeakPolarHBondContact O-CB 3.42Å; G698-K702 PolarHBondContact O-N 3.08Å
699	Y	87.4	Confident	88.2	Confident	152 Å²	152	49.2 Å²	49.2	60%	0.596	25%	0.249	S	C	*	.	H	α-helix	trans	-62.4	-47.2	176.4	176.7	-104.4	0	0	0	112.6	D695 H696 L697 L703	D695-Y699 WeakPolarHBondContact O-CB 3.34Å; D695-Y699 PolarHBondContact O-N 2.88Å; H696-Y699 PolarHBondContact O-N 3.14Å; L697-Y699 PolarHBondContact O-N 2.93Å; Y699-L703 PolarHBondContact O-N 3.39Å; Y699-L703 VanDerWaalsContact O-N 3.15Å
700	K	88	Confident	88.2	Confident	42 Å²	42	52.6 Å²	52.6	18%	0.183	27%	0.265	C	S	.	.	H	α-helix	trans	-69.3	-44.2	-177.2	-70.6	-69.9	-170.9	173.7	0	112.8	L567 D570 H696 L697 K702 L703 L704	L567-K700 HydrophobicContact CB-CB 4.38Å; L567-K700 HydrophobicContact CD2-CB 4.13Å; D570-K700 IonicContact OD1-NZ 3.6Å; D570-K700 WeakPolarHBondContact OD2-CE 3.41Å; D570-K700 IonicContact OD2-NZ 2.88Å; D570-K700 PolarHBondContact OD2-NZ 2.9Å; H696-K700 VanDerWaalsContact CE1-CE 3.43Å; H696-K700 WeakPolarHBondContact CE1-CE 3.08Å; H696-K700 WeakPolarHBondContact O-CB 3.5Å; H696-K700 VanDerWaalsContact O-CG 3.3Å; H696-K700 WeakPolarHBondContact O-CG 3.35Å; H696-K700 PolarHBondContact O-N 3.4Å; L697-K700 PolarHBondContact O-N 3.44Å; K700-K702 VanDerWaalsContact C-N 3.32Å; K700-L703 WeakPolarHBondContact O-CB 3.41Å; K700-L703 PolarHBondContact O-N 2.93Å; K700-L704 PolarHBondContact O-N 3.28Å
701	V	85	Confident	88.1	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-38.2	177.5	171.9	0	0	0	0	110.5	F467 M471 V562 L697 L703 L704 E705	F467-V701 HydrophobicContact CD1-CG1 3.86Å; F467-V701 HydrophobicContact CE1-CG1 3.64Å; M471-V701 HydrophobicContact CE-CB 3.54Å; M471-V701 HydrophobicContact CE-CG1 3.52Å; M471-V701 HydrophobicContact CE-CG2 4.13Å; V562-V701 HydrophobicContact CG1-CG2 4.49Å; L697-V701 HydrophobicContact CD1-CG2 3.53Å; L697-V701 HydrophobicContact CG-CG2 4.27Å; L697-V701 VanDerWaalsContact O-CB 3.29Å; L697-V701 WeakPolarHBondContact O-CB 3.42Å; L697-V701 VanDerWaalsContact O-CG2 3.25Å; L697-V701 WeakPolarHBondContact O-CG2 3.42Å; L697-V701 PolarHBondContact O-N 3.49Å; V701-L703 VanDerWaalsContact C-N 3.28Å; V701-L703 PolarHBondContact O-N 3.32Å; V701-L704 CarbonylContact O-C 3.55Å; V701-L704 PolarHBondContact O-N 2.9Å; V701-L704 VanDerWaalsContact O-N 3.08Å; V701-E705 PolarHBondContact O-N 3.01Å
702	K	84.9	Confident	88.2	Confident	133 Å²	133	49.2 Å²	49.2	58%	0.578	25%	0.254	S	S	*	.	H	α-helix	trans	-65.1	-30.3	175.6	-170	167	-170.4	164.8	0	113.3	G698 K700 L704 E705	G698-K702 WeakPolarHBondContact O-CB 3.42Å; G698-K702 PolarHBondContact O-N 3.08Å; K700-K702 VanDerWaalsContact C-N 3.32Å; K702-L704 VanDerWaalsContact C-N 3.33Å; K702-E705 WeakPolarHBondContact O-CB 3.37Å; K702-E705 PolarHBondContact O-N 3.42Å
703	L	85.7	Confident	88.2	Confident	117 Å²	117	49.5 Å²	49.5	61%	0.613	25%	0.252	S	S	*	.	H	α-helix	trans	-65.4	-39.3	171.8	-170.8	67.7	0	0	0	111.3	Y699 K700 V701 S706	Y699-L703 PolarHBondContact O-N 3.39Å; Y699-L703 VanDerWaalsContact O-N 3.15Å; K700-L703 WeakPolarHBondContact O-CB 3.41Å; K700-L703 PolarHBondContact O-N 2.93Å; V701-L703 VanDerWaalsContact C-N 3.28Å; V701-L703 PolarHBondContact O-N 3.32Å; L703-S706 PolarHBondContact O-OG 3.31Å
704	L	87.1	Confident	88.1	Confident	39 Å²	39	54.5 Å²	54.5	20%	0.204	28%	0.275	C	S	.	.	H	α-helix	trans	-78.5	-19.8	179.1	-167.8	65.1	0	0	0	113.6	V562 L567 K700 V701 K702 S706 T707 I708	V562-L704 HydrophobicContact CG1-CD2 4.19Å; L567-L704 HydrophobicContact CD1-CD2 4.05Å; K700-L704 PolarHBondContact O-N 3.28Å; V701-L704 CarbonylContact O-C 3.55Å; V701-L704 PolarHBondContact O-N 2.9Å; V701-L704 VanDerWaalsContact O-N 3.08Å; K702-L704 VanDerWaalsContact C-N 3.33Å; L704-S706 VanDerWaalsContact C-N 3.26Å; L704-S706 PolarHBondContact O-N 3.27Å; L704-T707 PolarHBondContact O-N 3.22Å; L704-I708 HydrophobicContact CD2-CD1 3.69Å; L704-I708 HydrophobicContact CD2-CG1 4.44Å; L704-I708 HydrophobicContact CG-CD1 3.75Å; L704-I708 HydrophobicContact CG-CG1 4.11Å; L704-I708 PolarHBondContact O-N 3Å; L704-I708 VanDerWaalsContact O-N 3.1Å
705	E	88.4	Confident	88.1	Confident	25 Å²	25	55.6 Å²	55.6	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-48	-49.1	179.6	-174.9	-171.7	163.3	0	0	111.4	S464 F467 V701 K702 T707 I708 V709	S464-E705 WeakPolarHBondContact CA-OE1 3.47Å; S464-E705 WeakPolarHBondContact CB-OE1 3.47Å; S464-E705 PolarHBondContact OG-OE1 2.8Å; F467-E705 HydrophobicContact CB-CG 4.28Å; F467-E705 HydrophobicContact CD1-CB 4.27Å; F467-E705 HydrophobicContact CD1-CG 4.14Å; F467-E705 HydrophobicContact CD2-CG 4.37Å; F467-E705 HydrophobicContact CE1-CB 4.41Å; F467-E705 HydrophobicContact CG-CG 4.01Å; V701-E705 PolarHBondContact O-N 3.01Å; K702-E705 WeakPolarHBondContact O-CB 3.37Å; K702-E705 PolarHBondContact O-N 3.42Å; E705-T707 VanDerWaalsContact C-N 3.29Å; E705-T707 PolarHBondContact O-N 3.28Å; E705-I708 PolarHBondContact O-N 3.34Å; E705-V709 HydrophobicContact CG-CG2 4.14Å; E705-V709 VanDerWaalsContact O-CB 3.28Å; E705-V709 WeakPolarHBondContact O-CB 3.42Å; E705-V709 WeakPolarHBondContact O-CG2 3.23Å; E705-V709 PolarHBondContact O-N 3.28Å
706	S	86.8	Confident	88.2	Confident	82 Å²	82	51.1 Å²	51.1	57%	0.573	26%	0.255	S	S	*	.	H	α-helix	trans	-59	-37.7	-179.1	66.1	0	0	0	0	113.5	L703 L704 E710	L703-S706 PolarHBondContact O-OG 3.31Å; L704-S706 VanDerWaalsContact C-N 3.26Å; L704-S706 PolarHBondContact O-N 3.27Å; S706-E710 WeakPolarHBondContact O-CB 3.27Å; S706-E710 PolarHBondContact O-N 2.56Å; S706-E710 VanDerWaalsContact O-N 3.11Å
707	T	89	Confident	88.1	Confident	79 Å²	79	50.5 Å²	50.5	49%	0.485	26%	0.257	S	S	.	.	H	α-helix	trans	-73.3	-41	179.9	-50.4	0	0	0	0	111.6	L704 E705 E710 T711	L704-T707 PolarHBondContact O-N 3.22Å; E705-T707 VanDerWaalsContact C-N 3.29Å; E705-T707 PolarHBondContact O-N 3.28Å; T707-E710 PolarHBondContact O-N 2.92Å; T707-T711 WeakPolarHBondContact O-CB 3.24Å; T707-T711 PolarHBondContact O-N 3Å; T707-T711 PolarHBondContact O-OG1 2.86Å
708	I	88.5	Confident	88.1	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-70.9	-44	179.4	-69.1	170.1	0	0	0	110.4	F467 F560 V562 L704 E705 E710 T711 C712	F467-I708 HydrophobicContact CE1-CD1 4.47Å; F467-I708 HydrophobicContact CE2-CB 4.19Å; F467-I708 HydrophobicContact CE2-CG2 3.73Å; F467-I708 HydrophobicContact CZ-CB 4.01Å; F467-I708 HydrophobicContact CZ-CD1 3.67Å; F467-I708 HydrophobicContact CZ-CG1 4.43Å; F467-I708 HydrophobicContact CZ-CG2 3.9Å; F560-I708 HydrophobicContact CB-CG2 4.48Å; F560-I708 HydrophobicContact CD1-CG2 4.13Å; F560-I708 HydrophobicContact CD2-CD1 4.16Å; F560-I708 HydrophobicContact CD2-CG1 4.39Å; F560-I708 HydrophobicContact CD2-CG2 3.6Å; F560-I708 HydrophobicContact CE1-CG2 4.27Å; F560-I708 HydrophobicContact CE2-CG2 3.75Å; F560-I708 HydrophobicContact CG-CG2 3.81Å; F560-I708 HydrophobicContact CZ-CG2 4.09Å; V562-I708 HydrophobicContact CG2-CD1 3.76Å; L704-I708 HydrophobicContact CD2-CD1 3.69Å; L704-I708 HydrophobicContact CD2-CG1 4.44Å; L704-I708 HydrophobicContact CG-CD1 3.75Å; L704-I708 HydrophobicContact CG-CG1 4.11Å; L704-I708 PolarHBondContact O-N 3Å; L704-I708 VanDerWaalsContact O-N 3.1Å; E705-I708 PolarHBondContact O-N 3.34Å; I708-E710 VanDerWaalsContact C-N 3.27Å; I708-E710 PolarHBondContact O-N 3.2Å; I708-T711 WeakPolarHBondContact O-CB 3.36Å; I708-T711 PolarHBondContact O-N 3.15Å; I708-T711 VanDerWaalsContact O-N 3.1Å; I708-C712 PolarHBondContact O-N 2.84Å; I708-C712 PolarHBondContact O-SG 2.87Å
709	V	90.7	Very high	88	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.024	29%	0.291	C	S	.	.	H	α-helix	trans	-53.8	-46.9	172.8	164	0	0	0	0	110.8	Q460 I463 E705 T711 C712 R713	Q460-V709 HydrophobicContact CB-CG1 3.65Å; Q460-V709 HydrophobicContact CG-CG1 3.47Å; Q460-V709 VanDerWaalsContact CG-CG1 3.47Å; I463-V709 HydrophobicContact CB-CG2 4.27Å; I463-V709 HydrophobicContact CG2-CG2 3.73Å; E705-V709 HydrophobicContact CG-CG2 4.14Å; E705-V709 VanDerWaalsContact O-CB 3.28Å; E705-V709 WeakPolarHBondContact O-CB 3.42Å; E705-V709 WeakPolarHBondContact O-CG2 3.23Å; E705-V709 PolarHBondContact O-N 3.28Å; V709-T711 VanDerWaalsContact C-N 3.34Å; V709-T711 PolarHBondContact O-N 3.47Å; V709-C712 PolarHBondContact O-N 3.14Å; V709-R713 WeakPolarHBondContact O-CB 3.01Å; V709-R713 PolarHBondContact O-N 3.35Å
710	E	88.4	Confident	88	Confident	71 Å²	71	52.9 Å²	52.9	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-66.7	-36.2	178.8	-171.7	61	-167.7	0	0	112.3	S706 T707 I708 R713 H714	S706-E710 WeakPolarHBondContact O-CB 3.27Å; S706-E710 PolarHBondContact O-N 2.56Å; S706-E710 VanDerWaalsContact O-N 3.11Å; T707-E710 PolarHBondContact O-N 2.92Å; I708-E710 VanDerWaalsContact C-N 3.27Å; I708-E710 PolarHBondContact O-N 3.2Å; E710-R713 PolarHBondContact O-N 3.22Å; E710-R713 IonicContact OE1-CZ 2.83Å; E710-R713 IonicContact OE1-NE 3.48Å; E710-R713 PolarHBondContact OE1-NE 3.26Å; E710-R713 IonicContact OE1-NH2 3.8Å; E710-R713 PolarHBondContact OE1-NH2 3.28Å; E710-R713 IonicContact OE2-CZ 2.96Å; E710-R713 IonicContact OE2-NE 3.34Å; E710-R713 PolarHBondContact OE2-NE 3.22Å; E710-R713 IonicContact OE2-NH2 3.6Å; E710-H714 PolarHBondContact O-N 2.78Å; E710-H714 VanDerWaalsContact O-N 3.1Å; E710-H714 PolarHBondContact O-ND1 2.83Å; E710-H714 IonicContact OE1-CE1 3.91Å; E710-H714 PolarHBondContact OE1-CE1 3.01Å; E710-H714 IonicContact OE1-ND1 3.04Å
711	T	89.9	Confident	87.9	Confident	58 Å²	58	58.1 Å²	58.1	36%	0.356	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-46.7	174.6	-57.2	0	0	0	0	111.1	T707 I708 V709 R713 H714 Q715	T707-T711 WeakPolarHBondContact O-CB 3.24Å; T707-T711 PolarHBondContact O-N 3Å; T707-T711 PolarHBondContact O-OG1 2.86Å; I708-T711 WeakPolarHBondContact O-CB 3.36Å; I708-T711 PolarHBondContact O-N 3.15Å; I708-T711 VanDerWaalsContact O-N 3.1Å; V709-T711 VanDerWaalsContact C-N 3.34Å; V709-T711 PolarHBondContact O-N 3.47Å; T711-R713 PolarHBondContact O-N 2.97Å; T711-H714 PolarHBondContact O-N 2.72Å; T711-Q715 PolarHBondContact O-N 3.19Å
712	C	89.7	Confident	88	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-39.8	177.4	-67.5	0	0	0	0	112	I463 F558 I708 V709 H714 Q715 V716	I463-C712 HydrophobicContact CD1-CB 3.17Å; F558-C712 HydrophobicContact CD1-CB 3.82Å; F558-C712 HydrophobicContact CE1-CB 3.48Å; F558-C712 VanDerWaalsContact CE1-CB 3.48Å; F558-C712 HydrophobicContact CZ-CB 4.09Å; I708-C712 PolarHBondContact O-N 2.84Å; I708-C712 PolarHBondContact O-SG 2.87Å; V709-C712 PolarHBondContact O-N 3.14Å; C712-H714 VanDerWaalsContact C-N 3.29Å; C712-H714 PolarHBondContact O-N 2.82Å; C712-Q715 PolarHBondContact O-N 3.19Å; C712-V716 PolarHBondContact O-N 2.66Å
713	R	89.9	Confident	88	Confident	61 Å²	61	54.9 Å²	54.9	23%	0.23	27%	0.272	C	S	.	.	H	α-helix	trans	-56.4	-44.7	173.5	-170.3	-177	77.7	81.7	3.4	111.2	V709 E710 T711 A717	V709-R713 WeakPolarHBondContact O-CB 3.01Å; V709-R713 PolarHBondContact O-N 3.35Å; E710-R713 PolarHBondContact O-N 3.22Å; E710-R713 IonicContact OE1-CZ 2.83Å; E710-R713 IonicContact OE1-NE 3.48Å; E710-R713 PolarHBondContact OE1-NE 3.26Å; E710-R713 IonicContact OE1-NH2 3.8Å; E710-R713 PolarHBondContact OE1-NH2 3.28Å; E710-R713 IonicContact OE2-CZ 2.96Å; E710-R713 IonicContact OE2-NE 3.34Å; E710-R713 PolarHBondContact OE2-NE 3.22Å; E710-R713 IonicContact OE2-NH2 3.6Å; T711-R713 PolarHBondContact O-N 2.97Å; R713-A717 WeakPolarHBondContact O-CB 3.23Å; R713-A717 PolarHBondContact O-N 3.32Å
714	H	88.7	Confident	88	Confident	104 Å²	104	49.8 Å²	49.8	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-66.6	-39.7	176.4	-78.2	92.3	0	0	0	112.8	E710 T711 C712 A717 R718	E710-H714 PolarHBondContact O-N 2.78Å; E710-H714 VanDerWaalsContact O-N 3.1Å; E710-H714 PolarHBondContact O-ND1 2.83Å; E710-H714 IonicContact OE1-CE1 3.91Å; E710-H714 PolarHBondContact OE1-CE1 3.01Å; E710-H714 IonicContact OE1-ND1 3.04Å; T711-H714 PolarHBondContact O-N 2.72Å; C712-H714 VanDerWaalsContact C-N 3.29Å; C712-H714 PolarHBondContact O-N 2.82Å; H714-A717 PolarHBondContact O-N 2.83Å; H714-R718 WeakPolarHBondContact O-CB 3.48Å; H714-R718 PolarHBondContact O-N 3.11Å
715	Q	90	Very high	88.1	Confident	36 Å²	36	50.9 Å²	50.9	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-49.4	176	-72.3	-176.6	15.2	0	0	111	F556 F558 T559 T711 C712 A717 R718 E719	F556-Q715 HydrophobicContact CZ-CB 4.49Å; F558-Q715 HydrophobicContact CD1-CB 4.36Å; F558-Q715 HydrophobicContact CE1-CB 4.43Å; T559-Q715 VanDerWaalsContact N-OE1 3.09Å; T559-Q715 PolarHBondContact O-NE2 2.62Å; T559-Q715 PolarHBondContact OG1-NE2 3.07Å; T711-Q715 PolarHBondContact O-N 3.19Å; C712-Q715 PolarHBondContact O-N 3.19Å; Q715-A717 PolarHBondContact O-N 3.1Å; Q715-R718 WeakPolarHBondContact O-CB 3.35Å; Q715-R718 PolarHBondContact O-N 3.02Å; Q715-E719 WeakPolarHBondContact O-CG 3.26Å; Q715-E719 PolarHBondContact O-N 3.49Å
716	V	89.2	Confident	88	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-42	177.7	177.8	0	0	0	0	112.2	L455 V459 V519 I523 F556 F558 C712 R718 E719 I720	L455-V716 HydrophobicContact CD2-CG1 3.47Å; L455-V716 VanDerWaalsContact CD2-CG1 3.47Å; L455-V716 HydrophobicContact CG-CG1 3.75Å; V459-V716 HydrophobicContact CG1-CG2 4.14Å; V459-V716 HydrophobicContact CG2-CB 4.39Å; V459-V716 HydrophobicContact CG2-CG1 4.16Å; V459-V716 HydrophobicContact CG2-CG2 3.99Å; V519-V716 HydrophobicContact CG1-CG2 4.43Å; I523-V716 HydrophobicContact CD1-CG1 4.27Å; I523-V716 HydrophobicContact CD1-CG2 3.97Å; I523-V716 HydrophobicContact CG1-CG1 4.06Å; F556-V716 HydrophobicContact CE1-CG2 4.25Å; F556-V716 HydrophobicContact CZ-CG2 3.96Å; F558-V716 HydrophobicContact CE1-CG2 3.69Å; F558-V716 HydrophobicContact CZ-CG2 3.66Å; C712-V716 PolarHBondContact O-N 2.66Å; V716-R718 VanDerWaalsContact C-N 3.27Å; V716-R718 PolarHBondContact O-N 3.22Å; V716-E719 PolarHBondContact O-N 3.31Å; V716-I720 PolarHBondContact O-N 3.44Å; V716-I720 VanDerWaalsContact O-N 3.11Å
717	A	88.1	Confident	87.9	Confident	28 Å²	28	51 Å²	51	23%	0.231	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-36.9	177.1	0	0	0	0	0	112	R713 H714 Q715 K721	R713-A717 WeakPolarHBondContact O-CB 3.23Å; R713-A717 PolarHBondContact O-N 3.32Å; H714-A717 PolarHBondContact O-N 2.83Å; Q715-A717 PolarHBondContact O-N 3.1Å; A717-K721 VanDerWaalsContact O-CB 3.28Å; A717-K721 WeakPolarHBondContact O-CB 3.38Å; A717-K721 PolarHBondContact O-N 3.32Å
718	R	87.7	Confident	87.8	Confident	179 Å²	179	48.1 Å²	48.1	68%	0.675	23%	0.226	S	C	*	.	H	α-helix	trans	-65.2	-43.3	175.2	-178.8	-179.4	174	171.3	-1.9	111.6	H714 Q715 V716 K721 E722	H714-R718 WeakPolarHBondContact O-CB 3.48Å; H714-R718 PolarHBondContact O-N 3.11Å; Q715-R718 WeakPolarHBondContact O-CB 3.35Å; Q715-R718 PolarHBondContact O-N 3.02Å; V716-R718 VanDerWaalsContact C-N 3.27Å; V716-R718 PolarHBondContact O-N 3.22Å; R718-K721 WeakPolarHBondContact O-CB 3.39Å; R718-K721 PolarHBondContact O-N 3.44Å; R718-E722 PolarHBondContact O-N 2.85Å
719	E	84.3	Confident	87.8	Confident	41 Å²	41	54.3 Å²	54.3	19%	0.192	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-50.4	178.2	-69.4	-56	146.7	0	0	112.5	R553 F556 Q715 V716 K721 E722 L723	R553-E719 IonicContact CZ-OE2 2.76Å; R553-E719 IonicContact NH1-OE2 3.66Å; R553-E719 PolarHBondContact NH1-OE2 2.88Å; R553-E719 IonicContact NH2-OE2 3.83Å; R553-E719 PolarHBondContact NH2-OE2 3.22Å; F556-E719 HydrophobicContact CD2-CG 3.52Å; F556-E719 HydrophobicContact CE2-CG 3.39Å; F556-E719 HydrophobicContact CZ-CG 4.47Å; Q715-E719 WeakPolarHBondContact O-CG 3.26Å; Q715-E719 PolarHBondContact O-N 3.49Å; V716-E719 PolarHBondContact O-N 3.31Å; E719-K721 PolarHBondContact O-N 2.89Å; E719-E722 PolarHBondContact O-N 2.95Å; E719-L723 PolarHBondContact O-N 2.88Å; E719-L723 VanDerWaalsContact O-N 3.08Å
720	I	87.8	Confident	87.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-38.4	177.4	-63	-58.8	0	0	0	110.6	A452 L455 I523 T526 E527 L530 V716 S724	A452-I720 HydrophobicContact CB-CB 4.35Å; A452-I720 HydrophobicContact CB-CG2 4.04Å; L455-I720 HydrophobicContact CD2-CD1 3.94Å; L455-I720 HydrophobicContact CD2-CG1 3.85Å; I523-I720 HydrophobicContact CG2-CD1 4.5Å; T526-I720 HydrophobicContact CG2-CD1 4.3Å; E527-I720 HydrophobicContact CG-CD1 3.76Å; L530-I720 HydrophobicContact CD1-CG2 3.75Å; V716-I720 PolarHBondContact O-N 3.44Å; V716-I720 VanDerWaalsContact O-N 3.11Å; I720-S724 VanDerWaalsContact O-CB 3.25Å; I720-S724 WeakPolarHBondContact O-CB 3.45Å; I720-S724 PolarHBondContact O-N 2.73Å; I720-S724 PolarHBondContact O-OG 2.96Å
721	K	86.6	Confident	87.5	Confident	151 Å²	151	51.7 Å²	51.7	66%	0.657	24%	0.243	S	C	*	.	H	α-helix	trans	-64.4	-40.7	177.5	-169.3	178.4	-179.1	-176	0	111.8	A717 R718 E719 S724 S725	A717-K721 VanDerWaalsContact O-CB 3.28Å; A717-K721 WeakPolarHBondContact O-CB 3.38Å; A717-K721 PolarHBondContact O-N 3.32Å; R718-K721 WeakPolarHBondContact O-CB 3.39Å; R718-K721 PolarHBondContact O-N 3.44Å; E719-K721 PolarHBondContact O-N 2.89Å; K721-S724 WeakPolarHBondContact CA-OG 3.4Å; K721-S724 PolarHBondContact O-N 2.73Å; K721-S724 PolarHBondContact O-OG 2.84Å; K721-S725 PolarHBondContact O-N 3.45Å
722	E	87.2	Confident	87.4	Confident	63 Å²	63	52.5 Å²	52.5	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-67.8	-43	178.7	-167.2	-177.7	155.6	0	0	112.4	R553 R718 E719 S724 S725 R726	R553-E722 IonicContact NH2-OE1 2.62Å; R553-E722 IonicContact NH2-OE2 2.83Å; R553-E722 PolarHBondContact NH2-OE2 3.48Å; R718-E722 PolarHBondContact O-N 2.85Å; E719-E722 PolarHBondContact O-N 2.95Å; E722-S724 VanDerWaalsContact C-N 3.29Å; E722-S724 PolarHBondContact O-N 3.18Å; E722-S725 PolarHBondContact O-N 3.47Å; E722-S725 PolarHBondContact O-OG 2.74Å; E722-R726 PolarHBondContact O-N 3.1Å; E722-R726 IonicContact OE1-CZ 2.73Å; E722-R726 IonicContact OE1-NE 3.71Å; E722-R726 IonicContact OE1-NH2 2.73Å; E722-R726 PolarHBondContact OE1-NH2 3.39Å
723	L	85.1	Confident	87.3	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.031	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-44.6	172	177.5	64.3	0	0	0	110.4	E527 I549 E719 S725 R726 L727	E527-L723 HydrophobicContact CB-CD2 3.52Å; E527-L723 HydrophobicContact CG-CD2 3.51Å; I549-L723 HydrophobicContact CG2-CD1 3.91Å; E719-L723 PolarHBondContact O-N 2.88Å; E719-L723 VanDerWaalsContact O-N 3.08Å; L723-S725 VanDerWaalsContact C-N 3.31Å; L723-S725 PolarHBondContact O-N 3.39Å; L723-R726 PolarHBondContact O-N 3.19Å; L723-L727 HydrophobicContact CD1-CD1 4.33Å; L723-L727 HydrophobicContact CD1-CG 4.29Å; L723-L727 HydrophobicContact CG-CD1 4.05Å; L723-L727 HydrophobicContact CG-CG 4.39Å; L723-L727 WeakPolarHBondContact O-CG 3.39Å; L723-L727 PolarHBondContact O-N 2.74Å; L723-L727 VanDerWaalsContact O-N 3.07Å
724	S	85.2	Confident	87	Confident	10 Å²	10	55.3 Å²	55.3	7%	0.07	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-37.6	-178.5	76.4	0	0	0	0	113	I448 I720 K721 E722 R726 L727 T728	I448-S724 VanDerWaalsContact CG2-CB 3.42Å; I720-S724 VanDerWaalsContact O-CB 3.25Å; I720-S724 WeakPolarHBondContact O-CB 3.45Å; I720-S724 PolarHBondContact O-N 2.73Å; I720-S724 PolarHBondContact O-OG 2.96Å; K721-S724 WeakPolarHBondContact CA-OG 3.4Å; K721-S724 PolarHBondContact O-N 2.73Å; K721-S724 PolarHBondContact O-OG 2.84Å; E722-S724 VanDerWaalsContact C-N 3.29Å; E722-S724 PolarHBondContact O-N 3.18Å; S724-R726 PolarHBondContact O-N 2.84Å; S724-L727 PolarHBondContact O-N 3.29Å; S724-T728 WeakPolarHBondContact O-CB 3.49Å; S724-T728 PolarHBondContact O-N 3.23Å; S724-T728 PolarHBondContact O-OG1 2.88Å
725	S	88.4	Confident	86.9	Confident	62 Å²	62	51.2 Å²	51.2	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-65	-41	178.7	62.8	0	0	0	0	111.6	K721 E722 L723 T728 E729	K721-S725 PolarHBondContact O-N 3.45Å; E722-S725 PolarHBondContact O-N 3.47Å; E722-S725 PolarHBondContact O-OG 2.74Å; L723-S725 VanDerWaalsContact C-N 3.31Å; L723-S725 PolarHBondContact O-N 3.39Å; S725-T728 PolarHBondContact O-N 3.14Å; S725-E729 WeakPolarHBondContact O-CB 3.2Å; S725-E729 PolarHBondContact O-N 3.06Å
726	R	87.1	Confident	86.9	Confident	110 Å²	110	55.2 Å²	55.2	42%	0.415	26%	0.262	S	S	.	.	H	α-helix	trans	-64.9	-41.5	176.9	-62.8	178.6	-169.5	-165.8	3	111.9	I549 E722 L723 S724 E729 L730	I549-R726 HydrophobicContact CG2-CB 4.31Å; E722-R726 PolarHBondContact O-N 3.1Å; E722-R726 IonicContact OE1-CZ 2.73Å; E722-R726 IonicContact OE1-NE 3.71Å; E722-R726 IonicContact OE1-NH2 2.73Å; E722-R726 PolarHBondContact OE1-NH2 3.39Å; L723-R726 PolarHBondContact O-N 3.19Å; S724-R726 PolarHBondContact O-N 2.84Å; R726-E729 PolarHBondContact O-N 2.92Å; R726-L730 PolarHBondContact O-N 2.67Å; R726-L730 VanDerWaalsContact O-N 3.14Å
727	L	84.8	Confident	86.8	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-43.3	176.6	-67.7	179.4	0	0	0	111.4	F444 I534 A546 I549 L723 S724 E729 L730 A731	F444-L727 HydrophobicContact CZ-CD1 4.47Å; I534-L727 VanDerWaalsContact CD1-C 3.47Å; I534-L727 HydrophobicContact CD1-CB 3.7Å; I534-L727 WeakPolarHBondContact CD1-O 3.47Å; I534-L727 HydrophobicContact CG2-CB 4.37Å; I534-L727 HydrophobicContact CG2-CD1 4.19Å; I534-L727 HydrophobicContact CG2-CD2 4.06Å; I534-L727 HydrophobicContact CG2-CG 4.44Å; A546-L727 HydrophobicContact CB-CD2 4.24Å; I549-L727 HydrophobicContact CG2-CD2 4.35Å; L723-L727 HydrophobicContact CD1-CD1 4.33Å; L723-L727 HydrophobicContact CD1-CG 4.29Å; L723-L727 HydrophobicContact CG-CD1 4.05Å; L723-L727 HydrophobicContact CG-CG 4.39Å; L723-L727 WeakPolarHBondContact O-CG 3.39Å; L723-L727 PolarHBondContact O-N 2.74Å; L723-L727 VanDerWaalsContact O-N 3.07Å; S724-L727 PolarHBondContact O-N 3.29Å; L727-E729 VanDerWaalsContact C-N 3.33Å; L727-E729 PolarHBondContact O-N 3.48Å; L727-L730 PolarHBondContact O-N 3.02Å; L727-A731 PolarHBondContact O-N 3.34Å; L727-A731 VanDerWaalsContact O-N 3.16Å
728	T	87.1	Confident	86.7	Confident	19 Å²	19	57.6 Å²	57.6	12%	0.117	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-37.9	175.6	-61.4	0	0	0	0	112.1	M441 L445 S724 S725 A731 N732	M441-T728 HydrophobicContact SD-CG2 4.14Å; L445-T728 HydrophobicContact CD2-CG2 4.18Å; S724-T728 WeakPolarHBondContact O-CB 3.49Å; S724-T728 PolarHBondContact O-N 3.23Å; S724-T728 PolarHBondContact O-OG1 2.88Å; S725-T728 PolarHBondContact O-N 3.14Å; T728-A731 PolarHBondContact O-N 3.13Å; T728-N732 WeakPolarHBondContact O-CB 3.46Å; T728-N732 VanDerWaalsContact O-CG 3.29Å; T728-N732 PolarHBondContact O-N 3.48Å; T728-N732 PolarHBondContact O-ND2 2.84Å
729	E	88.5	Confident	86.7	Confident	137 Å²	137	51.7 Å²	51.7	64%	0.64	25%	0.252	S	S	*	.	H	α-helix	trans	-61.4	-49.4	175.9	-172.3	171.9	-165.2	0	0	111.7	S725 R726 L727 A731 N732 E733	S725-E729 WeakPolarHBondContact O-CB 3.2Å; S725-E729 PolarHBondContact O-N 3.06Å; R726-E729 PolarHBondContact O-N 2.92Å; L727-E729 VanDerWaalsContact C-N 3.33Å; L727-E729 PolarHBondContact O-N 3.48Å; E729-A731 VanDerWaalsContact C-N 3.28Å; E729-A731 PolarHBondContact O-N 2.97Å; E729-N732 PolarHBondContact O-N 3.28Å; E729-N732 VanDerWaalsContact O-N 3.16Å; E729-E733 PolarHBondContact O-N 3.34Å
730	L	86.2	Confident	87	Confident	16 Å²	16	52.7 Å²	52.7	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-56.1	-42.9	176.1	178.9	66.8	0	0	0	112.2	L538 K545 A546 I549 R726 L727 E733 E734	L538-L730 HydrophobicContact CD1-CD2 4.33Å; K545-L730 HydrophobicContact CB-CD1 4.34Å; K545-L730 HydrophobicContact CB-CD2 4.06Å; K545-L730 HydrophobicContact CD-CD1 4.17Å; A546-L730 HydrophobicContact CB-CD2 3.84Å; I549-L730 HydrophobicContact CD1-CD2 4.27Å; R726-L730 PolarHBondContact O-N 2.67Å; R726-L730 VanDerWaalsContact O-N 3.14Å; L727-L730 PolarHBondContact O-N 3.02Å; L730-E733 PolarHBondContact O-N 2.8Å; L730-E734 PolarHBondContact O-N 3.29Å
731	A	85.8	Confident	87	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-77.3	-25.8	-178.3	0	0	0	0	0	113.7	M441 I534 F537 L538 L727 T728 E729 L735	M441-A731 HydrophobicContact CE-CB 3.11Å; I534-A731 HydrophobicContact CD1-CB 3.74Å; I534-A731 HydrophobicContact CG1-CB 4.28Å; F537-A731 HydrophobicContact CE2-CB 4.46Å; L538-A731 HydrophobicContact CD2-CB 3.82Å; L727-A731 PolarHBondContact O-N 3.34Å; L727-A731 VanDerWaalsContact O-N 3.16Å; T728-A731 PolarHBondContact O-N 3.13Å; E729-A731 VanDerWaalsContact C-N 3.28Å; E729-A731 PolarHBondContact O-N 2.97Å; A731-L735 WeakPolarHBondContact O-CB 3.46Å; A731-L735 PolarHBondContact O-N 3.26Å; A731-L735 VanDerWaalsContact O-N 3.12Å
732	N	88	Confident	87.2	Confident	75 Å²	75	48.3 Å²	48.3	40%	0.401	24%	0.241	S	C	.	.	H	α-helix	trans	-69.2	-38.1	169.3	-76.7	-27.7	0	0	0	111.6	T728 E729 E734 L735 E736	T728-N732 WeakPolarHBondContact O-CB 3.46Å; T728-N732 VanDerWaalsContact O-CG 3.29Å; T728-N732 PolarHBondContact O-N 3.48Å; T728-N732 PolarHBondContact O-ND2 2.84Å; E729-N732 PolarHBondContact O-N 3.28Å; E729-N732 VanDerWaalsContact O-N 3.16Å; N732-E734 VanDerWaalsContact C-N 3.34Å; N732-E734 PolarHBondContact O-N 3.41Å; N732-L735 PolarHBondContact O-N 3.5Å; N732-E736 WeakPolarHBondContact O-CB 3.34Å; N732-E736 PolarHBondContact O-N 3.21Å
733	E	87	Confident	87.3	Confident	88 Å²	88	51.5 Å²	51.5	41%	0.411	26%	0.256	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.9	-170.3	-174.4	167.9	0	0	111.5	R90 E729 L730 E736 T737	R90-E733 IonicContact NH1-OE1 2.66Å; E729-E733 PolarHBondContact O-N 3.34Å; L730-E733 PolarHBondContact O-N 2.8Å; E733-E736 PolarHBondContact O-N 2.9Å; E733-T737 PolarHBondContact O-N 3.22Å; E733-T737 PolarHBondContact O-OG1 3.01Å
734	E	84.7	Confident	87.3	Confident	32 Å²	32	53.4 Å²	53.4	15%	0.15	27%	0.265	C	S	.	.	H	α-helix	trans	-66.8	-39.8	175.3	-68.2	-62.8	144.3	0	0	112.1	L538 A542 L730 N732 T737 I738	L538-E734 HydrophobicContact CD2-CB 4.27Å; L538-E734 HydrophobicContact CD2-CG 4.12Å; A542-E734 HydrophobicContact CB-CG 3.75Å; L730-E734 PolarHBondContact O-N 3.29Å; N732-E734 VanDerWaalsContact C-N 3.34Å; N732-E734 PolarHBondContact O-N 3.41Å; E734-T737 PolarHBondContact O-N 3.03Å; E734-I738 WeakPolarHBondContact O-CG1 3.36Å; E734-I738 PolarHBondContact O-N 3.38Å; E734-I738 VanDerWaalsContact O-N 3.14Å
735	L	87.4	Confident	87.3	Confident	18 Å²	18	54.7 Å²	54.7	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-41.4	176.9	-173.2	65.8	0	0	0	111.6	V434 R438 A731 N732 T737 I738 Q739	V434-L735 HydrophobicContact CB-CD1 4.38Å; V434-L735 HydrophobicContact CG1-CD1 4Å; V434-L735 HydrophobicContact CG2-CD1 4.46Å; R438-L735 HydrophobicContact CB-CD2 4.41Å; A731-L735 WeakPolarHBondContact O-CB 3.46Å; A731-L735 PolarHBondContact O-N 3.26Å; A731-L735 VanDerWaalsContact O-N 3.12Å; N732-L735 PolarHBondContact O-N 3.5Å; L735-T737 VanDerWaalsContact C-N 3.35Å; L735-I738 PolarHBondContact O-N 2.94Å; L735-Q739 WeakPolarHBondContact O-CG 3.41Å; L735-Q739 PolarHBondContact O-N 3.36Å
736	E	88.4	Confident	87.3	Confident	121 Å²	121	57.1 Å²	57.1	57%	0.565	27%	0.274	S	S	*	.	H	α-helix	trans	-63.3	-41.7	176.6	-172.8	170.6	-167	0	0	111	N732 E733 I738 Q739 L740	N732-E736 WeakPolarHBondContact O-CB 3.34Å; N732-E736 PolarHBondContact O-N 3.21Å; E733-E736 PolarHBondContact O-N 2.9Å; E736-I738 PolarHBondContact O-N 3.5Å; E736-Q739 WeakPolarHBondContact O-CB 3.42Å; E736-Q739 PolarHBondContact O-N 2.84Å; E736-Q739 VanDerWaalsContact O-N 3.12Å; E736-L740 HydrophobicContact CG-CD1 4.39Å; E736-L740 WeakPolarHBondContact O-CG 3.26Å; E736-L740 PolarHBondContact O-N 2.97Å
737	T	87.8	Confident	87.1	Confident	53 Å²	53	54.5 Å²	54.5	33%	0.325	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-47	175	-58	0	0	0	0	111.7	E733 E734 L735 Q739 L740 E741	E733-T737 PolarHBondContact O-N 3.22Å; E733-T737 PolarHBondContact O-OG1 3.01Å; E734-T737 PolarHBondContact O-N 3.03Å; L735-T737 VanDerWaalsContact C-N 3.35Å; T737-Q739 VanDerWaalsContact C-N 3.32Å; T737-Q739 PolarHBondContact O-N 3.14Å; T737-L740 PolarHBondContact O-N 3.5Å; T737-E741 PolarHBondContact O-N 3.46Å
738	I	85.4	Confident	87	Confident	24 Å²	24	56.6 Å²	56.6	12%	0.123	27%	0.273	C	S	.	.	H	α-helix	trans	-67.1	-35.1	177.9	-59	169.1	0	0	0	110.9	K430 V434 E734 L735 E736 E741 V742	K430-I738 HydrophobicContact CD-CG2 4.1Å; V434-I738 HydrophobicContact CG2-CB 4.1Å; V434-I738 HydrophobicContact CG2-CG2 3.49Å; V434-I738 VanDerWaalsContact CG2-CG2 3.49Å; E734-I738 WeakPolarHBondContact O-CG1 3.36Å; E734-I738 PolarHBondContact O-N 3.38Å; E734-I738 VanDerWaalsContact O-N 3.14Å; L735-I738 PolarHBondContact O-N 2.94Å; E736-I738 PolarHBondContact O-N 3.5Å; I738-E741 PolarHBondContact O-N 3.02Å; I738-V742 WeakPolarHBondContact O-CG2 3.46Å; I738-V742 PolarHBondContact O-N 3.2Å; I738-V742 VanDerWaalsContact O-N 3.09Å
739	Q	88.8	Confident	86.9	Confident	55 Å²	55	56.2 Å²	56.2	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-41.8	176	-77.7	-178.7	-14.7	0	0	112.5	V434 L735 E736 T737 E741 V742 E743	V434-Q739 HydrophobicContact CG1-CG 3.73Å; V434-Q739 HydrophobicContact CG2-CG 3.99Å; L735-Q739 WeakPolarHBondContact O-CG 3.41Å; L735-Q739 PolarHBondContact O-N 3.36Å; E736-Q739 WeakPolarHBondContact O-CB 3.42Å; E736-Q739 PolarHBondContact O-N 2.84Å; E736-Q739 VanDerWaalsContact O-N 3.12Å; T737-Q739 VanDerWaalsContact C-N 3.32Å; T737-Q739 PolarHBondContact O-N 3.14Å; Q739-E741 VanDerWaalsContact C-N 3.32Å; Q739-E741 PolarHBondContact O-N 3.37Å; Q739-V742 WeakPolarHBondContact O-CB 3.49Å; Q739-V742 PolarHBondContact O-N 3.26Å; Q739-V742 VanDerWaalsContact O-N 3.1Å; Q739-E743 PolarHBondContact O-N 3.07Å
740	L	90.3	Very high	86.7	Confident	63 Å²	63	54.7 Å²	54.7	33%	0.33	27%	0.266	S	S	.	.	H	α-helix	trans	-60.8	-41.6	175.2	-69.9	167.2	0	0	0	111.5	E736 T737 V742 E743 E744	E736-L740 HydrophobicContact CG-CD1 4.39Å; E736-L740 WeakPolarHBondContact O-CG 3.26Å; E736-L740 PolarHBondContact O-N 2.97Å; T737-L740 PolarHBondContact O-N 3.5Å; L740-V742 VanDerWaalsContact C-N 3.31Å; L740-V742 PolarHBondContact O-N 3.26Å; L740-E743 PolarHBondContact O-N 3.5Å; L740-E744 PolarHBondContact O-N 2.87Å
741	E	87.8	Confident	86.4	Confident	42 Å²	42	54.7 Å²	54.7	20%	0.196	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-38.7	173.5	-68.7	-178.6	176.7	0	0	112.4	L91 K430 T737 I738 Q739 E744 L745	L91-E741 HydrophobicContact CD1-CG 4.43Å; K430-E741 WeakPolarHBondContact CE-OE2 3.39Å; K430-E741 IonicContact NZ-OE2 3.68Å; K430-E741 PolarHBondContact NZ-OE2 2.91Å; T737-E741 PolarHBondContact O-N 3.46Å; I738-E741 PolarHBondContact O-N 3.02Å; Q739-E741 VanDerWaalsContact C-N 3.32Å; Q739-E741 PolarHBondContact O-N 3.37Å; E741-E744 PolarHBondContact O-N 3.32Å; E741-L745 WeakPolarHBondContact O-CB 3.3Å; E741-L745 VanDerWaalsContact O-CG 3.29Å; E741-L745 WeakPolarHBondContact O-CG 3.44Å; E741-L745 PolarHBondContact O-N 3.27Å
742	V	89.6	Confident	86.3	Confident	16 Å²	16	55.1 Å²	55.1	10%	0.097	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-43.9	176.8	169.2	0	0	0	0	110.8	Y427 K430 V434 I738 Q739 L740 L745 K746	Y427-V742 HydrophobicContact CD2-CG1 3.66Å; Y427-V742 HydrophobicContact CE2-CG1 3.36Å; K430-V742 HydrophobicContact CB-CG2 3.54Å; V434-V742 HydrophobicContact CG2-CG2 4.36Å; I738-V742 WeakPolarHBondContact O-CG2 3.46Å; I738-V742 PolarHBondContact O-N 3.2Å; I738-V742 VanDerWaalsContact O-N 3.09Å; Q739-V742 WeakPolarHBondContact O-CB 3.49Å; Q739-V742 PolarHBondContact O-N 3.26Å; Q739-V742 VanDerWaalsContact O-N 3.1Å; L740-V742 VanDerWaalsContact C-N 3.31Å; L740-V742 PolarHBondContact O-N 3.26Å; V742-L745 PolarHBondContact O-N 3.4Å; V742-K746 WeakPolarHBondContact O-CB 3.5Å; V742-K746 PolarHBondContact O-N 3.43Å
743	E	89.1	Confident	86.2	Confident	130 Å²	130	54.8 Å²	54.8	61%	0.607	27%	0.266	S	S	*	.	H	α-helix	trans	-64.2	-41.6	176.7	-70.3	-175.9	174	0	0	111.9	Q739 L740 K746 R747	Q739-E743 PolarHBondContact O-N 3.07Å; L740-E743 PolarHBondContact O-N 3.5Å; E743-K746 WeakPolarHBondContact O-CB 3.4Å; E743-K746 PolarHBondContact O-N 2.87Å; E743-R747 PolarHBondContact O-N 3.1Å
744	E	86.2	Confident	86	Confident	46 Å²	46	55.3 Å²	55.3	22%	0.215	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-45	176.5	-169.3	-173.8	173.7	0	0	111.8	L91 L740 E741 K746 R747 K748	L91-E744 WeakPolarHBondContact CD2-OE2 3.31Å; L740-E744 PolarHBondContact O-N 2.87Å; E741-E744 PolarHBondContact O-N 3.32Å; E744-K746 VanDerWaalsContact C-N 3.29Å; E744-K746 PolarHBondContact O-N 3.4Å; E744-R747 PolarHBondContact O-N 2.97Å; E744-K748 WeakPolarHBondContact O-CB 3.38Å; E744-K748 PolarHBondContact O-N 2.94Å
745	L	85.9	Confident	85.8	Confident	38 Å²	38	54 Å²	54	20%	0.199	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-38	175.6	-74.1	171	0	0	0	111.8	C423 T426 E741 V742 K748 G749	C423-L745 PolarHBondContact SG-O 2.75Å; T426-L745 HydrophobicContact CG2-CD1 3.83Å; E741-L745 WeakPolarHBondContact O-CB 3.3Å; E741-L745 VanDerWaalsContact O-CG 3.29Å; E741-L745 WeakPolarHBondContact O-CG 3.44Å; E741-L745 PolarHBondContact O-N 3.27Å; V742-L745 PolarHBondContact O-N 3.4Å; L745-K748 PolarHBondContact O-N 3.23Å; L745-G749 PolarHBondContact O-N 2.96Å
746	K	86.9	Confident	85.7	Confident	112 Å²	112	54.8 Å²	54.8	49%	0.487	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-48.2	175.8	-172.7	179.8	175.8	-175.4	0	111.2	Y427 V742 E743 E744 K748 G749 E750	Y427-K746 HydrophobicContact CD2-CB 4.26Å; Y427-K746 HydrophobicContact CE2-CB 4.11Å; V742-K746 WeakPolarHBondContact O-CB 3.5Å; V742-K746 PolarHBondContact O-N 3.43Å; E743-K746 WeakPolarHBondContact O-CB 3.4Å; E743-K746 PolarHBondContact O-N 2.87Å; E744-K746 VanDerWaalsContact C-N 3.29Å; E744-K746 PolarHBondContact O-N 3.4Å; K746-K748 VanDerWaalsContact C-N 3.32Å; K746-K748 PolarHBondContact O-N 3.3Å; K746-G749 WeakPolarHBondContact O-CA 3.46Å; K746-G749 PolarHBondContact O-N 3.34Å; K746-G749 VanDerWaalsContact O-N 3.07Å; K746-E750 PolarHBondContact O-N 3.14Å
747	R	84.1	Confident	85.6	Confident	55 Å²	55	52.5 Å²	52.5	21%	0.208	27%	0.267	C	S	.	.	H	α-helix	trans	-59.1	-41.4	176.8	-166.3	-166.6	73.2	71.8	0.8	112.2	E743 E744 G749 E750 T751	E743-R747 PolarHBondContact O-N 3.1Å; E744-R747 PolarHBondContact O-N 2.97Å; R747-G749 VanDerWaalsContact C-N 3.34Å; R747-E750 PolarHBondContact O-N 2.95Å; R747-T751 PolarHBondContact O-N 3.34Å; R747-T751 PolarHBondContact O-OG1 3.33Å
748	K	82	Confident	85.4	Confident	45 Å²	45	51 Å²	51	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-42.5	174.4	-173	178	-178.2	177	0	111.4	E744 L745 K746 T751 L752	E744-K748 WeakPolarHBondContact O-CB 3.38Å; E744-K748 PolarHBondContact O-N 2.94Å; L745-K748 PolarHBondContact O-N 3.23Å; K746-K748 VanDerWaalsContact C-N 3.32Å; K746-K748 PolarHBondContact O-N 3.3Å; K748-T751 PolarHBondContact O-N 3.46Å; K748-L752 WeakPolarHBondContact O-CG 3.03Å; K748-L752 PolarHBondContact O-N 2.98Å
749	G	84.5	Confident	85.5	Confident	11 Å²	11	49.9 Å²	49.9	11%	0.113	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-44.7	174.7	0	0	0	0	0	113	L745 K746 R747 L752 D753	L745-G749 PolarHBondContact O-N 2.96Å; K746-G749 WeakPolarHBondContact O-CA 3.46Å; K746-G749 PolarHBondContact O-N 3.34Å; K746-G749 VanDerWaalsContact O-N 3.07Å; R747-G749 VanDerWaalsContact C-N 3.34Å; G749-L752 PolarHBondContact O-N 3.43Å; G749-D753 PolarHBondContact O-N 3.04Å; G749-D753 VanDerWaalsContact O-N 3.07Å
750	E	84.8	Confident	85.4	Confident	105 Å²	105	50 Å²	50	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-62.2	-42.2	176.3	-69.9	170.1	-177.3	0	0	111.7	K746 R747 L752 D753 E754	K746-E750 PolarHBondContact O-N 3.14Å; R747-E750 PolarHBondContact O-N 2.95Å; E750-L752 VanDerWaalsContact C-N 3.34Å; E750-L752 PolarHBondContact O-N 2.96Å; E750-D753 WeakPolarHBondContact O-CB 3.47Å; E750-D753 PolarHBondContact O-N 3.47Å; E750-E754 PolarHBondContact O-N 2.87Å
751	T	80.7	Confident	85.4	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-40.3	176.9	-50	0	0	0	0	111.7	T78 R747 K748 D753 E754 V755	T78-T751 HydrophobicContact CG2-CG2 4.09Å; R747-T751 PolarHBondContact O-N 3.34Å; R747-T751 PolarHBondContact O-OG1 3.33Å; K748-T751 PolarHBondContact O-N 3.46Å; T751-D753 VanDerWaalsContact C-N 3.32Å; T751-D753 PolarHBondContact O-N 3.27Å; T751-E754 WeakPolarHBondContact O-CB 3.43Å; T751-E754 PolarHBondContact O-N 3.49Å; T751-V755 WeakPolarHBondContact O-CG2 3.11Å; T751-V755 PolarHBondContact O-N 2.63Å
752	L	83.5	Confident	85.5	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-35.4	175.8	-70.4	172.3	0	0	0	112.1	V416 E419 K420 K748 G749 E750 V755 S756	V416-L752 HydrophobicContact CG1-CB 4.19Å; V416-L752 HydrophobicContact CG1-CD2 4.1Å; V416-L752 WeakPolarHBondContact CG1-O 3.29Å; V416-L752 HydrophobicContact CG2-CD2 4.49Å; E419-L752 HydrophobicContact CB-CD1 4.12Å; K420-L752 HydrophobicContact CB-CB 4.48Å; K420-L752 HydrophobicContact CB-CD1 4.22Å; K748-L752 WeakPolarHBondContact O-CG 3.03Å; K748-L752 PolarHBondContact O-N 2.98Å; G749-L752 PolarHBondContact O-N 3.43Å; E750-L752 VanDerWaalsContact C-N 3.34Å; E750-L752 PolarHBondContact O-N 2.96Å; L752-V755 PolarHBondContact O-N 2.91Å; L752-S756 WeakPolarHBondContact O-CB 3.41Å; L752-S756 PolarHBondContact O-N 3.46Å
753	D	85.1	Confident	85.7	Confident	69 Å²	69	48.9 Å²	48.9	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-65.7	-42.4	173.9	-89.2	-29.2	0	0	0	112.4	K420 G749 E750 T751 V755 S756 S757	K420-D753 WeakPolarHBondContact CD-OD1 3.42Å; K420-D753 VanDerWaalsContact CE-OD1 3.25Å; K420-D753 WeakPolarHBondContact CE-OD1 3.33Å; K420-D753 VanDerWaalsContact CE-OD2 3.26Å; K420-D753 WeakPolarHBondContact CE-OD2 3.29Å; K420-D753 IonicContact NZ-OD1 3.65Å; K420-D753 PolarHBondContact NZ-OD1 3Å; K420-D753 IonicContact NZ-OD2 2.73Å; K420-D753 PolarHBondContact NZ-OD2 3.37Å; G749-D753 PolarHBondContact O-N 3.04Å; G749-D753 VanDerWaalsContact O-N 3.07Å; E750-D753 WeakPolarHBondContact O-CB 3.47Å; E750-D753 PolarHBondContact O-N 3.47Å; T751-D753 VanDerWaalsContact C-N 3.32Å; T751-D753 PolarHBondContact O-N 3.27Å; D753-V755 PolarHBondContact O-N 3.17Å; D753-S756 PolarHBondContact O-N 3.03Å; D753-S757 WeakPolarHBondContact O-CB 3.34Å; D753-S757 PolarHBondContact O-N 3.4Å
754	E	82.5	Confident	85.9	Confident	99 Å²	99	47 Å²	47	46%	0.463	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-44	173.6	-85.1	-162	-148.6	0	0	112.9	K74 E750 T751 S757 V758	K74-E754 HydrophobicContact CD-CB 4.41Å; K74-E754 IonicContact NZ-OE2 2.65Å; K74-E754 PolarHBondContact NZ-OE2 3.23Å; E750-E754 PolarHBondContact O-N 2.87Å; T751-E754 WeakPolarHBondContact O-CB 3.43Å; T751-E754 PolarHBondContact O-N 3.49Å; E754-S757 PolarHBondContact O-N 3.28Å; E754-S757 PolarHBondContact O-OG 3.13Å; E754-V758 WeakPolarHBondContact O-CG2 3.41Å
755	V	81.7	Confident	86.2	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-46.7	175.5	170.4	0	0	0	0	110.5	L71 K74 L75 V416 T751 L752 D753 S757 V758 I759	L71-V755 HydrophobicContact CD2-CG1 3.97Å; K74-V755 HydrophobicContact CB-CG2 4.04Å; L75-V755 HydrophobicContact CD2-CG2 4.43Å; V416-V755 HydrophobicContact CG2-CG1 4Å; T751-V755 WeakPolarHBondContact O-CG2 3.11Å; T751-V755 PolarHBondContact O-N 2.63Å; L752-V755 PolarHBondContact O-N 2.91Å; D753-V755 PolarHBondContact O-N 3.17Å; V755-S757 VanDerWaalsContact C-N 3.28Å; V755-S757 PolarHBondContact O-N 3.45Å; V755-V758 PolarHBondContact O-N 3.18Å; V755-V758 VanDerWaalsContact O-N 3.12Å; V755-I759 HydrophobicContact CG1-CD1 3.82Å; V755-I759 HydrophobicContact CG1-CG1 4.42Å; V755-I759 WeakPolarHBondContact O-CG1 3.46Å; V755-I759 PolarHBondContact O-N 3.35Å
756	S	85	Confident	86.6	Confident	36 Å²	36	46.6 Å²	46.6	25%	0.252	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-38.3	178.2	-172.3	0	0	0	0	112.7	L752 D753 V758 I759	L752-S756 WeakPolarHBondContact O-CB 3.41Å; L752-S756 PolarHBondContact O-N 3.46Å; D753-S756 PolarHBondContact O-N 3.03Å; S756-V758 PolarHBondContact O-N 3.06Å; S756-I759 PolarHBondContact O-N 3.49Å
757	S	85.2	Confident	87	Confident	72 Å²	72	43.7 Å²	43.7	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-28.6	178.8	78.8	0	0	0	0	113.4	D753 E754 V755 P761	D753-S757 WeakPolarHBondContact O-CB 3.34Å; D753-S757 PolarHBondContact O-N 3.4Å; E754-S757 PolarHBondContact O-N 3.28Å; E754-S757 PolarHBondContact O-OG 3.13Å; V755-S757 VanDerWaalsContact C-N 3.28Å; V755-S757 PolarHBondContact O-N 3.45Å; S757-P761 WeakPolarHBondContact O-CD 3.48Å
758	V	84.5	Confident	87.6	Confident	23 Å²	23	46.7 Å²	46.7	14%	0.139	26%	0.263	C	S	.	.	H	α-helix	trans	-88.5	-34.6	-177.1	173.3	0	0	0	0	112	I70 K74 E754 V755 S756 T760 P761 M762	I70-V758 HydrophobicContact CB-CG1 4.35Å; I70-V758 HydrophobicContact CG2-CB 4.42Å; I70-V758 HydrophobicContact CG2-CG1 3.66Å; I70-V758 HydrophobicContact CG2-CG2 4.03Å; K74-V758 HydrophobicContact CD-CG2 4.37Å; E754-V758 WeakPolarHBondContact O-CG2 3.41Å; V755-V758 PolarHBondContact O-N 3.18Å; V755-V758 VanDerWaalsContact O-N 3.12Å; S756-V758 PolarHBondContact O-N 3.06Å; V758-T760 VanDerWaalsContact C-N 3.3Å; V758-T760 PolarHBondContact O-N 3.07Å; V758-P761 VanDerWaalsContact O-CD 3.32Å; V758-P761 WeakPolarHBondContact O-CD 3.29Å; V758-M762 HydrophobicContact CG1-CE 3.31Å; V758-M762 HydrophobicContact CG1-CG 4.34Å; V758-M762 HydrophobicContact CG1-SD 3.65Å; V758-M762 WeakPolarHBondContact O-CG 3.32Å; V758-M762 PolarHBondContact O-N 2.95Å
759	I	86.5	Confident	88.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-39.3	-177.7	-68.3	166.7	0	0	0	111.5	L71 L409 L412 Q413 V416 V755 S756 M762 K763	L71-I759 HydrophobicContact CD2-CG1 4.19Å; L409-I759 HydrophobicContact CB-CG2 4.18Å; L412-I759 HydrophobicContact CD2-CD1 3.83Å; L412-I759 HydrophobicContact CD2-CG1 4.38Å; L412-I759 HydrophobicContact CG-CD1 3.89Å; Q413-I759 HydrophobicContact CB-CG2 4.07Å; Q413-I759 HydrophobicContact CG-CG2 4.47Å; V416-I759 HydrophobicContact CG2-CD1 4.44Å; V755-I759 HydrophobicContact CG1-CD1 3.82Å; V755-I759 HydrophobicContact CG1-CG1 4.42Å; V755-I759 WeakPolarHBondContact O-CG1 3.46Å; V755-I759 PolarHBondContact O-N 3.35Å; S756-I759 PolarHBondContact O-N 3.49Å; I759-M762 PolarHBondContact O-N 3.33Å; I759-K763 HydrophobicContact CG2-CD 3.79Å; I759-K763 HydrophobicContact CG2-CG 4.25Å; I759-K763 WeakPolarHBondContact O-CG 3.42Å; I759-K763 PolarHBondContact O-N 3.3Å
760	T	88.7	Confident	88.9	Confident	58 Å²	58	46.7 Å²	46.7	36%	0.356	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-50.8	-176	-57.6	0	0	0	0	112.8	Q413 V758 M762 K763 N764	Q413-T760 PolarHBondContact NE2-OG1 3.28Å; V758-T760 VanDerWaalsContact C-N 3.3Å; V758-T760 PolarHBondContact O-N 3.07Å; T760-M762 VanDerWaalsContact C-N 3.31Å; T760-M762 PolarHBondContact O-N 3.15Å; T760-K763 PolarHBondContact O-N 2.87Å; T760-N764 PolarHBondContact O-N 3.29Å
761	P	90.4	Very high	89.5	Confident	67 Å²	67	42.9 Å²	42.9	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-55.8	-40	171.2	-26.8	32.6	0	0	0	114.2	S757 V758 N764 N765	S757-P761 WeakPolarHBondContact O-CD 3.48Å; V758-P761 VanDerWaalsContact O-CD 3.32Å; V758-P761 WeakPolarHBondContact O-CD 3.29Å; P761-N764 PolarHBondContact O-N 2.89Å; P761-N765 VanDerWaalsContact O-CG 3.29Å; P761-N765 PolarHBondContact O-N 2.86Å; P761-N765 PolarHBondContact O-ND2 3.23Å
762	M	89.3	Confident	90.3	Very high	10 Å²	10	43.6 Å²	43.6	5%	0.049	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-44.4	179.5	-71.1	173.9	169.2	0	0	111.9	K66 I67 I70 L71 L409 V758 I759 T760 N764 N765 L766	K66-M762 VanDerWaalsContact O-CE 3.3Å; K66-M762 WeakPolarHBondContact O-CE 3.39Å; I67-M762 HydrophobicContact CB-CE 4.44Å; I67-M762 HydrophobicContact CB-SD 4.18Å; I67-M762 HydrophobicContact CG1-CB 4.22Å; I67-M762 HydrophobicContact CG1-CE 4.13Å; I67-M762 HydrophobicContact CG1-CG 4.02Å; I67-M762 HydrophobicContact CG1-SD 3.52Å; I67-M762 VanDerWaalsContact CG1-SD 3.52Å; I67-M762 HydrophobicContact CG2-SD 4.5Å; I70-M762 HydrophobicContact CB-CE 3.94Å; I70-M762 HydrophobicContact CD1-CE 3.8Å; I70-M762 HydrophobicContact CG1-CE 4.37Å; I70-M762 HydrophobicContact CG2-CE 4.49Å; L71-M762 HydrophobicContact CG-SD 4.45Å; L409-M762 HydrophobicContact CD1-CB 3.95Å; V758-M762 HydrophobicContact CG1-CE 3.31Å; V758-M762 HydrophobicContact CG1-CG 4.34Å; V758-M762 HydrophobicContact CG1-SD 3.65Å; V758-M762 WeakPolarHBondContact O-CG 3.32Å; V758-M762 PolarHBondContact O-N 2.95Å; I759-M762 PolarHBondContact O-N 3.33Å; T760-M762 VanDerWaalsContact C-N 3.31Å; T760-M762 PolarHBondContact O-N 3.15Å; M762-N764 PolarHBondContact O-N 3.3Å; M762-N765 WeakPolarHBondContact O-CB 3.5Å; M762-N765 PolarHBondContact O-N 3.2Å; M762-L766 WeakPolarHBondContact O-CG 3.45Å; M762-L766 PolarHBondContact O-N 2.94Å
763	K	92.9	Very high	90.9	Very high	20 Å²	20	43 Å²	43	9%	0.087	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-44.3	173.6	-79.3	174.5	54.7	-173.7	0	112.3	Y406 L409 N410 I759 T760 N765 L766 A767	Y406-K763 HydrophobicContact CD2-CB 3.94Å; Y406-K763 HydrophobicContact CD2-CG 4.06Å; Y406-K763 WeakPolarHBondContact CD2-O 3.49Å; Y406-K763 HydrophobicContact CE2-CB 3.6Å; Y406-K763 HydrophobicContact CE2-CG 4Å; Y406-K763 WeakPolarHBondContact CE2-O 3.44Å; L409-K763 HydrophobicContact CB-CD 4.19Å; L409-K763 HydrophobicContact CB-CG 3.82Å; L409-K763 HydrophobicContact CD1-CG 4.06Å; N410-K763 WeakPolarHBondContact OD1-CE 3.46Å; N410-K763 PolarHBondContact OD1-NZ 3.24Å; I759-K763 HydrophobicContact CG2-CD 3.79Å; I759-K763 HydrophobicContact CG2-CG 4.25Å; I759-K763 WeakPolarHBondContact O-CG 3.42Å; I759-K763 PolarHBondContact O-N 3.3Å; T760-K763 PolarHBondContact O-N 2.87Å; K763-N765 VanDerWaalsContact C-N 3.31Å; K763-N765 PolarHBondContact O-N 3.47Å; K763-L766 PolarHBondContact O-N 2.92Å; K763-A767 PolarHBondContact O-N 2.92Å
764	N	93.3	Very high	91.5	Very high	91 Å²	91	42.4 Å²	42.4	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-41.3	177	-69.5	-13.3	0	0	0	111.5	T760 P761 M762 L766 A767 M768	T760-N764 PolarHBondContact O-N 3.29Å; P761-N764 PolarHBondContact O-N 2.89Å; M762-N764 PolarHBondContact O-N 3.3Å; N764-L766 PolarHBondContact O-N 3.45Å; N764-A767 PolarHBondContact O-N 3.24Å; N764-M768 WeakPolarHBondContact O-CG 3.34Å; N764-M768 PolarHBondContact O-N 2.94Å
765	N	93.1	Very high	92.1	Very high	73 Å²	73	41.7 Å²	41.7	39%	0.39	24%	0.244	S	C	.	.	H	α-helix	trans	-62	-42.2	175.5	-70.6	-24.4	0	0	0	112.1	P761 M762 K763 M768 L769	P761-N765 VanDerWaalsContact O-CG 3.29Å; P761-N765 PolarHBondContact O-N 2.86Å; P761-N765 PolarHBondContact O-ND2 3.23Å; M762-N765 WeakPolarHBondContact O-CB 3.5Å; M762-N765 PolarHBondContact O-N 3.2Å; K763-N765 VanDerWaalsContact C-N 3.31Å; K763-N765 PolarHBondContact O-N 3.47Å; N765-M768 PolarHBondContact O-N 3.34Å; N765-L769 VanDerWaalsContact O-CG 3.3Å; N765-L769 WeakPolarHBondContact O-CG 3.43Å; N765-L769 PolarHBondContact O-N 3.41Å
766	L	94.6	Very high	92.9	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-43	175.8	-71.2	165.1	0	0	0	111.9	I67 I405 Y406 L409 M762 K763 N764 M768 L769 R770	I67-L766 HydrophobicContact CD1-CD1 4.29Å; I405-L766 HydrophobicContact CB-CD1 4.06Å; I405-L766 HydrophobicContact CB-CD2 4.38Å; I405-L766 HydrophobicContact CG2-CD1 3.49Å; I405-L766 VanDerWaalsContact CG2-CD1 3.49Å; I405-L766 HydrophobicContact CG2-CD2 4.22Å; Y406-L766 HydrophobicContact CD2-CB 4.28Å; L409-L766 HydrophobicContact CD1-CD1 3.71Å; M762-L766 WeakPolarHBondContact O-CG 3.45Å; M762-L766 PolarHBondContact O-N 2.94Å; K763-L766 PolarHBondContact O-N 2.92Å; N764-L766 PolarHBondContact O-N 3.45Å; L766-M768 VanDerWaalsContact C-N 3.31Å; L766-M768 PolarHBondContact O-N 2.94Å; L766-L769 PolarHBondContact O-N 2.92Å; L766-R770 WeakPolarHBondContact O-CB 3.28Å; L766-R770 PolarHBondContact O-N 3.47Å
767	A	95.4	Very high	93.4	Very high	50 Å²	50	44.9 Å²	44.9	41%	0.413	25%	0.25	S	S	.	.	H	α-helix	trans	-62	-39	175.5	0	0	0	0	0	111.9	Y406 K763 N764 R770 G771	Y406-A767 HydrophobicContact CE2-CB 4.35Å; K763-A767 PolarHBondContact O-N 2.92Å; N764-A767 PolarHBondContact O-N 3.24Å; A767-R770 PolarHBondContact O-N 3.39Å; A767-G771 PolarHBondContact O-N 3.07Å
768	M	96.2	Very high	93.8	Very high	119 Å²	119	44.7 Å²	44.7	59%	0.586	24%	0.243	S	C	*	.	H	α-helix	trans	-65	-44.5	173.3	-73.4	-170.8	73.5	0	0	112.3	N764 N765 L766 R770 G771 D772	N764-M768 WeakPolarHBondContact O-CG 3.34Å; N764-M768 PolarHBondContact O-N 2.94Å; N765-M768 PolarHBondContact O-N 3.34Å; L766-M768 VanDerWaalsContact C-N 3.31Å; L766-M768 PolarHBondContact O-N 2.94Å; M768-R770 VanDerWaalsContact C-N 3.28Å; M768-R770 PolarHBondContact O-N 3.18Å; M768-G771 CarbonylContact O-C 3.59Å; M768-G771 PolarHBondContact O-N 2.75Å; M768-G771 VanDerWaalsContact O-N 3.17Å; M768-D772 PolarHBondContact O-N 3.38Å
769	L	96.7	Very high	94.3	Very high	5 Å²	5	48 Å²	48	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-63.5	-37.5	177.2	-71.4	167.7	0	0	0	111.8	I56 R59 I60 C63 N765 L766 D772 L773	I56-L769 HydrophobicContact CG2-CD2 4.45Å; R59-L769 HydrophobicContact CB-CD2 3.49Å; R59-L769 VanDerWaalsContact CB-CD2 3.49Å; I60-L769 HydrophobicContact CG1-CB 4.32Å; I60-L769 HydrophobicContact CG1-CD1 3.94Å; I60-L769 HydrophobicContact CG1-CD2 4.41Å; I60-L769 HydrophobicContact CG1-CG 4.45Å; C63-L769 HydrophobicContact CB-CD1 4.16Å; N765-L769 VanDerWaalsContact O-CG 3.3Å; N765-L769 WeakPolarHBondContact O-CG 3.43Å; N765-L769 PolarHBondContact O-N 3.41Å; L766-L769 PolarHBondContact O-N 2.92Å; L769-D772 PolarHBondContact O-N 3.01Å; L769-L773 WeakPolarHBondContact O-CG 3.38Å; L769-L773 PolarHBondContact O-N 3.5Å; L769-L773 VanDerWaalsContact O-N 3.09Å
770	R	97.3	Very high	94.6	Very high	50 Å²	50	49.7 Å²	49.7	19%	0.189	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-47.1	171.7	175.5	54.9	-170.1	-129.8	8.7	111.5	K399 C402 D403 L766 A767 M768 D772 L773 D774	K399-R770 VanDerWaalsContact CB-CZ 3.44Å; K399-R770 PolarHBondContact O-NH1 3.28Å; C402-R770 HydrophobicContact CB-CB 4.17Å; D403-R770 IonicContact OD1-CZ 2.92Å; D403-R770 IonicContact OD1-NE 3.07Å; D403-R770 IonicContact OD1-NH1 2.66Å; D403-R770 PolarHBondContact OD1-NH1 3.25Å; D403-R770 IonicContact OD2-CZ 3.66Å; D403-R770 IonicContact OD2-NH1 3.97Å; D403-R770 PolarHBondContact OD2-NH1 3.04Å; D403-R770 IonicContact OD2-NH2 3.73Å; L766-R770 WeakPolarHBondContact O-CB 3.28Å; L766-R770 PolarHBondContact O-N 3.47Å; A767-R770 PolarHBondContact O-N 3.39Å; M768-R770 VanDerWaalsContact C-N 3.28Å; M768-R770 PolarHBondContact O-N 3.18Å; R770-D772 VanDerWaalsContact C-N 3.3Å; R770-D772 PolarHBondContact O-N 3.1Å; R770-L773 WeakPolarHBondContact O-CB 3.42Å; R770-L773 PolarHBondContact O-N 3.08Å; R770-L773 VanDerWaalsContact O-N 3.14Å; R770-D774 IonicContact NE-OD2 3.79Å; R770-D774 PolarHBondContact NE-OD2 3.05Å; R770-D774 PolarHBondContact O-N 3.28Å
771	G	96.8	Very high	94.9	Very high	25 Å²	25	46.9 Å²	46.9	26%	0.258	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-37.4	174	0	0	0	0	0	113.2	A767 M768 L773 D774 N775	A767-G771 PolarHBondContact O-N 3.07Å; M768-G771 CarbonylContact O-C 3.59Å; M768-G771 PolarHBondContact O-N 2.75Å; M768-G771 VanDerWaalsContact O-N 3.17Å; G771-L773 VanDerWaalsContact C-N 3.32Å; G771-L773 PolarHBondContact O-N 3Å; G771-D774 PolarHBondContact O-N 3.36Å; G771-N775 WeakPolarHBondContact O-CB 3.28Å; G771-N775 VanDerWaalsContact O-CG 3.24Å; G771-N775 PolarHBondContact O-N 3.26Å; G771-N775 PolarHBondContact O-ND2 2.73Å
772	D	97.2	Very high	94.9	Very high	31 Å²	31	51.6 Å²	51.6	17%	0.166	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-36.2	175.1	-75.3	-25.8	0	0	0	112	I56 R59 M768 L769 R770 N775 F776	I56-D772 HydrophobicContact CD1-CB 3.97Å; I56-D772 HydrophobicContact CG1-CB 4.07Å; R59-D772 IonicContact CZ-OD2 3.95Å; R59-D772 IonicContact NH1-OD2 2.74Å; R59-D772 PolarHBondContact NH1-OD2 2.85Å; R59-D772 IonicContact NH2-OD2 3.55Å; R59-D772 PolarHBondContact NH2-OD2 3.36Å; M768-D772 PolarHBondContact O-N 3.38Å; L769-D772 PolarHBondContact O-N 3.01Å; R770-D772 VanDerWaalsContact C-N 3.3Å; R770-D772 PolarHBondContact O-N 3.1Å; D772-N775 PolarHBondContact O-N 3.26Å; D772-F776 WeakPolarHBondContact O-CB 3.48Å; D772-F776 PolarHBondContact O-N 3.41Å
773	L	97.5	Very high	94.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.6	-36.8	173.3	-68.6	168.8	0	0	0	112.3	I53 I56 I60 V395 K399 L769 R770 G771 F776 R777	I53-L773 HydrophobicContact CD1-CD2 3.62Å; I56-L773 HydrophobicContact CD1-CD2 4.32Å; I56-L773 HydrophobicContact CG2-CD2 3.68Å; I56-L773 HydrophobicContact CG2-CG 3.85Å; I60-L773 HydrophobicContact CD1-CD1 4.35Å; V395-L773 HydrophobicContact CG1-CB 4.4Å; K399-L773 HydrophobicContact CB-CD1 4.48Å; K399-L773 HydrophobicContact CG-CB 3.87Å; K399-L773 HydrophobicContact CG-CD1 3.91Å; L769-L773 WeakPolarHBondContact O-CG 3.38Å; L769-L773 PolarHBondContact O-N 3.5Å; L769-L773 VanDerWaalsContact O-N 3.09Å; R770-L773 WeakPolarHBondContact O-CB 3.42Å; R770-L773 PolarHBondContact O-N 3.08Å; R770-L773 VanDerWaalsContact O-N 3.14Å; G771-L773 VanDerWaalsContact C-N 3.32Å; G771-L773 PolarHBondContact O-N 3Å; L773-F776 PolarHBondContact O-N 3.5Å; L773-R777 PolarHBondContact O-N 3.46Å
774	D	96.6	Very high	94.5	Very high	56 Å²	56	54.9 Å²	54.9	30%	0.299	28%	0.278	S	S	.	.	H	α-helix	trans	-66.3	-42	172.6	-76.5	-46.5	0	0	0	111.7	K399 R770 G771 F776 R777 N778	K399-D774 WeakPolarHBondContact CE-OD1 3.41Å; K399-D774 IonicContact NZ-OD1 2.77Å; K399-D774 PolarHBondContact NZ-OD1 2.81Å; R770-D774 IonicContact NE-OD2 3.79Å; R770-D774 PolarHBondContact NE-OD2 3.05Å; R770-D774 PolarHBondContact O-N 3.28Å; G771-D774 PolarHBondContact O-N 3.36Å; D774-F776 VanDerWaalsContact C-N 3.33Å; D774-F776 PolarHBondContact O-N 3.34Å; D774-R777 PolarHBondContact O-N 3.26Å; D774-N778 PolarHBondContact O-N 3.4Å; D774-N778 PolarHBondContact O-ND2 2.85Å
775	N	96.2	Very high	93.8	Very high	85 Å²	85	57.4 Å²	57.4	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-61.9	-41.8	173	-72.1	-26	0	0	0	111.4	G771 D772 R777 N778 N779	G771-N775 WeakPolarHBondContact O-CB 3.28Å; G771-N775 VanDerWaalsContact O-CG 3.24Å; G771-N775 PolarHBondContact O-N 3.26Å; G771-N775 PolarHBondContact O-ND2 2.73Å; D772-N775 PolarHBondContact O-N 3.26Å; N775-R777 VanDerWaalsContact C-N 3.35Å; N775-R777 PolarHBondContact O-N 3.22Å; N775-N778 PolarHBondContact O-N 3.31Å; N775-N779 VanDerWaalsContact O-CB 3.31Å; N775-N779 WeakPolarHBondContact O-CB 3.44Å; N775-N779 VanDerWaalsContact O-CG 3.25Å; N775-N779 PolarHBondContact O-N 3.12Å; N775-N779 PolarHBondContact O-ND2 3.33Å
776	F	96.8	Very high	93.9	Very high	3 Å²	3	56.6 Å²	56.6	1%	0.013	29%	0.286	C	S	.	.	H	α-helix	trans	-59.1	-47.5	174.2	-174.7	-83.6	0	0	0	111.2	A49 K52 I53 I56 F391 V395 D772 L773 D774 N778 N779 Y780 L781	A49-F776 HydrophobicContact CB-CE2 4.05Å; A49-F776 HydrophobicContact CB-CZ 3.98Å; A49-F776 VanDerWaalsContact O-CE2 3.24Å; A49-F776 WeakPolarHBondContact O-CE2 3.41Å; K52-F776 HydrophobicContact CB-CD2 4.28Å; K52-F776 HydrophobicContact CB-CE2 4.3Å; K52-F776 HydrophobicContact CG-CD2 4.12Å; I53-F776 HydrophobicContact CB-CD2 4.24Å; I53-F776 HydrophobicContact CB-CE2 3.77Å; I53-F776 HydrophobicContact CB-CZ 3.96Å; I53-F776 HydrophobicContact CD1-CG 4.44Å; I53-F776 HydrophobicContact CG2-CE2 4.45Å; I53-F776 HydrophobicContact CG2-CZ 4.41Å; I56-F776 HydrophobicContact CD1-CB 4.32Å; F391-F776 HydrophobicContact CB-CE1 3.91Å; F391-F776 HydrophobicContact CB-CZ 4.09Å; F391-F776 AromaticContact CD2-CZ 3.95Å; F391-F776 HydrophobicContact CD2-CZ 3.95Å; F391-F776 HydrophobicContact CG-CZ 4.19Å; V395-F776 HydrophobicContact CG2-CD1 3.35Å; V395-F776 HydrophobicContact CG2-CE1 3.67Å; V395-F776 HydrophobicContact CG2-CG 4.3Å; D772-F776 WeakPolarHBondContact O-CB 3.48Å; D772-F776 PolarHBondContact O-N 3.41Å; L773-F776 PolarHBondContact O-N 3.5Å; D774-F776 VanDerWaalsContact C-N 3.33Å; D774-F776 PolarHBondContact O-N 3.34Å; F776-N778 VanDerWaalsContact C-N 3.34Å; F776-N778 PolarHBondContact O-N 3.18Å; F776-N779 PolarHBondContact O-N 3.21Å; F776-Y780 AromaticContact CD2-CD2 3.54Å; F776-Y780 HydrophobicContact CD2-CD2 3.54Å; F776-Y780 HydrophobicContact CD2-CE2 4.01Å; F776-Y780 HydrophobicContact CD2-CG 4.37Å; F776-Y780 AromaticContact CE2-CD2 3.62Å; F776-Y780 HydrophobicContact CE2-CD2 3.62Å; F776-Y780 HydrophobicContact CE2-CE2 4.15Å; F776-Y780 HydrophobicContact CE2-CG 4.06Å; F776-Y780 HydrophobicContact CG-CD2 4.05Å; F776-Y780 HydrophobicContact CZ-CD2 4.23Å; F776-Y780 HydrophobicContact CZ-CG 4.27Å; F776-Y780 WeakPolarHBondContact O-CB 3.23Å; F776-Y780 PolarHBondContact O-N 3.3Å; F776-L781 HydrophobicContact CD1-CD1 4.37Å; F776-L781 HydrophobicContact CE1-CD1 4.34Å; F776-L781 HydrophobicContact CE1-CG 4.27Å
777	R	95.9	Very high	93.8	Very high	103 Å²	103	59.5 Å²	59.5	39%	0.389	30%	0.301	S	S	.	.	I	π-helix	trans	-58.6	-45.5	176.6	-173.9	173.6	171.9	177	-10	111.6	V395 E396 L773 D774 N775 L781 R782	V395-R777 HydrophobicContact CG1-CB 4.21Å; E396-R777 IonicContact OE2-NH1 2.81Å; L773-R777 PolarHBondContact O-N 3.46Å; D774-R777 PolarHBondContact O-N 3.26Å; N775-R777 VanDerWaalsContact C-N 3.35Å; N775-R777 PolarHBondContact O-N 3.22Å; R777-L781 HydrophobicContact CB-CD1 4.34Å; R777-L781 HydrophobicContact CG-CB 4.29Å; R777-L781 HydrophobicContact CG-CD1 4.18Å; R777-L781 WeakPolarHBondContact O-CB 3.41Å; R777-L781 PolarHBondContact O-N 2.93Å; R777-L781 VanDerWaalsContact O-N 3.1Å; R777-R782 WeakPolarHBondContact O-CB 3.46Å; R777-R782 PolarHBondContact O-N 3.38Å
778	N	95	Very high	93.8	Very high	67 Å²	67	60 Å²	60	36%	0.358	30%	0.295	S	S	.	.	I	π-helix	trans	-68.2	-37.1	-179.5	-73	-39.6	0	0	0	113.2	D774 N775 F776 R782 P783	D774-N778 PolarHBondContact O-N 3.4Å; D774-N778 PolarHBondContact O-ND2 2.85Å; N775-N778 PolarHBondContact O-N 3.31Å; F776-N778 VanDerWaalsContact C-N 3.34Å; F776-N778 PolarHBondContact O-N 3.18Å; N778-R782 PolarHBondContact OD1-NH1 3.41Å; N778-P783 WeakPolarHBondContact O-CD 3.47Å
779	N	94	Very high	93.6	Very high	94 Å²	94	56.5 Å²	56.5	50%	0.503	28%	0.277	S	S	.	.	I	π-helix	trans	-86.5	-35.3	-174.8	-67.4	-13.2	0	0	0	113.1	R45 N775 F776 P783	R45-N779 PolarHBondContact NH2-O 3.07Å; N775-N779 VanDerWaalsContact O-CB 3.31Å; N775-N779 WeakPolarHBondContact O-CB 3.44Å; N775-N779 VanDerWaalsContact O-CG 3.25Å; N775-N779 PolarHBondContact O-N 3.12Å; N775-N779 PolarHBondContact O-ND2 3.33Å; F776-N779 PolarHBondContact O-N 3.21Å; N779-P783 WeakPolarHBondContact O-CG 3.49Å
780	Y	93.6	Very high	93.4	Very high	34 Å²	34	59.8 Å²	59.8	13%	0.133	29%	0.293	C	S	.	.	I	π-helix	trans	-111.8	-32.8	-171.6	-64.1	-79.5	0	0	0	114	R45 A49 K52 I387 F776 Y784	R45-Y780 HydrophobicContact CG-CD1 4.26Å; R45-Y780 HydrophobicContact CG-CE1 4.29Å; A49-Y780 HydrophobicContact CB-CD1 3.53Å; A49-Y780 HydrophobicContact CB-CE1 3.86Å; A49-Y780 HydrophobicContact CB-CG 3.93Å; K52-Y780 HydrophobicContact CG-CE2 4.45Å; I387-Y780 WeakPolarHBondContact CG2-O 3.32Å; F776-Y780 AromaticContact CD2-CD2 3.54Å; F776-Y780 HydrophobicContact CD2-CD2 3.54Å; F776-Y780 HydrophobicContact CD2-CE2 4.01Å; F776-Y780 HydrophobicContact CD2-CG 4.37Å; F776-Y780 AromaticContact CE2-CD2 3.62Å; F776-Y780 HydrophobicContact CE2-CD2 3.62Å; F776-Y780 HydrophobicContact CE2-CE2 4.15Å; F776-Y780 HydrophobicContact CE2-CG 4.06Å; F776-Y780 HydrophobicContact CG-CD2 4.05Å; F776-Y780 HydrophobicContact CZ-CD2 4.23Å; F776-Y780 HydrophobicContact CZ-CG 4.27Å; F776-Y780 WeakPolarHBondContact O-CB 3.23Å; F776-Y780 PolarHBondContact O-N 3.3Å; Y780-Y784 WeakPolarHBondContact O-CD2 3.26Å; Y780-Y784 VanDerWaalsContact O-CE2 3.28Å; Y780-Y784 WeakPolarHBondContact O-CE2 3.08Å
781	L	93.4	Very high	93.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.3	C	S	.	.	I	π-helix	trans	-97.3	-48.8	-176.4	-62.5	170.3	0	0	0	112.3	I387 L388 D392 V395 F776 R777 Y784 L785	I387-L781 HydrophobicContact CG2-CD2 3.86Å; I387-L781 WeakPolarHBondContact O-CD2 3.46Å; L388-L781 HydrophobicContact CD2-CD2 3.98Å; D392-L781 HydrophobicContact CB-CD1 4.22Å; D392-L781 HydrophobicContact CB-CD2 4.19Å; V395-L781 HydrophobicContact CB-CD1 4.25Å; V395-L781 HydrophobicContact CG1-CD1 4.47Å; V395-L781 HydrophobicContact CG2-CD1 3.97Å; F776-L781 HydrophobicContact CD1-CD1 4.37Å; F776-L781 HydrophobicContact CE1-CD1 4.34Å; F776-L781 HydrophobicContact CE1-CG 4.27Å; R777-L781 HydrophobicContact CB-CD1 4.34Å; R777-L781 HydrophobicContact CG-CB 4.29Å; R777-L781 HydrophobicContact CG-CD1 4.18Å; R777-L781 WeakPolarHBondContact O-CB 3.41Å; R777-L781 PolarHBondContact O-N 2.93Å; R777-L781 VanDerWaalsContact O-N 3.1Å; L781-Y784 WeakPolarHBondContact O-CB 3.05Å; L781-Y784 PolarHBondContact O-N 3.14Å; L781-L785 HydrophobicContact CB-CD1 4.16Å; L781-L785 PolarHBondContact O-N 3.4Å; L781-L785 VanDerWaalsContact O-N 3.13Å
782	R	91.2	Very high	92.9	Very high	165 Å²	165	62.9 Å²	62.9	62%	0.623	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.6	-176.4	-169.4	177	-176.8	166.9	-0.1	115.2	R777 N778 Y784	R777-R782 WeakPolarHBondContact O-CB 3.46Å; R777-R782 PolarHBondContact O-N 3.38Å; N778-R782 PolarHBondContact OD1-NH1 3.41Å; R782-Y784 PolarHBondContact O-N 3.38Å; R782-Y784 VanDerWaalsContact O-N 3.07Å
783	P	89.6	Confident	92.6	Very high	63 Å²	63	65.4 Å²	65.4	41%	0.409	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.8	173.4	-24.8	36.9	0	0	0	114	N778 N779	N778-P783 WeakPolarHBondContact O-CD 3.47Å; N779-P783 WeakPolarHBondContact O-CG 3.49Å
784	Y	83.4	Confident	92.2	Very high	36 Å²	36	70.8 Å²	70.8	14%	0.141	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-17.1	-173	-58.5	-50.5	0	0	0	114.8	R45 K384 I387 Y780 L781 R782	R45-Y784 WeakPolarHBondContact CD-OH 3.35Å; R45-Y784 PolarHBondContact NE-OH 3.48Å; K384-Y784 HydrophobicContact CB-CD1 4.12Å; K384-Y784 HydrophobicContact CB-CE1 4.21Å; K384-Y784 HydrophobicContact CB-CG 4.4Å; K384-Y784 HydrophobicContact CD-CD1 3.68Å; K384-Y784 HydrophobicContact CD-CE1 4.4Å; K384-Y784 HydrophobicContact CD-CG 4.15Å; K384-Y784 WeakPolarHBondContact CE-O 3.32Å; K384-Y784 HydrophobicContact CG-CD1 3.62Å; K384-Y784 HydrophobicContact CG-CD2 4.39Å; K384-Y784 HydrophobicContact CG-CE1 4.22Å; K384-Y784 HydrophobicContact CG-CG 3.72Å; I387-Y784 HydrophobicContact CD1-CE2 4.08Å; I387-Y784 HydrophobicContact CG2-CD2 4.44Å; Y780-Y784 WeakPolarHBondContact O-CD2 3.26Å; Y780-Y784 VanDerWaalsContact O-CE2 3.28Å; Y780-Y784 WeakPolarHBondContact O-CE2 3.08Å; L781-Y784 WeakPolarHBondContact O-CB 3.05Å; L781-Y784 PolarHBondContact O-N 3.14Å; R782-Y784 PolarHBondContact O-N 3.38Å; R782-Y784 VanDerWaalsContact O-N 3.07Å
785	L	80.5	Confident	91.8	Very high	144 Å²	144	72.2 Å²	72.2	75%	0.754	34%	0.343	S	S	*	.			trans	-85.6	0	169.6	-66.2	172	0	0	0	109.5	L388 L781	L388-L785 HydrophobicContact CD2-CD2 3.76Å; L388-L785 HydrophobicContact CD2-CG 3.8Å; L781-L785 HydrophobicContact CB-CD1 4.16Å; L781-L785 PolarHBondContact O-N 3.4Å; L781-L785 VanDerWaalsContact O-N 3.13Å

Retrieved 785 of 785 residues in 1318.1 ms (Link to these results)

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