A0A087XJF8_POEFO Loading...

Dpy-19 like C-mannosyltransferase 3

AlphaFold DB , UniProt , Accession A0A087XJF8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 735 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	29.2	Very low	238 Å²	238	173.3 Å²	173.3	100%	1.172	85%	0.85	S	S	*	*				0	110.3	0	-71.5	-176.2	-91.1	0	0	107.2
2	T	31.7	Very low	28.9	Very low	123 Å²	123	164.8 Å²	164.8	76%	0.755	84%	0.84	S	S	*	*			cis	-162.4	129	0.5	-33.3	0	0	0	0	106.7
3	S	29.4	Very low	28.8	Very low	94 Å²	94	166.8 Å²	166.8	66%	0.657	84%	0.84	S	S	*	*			trans	49.5	113.5	152.1	57.9	0	0	0	0	121.3
4	L	29.6	Very low	28.5	Very low	158 Å²	158	167.6 Å²	167.6	83%	0.827	84%	0.839	S	S	*	*				77.6	116.1	73.8	-77.9	160.2	0	0	0	115.2
5	R	29.7	Very low	28.3	Very low	248 Å²	248	163.2 Å²	163.2	94%	0.936	84%	0.839	S	S	*	*				-168.9	124.6	108.3	-116.1	177	175.8	171.6	-0.5	113.8
6	Q	30.4	Very low	28	Very low	163 Å²	163	161.4 Å²	161.4	76%	0.762	84%	0.838	S	S	*	*			trans	-67.1	155.1	163.6	-71.1	167.8	-44.6	0	0	111.8
7	R	28.2	Very low	28	Very low	257 Å²	257	159.5 Å²	159.5	97%	0.97	84%	0.838	S	S	*	*				-147.7	135.5	123.3	-120.2	178	-176.6	179.5	0.4	111.4
8	K	29.8	Very low	27.8	Very low	204 Å²	204	155.7 Å²	155.7	89%	0.887	83%	0.834	S	S	*	*			trans	-114.1	146.9	-172.9	-158.9	-175.3	-166.1	-178.8	0	107.1
9	G	26.3	Very low	27.7	Very low	74 Å²	74	155.1 Å²	155.1	76%	0.763	84%	0.835	S	S	*	*			trans	149.2	141	157.3	0	0	0	0	0	113.4
10	S	24.6	Very low	27.4	Very low	98 Å²	98	156.1 Å²	156.1	69%	0.685	84%	0.835	S	S	*	*			cis	174.6	128.2	-24.8	145.9	0	0	0	0	105.1
11	R	27.2	Very low	27.3	Very low	249 Å²	249	155.6 Å²	155.6	94%	0.94	84%	0.837	S	S	*	*			trans	62.3	135.5	150.1	-65.1	173.9	170.9	-176.5	-3.4	118.5
12	G	25.7	Very low	26.6	Very low	71 Å²	71	152.8 Å²	152.8	73%	0.732	82%	0.821	S	S	*	*			cis	170.2	-176.6	3.1	0	0	0	0	0	114.6
13	K	26.9	Very low	26.2	Very low	192 Å²	192	151.5 Å²	151.5	84%	0.835	82%	0.823	S	S	*	*			trans	69.7	104.2	160.3	-69.7	-174.6	170.6	-173.7	0	117.9
14	E	25.3	Very low	25.9	Very low	178 Å²	178	155.9 Å²	155.9	83%	0.832	83%	0.832	S	S	*	*				77.8	107.7	76.9	-84.3	-179.5	164.3	0	0	113.7
15	A	24.8	Very low	25.7	Very low	101 Å²	101	157.1 Å²	157.1	84%	0.835	83%	0.834	S	S	*	*				178.4	111.4	121.5	0	0	0	0	0	110.7
16	T	23.5	Very low	25.4	Very low	135 Å²	135	150.9 Å²	150.9	83%	0.828	83%	0.828	S	S	*	*			trans	-70.3	155.7	157.1	31.9	0	0	0	0	110.7
17	P	28	Very low	25	Very low	128 Å²	128	151 Å²	151	83%	0.831	83%	0.834	S	S	*	*				-142.1	160.9	92.5	30.6	-10.8	0	0	0	115.3
18	A	25.7	Very low	24.7	Very low	92 Å²	92	144.1 Å²	144.1	76%	0.76	83%	0.825	S	S	*	*			trans	-61.3	154.8	177.4	0	0	0	0	0	114.4
19	V	24.4	Very low	24.6	Very low	143 Å²	143	139.6 Å²	139.6	87%	0.867	82%	0.817	S	S	*	*			trans	-165.4	138.1	131.8	168.8	0	0	0	0	108.8
20	E	22.9	Very low	24.9	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	80%	0.803	S	S	*	*			trans	-55.4	144.5	176	-67.2	164.9	123.5	0	0	115.1
21	V	23.9	Very low	25.1	Very low	147 Å²	147	142.3 Å²	142.3	89%	0.891	80%	0.804	S	S	*	*			trans	-138.5	121.9	147.5	-180	0	0	0	0	109.1
22	Q	21.4	Very low	25.5	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	78%	0.784	S	S	*	*			trans	-64.8	145.4	176.4	-77	170.8	-31.2	0	0	113.3
23	A	23.1	Very low	26.4	Very low	95 Å²	95	137.3 Å²	137.3	79%	0.785	77%	0.772	S	S	*	*			trans	35.6	113	142.5	0	0	0	0	0	119.6
24	H	22.1	Very low	26.9	Very low	186 Å²	186	129.4 Å²	129.4	86%	0.861	74%	0.74	S	S	*	*			trans	-129.7	106.5	134.8	-140.1	-41.4	0	0	0	108.5	S26	H24-S26 PolarHBondContact O-N 3.3Å; H24-S26 VanDerWaalsContact O-N 3.16Å
25	E	25.5	Very low	27.7	Very low	184 Å²	184	122.7 Å²	122.7	86%	0.86	71%	0.71	S	S	*	*			trans	-49.9	117.8	165.9	-74.7	176.7	134	0	0	108.9
26	S	23.2	Very low	28.3	Very low	117 Å²	117	122.4 Å²	122.4	82%	0.818	69%	0.69	S	S	*	*			trans	-100.7	108.3	166.1	56.8	0	0	0	0	108.5	H24 C28	H24-S26 PolarHBondContact O-N 3.3Å; H24-S26 VanDerWaalsContact O-N 3.16Å; S26-C28 PolarHBondContact O-N 3.15Å; S26-C28 VanDerWaalsContact O-N 3.11Å
27	N	22.2	Very low	29.3	Very low	166 Å²	166	119.8 Å²	119.8	89%	0.888	67%	0.67	S	S	*	*			trans	-32.3	107.4	177.2	-84.8	-49.2	0	0	0	114.1
28	C	22.7	Very low	30.1	Very low	113 Å²	113	115.8 Å²	115.8	76%	0.764	64%	0.641	S	S	*	*			trans	-67.1	147.2	157.5	-158.5	0	0	0	0	109.4	S26	S26-C28 PolarHBondContact O-N 3.15Å; S26-C28 VanDerWaalsContact O-N 3.11Å
29	C	27.9	Very low	31.1	Very low	108 Å²	108	117 Å²	117	73%	0.73	63%	0.631	S	S	*	*			trans	90.7	120.7	163.7	-58.6	0	0	0	0	120.2
30	T	31.1	Very low	32	Very low	75 Å²	75	112.2 Å²	112.2	46%	0.46	61%	0.611	S	S	.	*			trans	86.9	79.8	154.5	58.6	0	0	0	0	119.7	R526	T30-R526 PolarHBondContact OG1-NH2 3.17Å
31	H	30	Very low	33.2	Very low	154 Å²	154	109.3 Å²	109.3	71%	0.713	60%	0.601	S	S	*	*	S	Bend	trans	-103.9	130.9	143.5	-90.9	-94.5	0	0	0	110
32	H	35.6	Very low	35	Very low	111 Å²	111	110.6 Å²	110.6	51%	0.514	59%	0.59	S	S	.	*			trans	32.6	98	159.1	-65.2	-90.4	0	0	0	118.8	D35	H32-D35 HydrophobicContact CB-CB 4.04Å; H32-D35 WeakPolarHBondContact CB-OD2 3.31Å; H32-D35 IonicContact CG-OD2 2.84Å; H32-D35 IonicContact ND1-OD2 3.88Å
33	H	43.7	Very low	37.7	Very low	105 Å²	105	105.1 Å²	105.1	49%	0.486	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	-28.4	172.3	-93.7	-68.7	0	0	0	117	D35	H33-D35 VanDerWaalsContact C-N 3.33Å
34	P	38.3	Very low	40.3	Very low	26 Å²	26	110.3 Å²	110.3	17%	0.169	57%	0.571	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	-21.1	176.7	28.7	-32.4	0	0	0	113.3
35	D	42.5	Very low	43.1	Very low	36 Å²	36	103.9 Å²	103.9	19%	0.193	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-81	-28.5	-177.8	-66.5	-20	0	0	0	111.9	H32 H33 I37 R235	H32-D35 HydrophobicContact CB-CB 4.04Å; H32-D35 WeakPolarHBondContact CB-OD2 3.31Å; H32-D35 IonicContact CG-OD2 2.84Å; H32-D35 IonicContact ND1-OD2 3.88Å; H33-D35 VanDerWaalsContact C-N 3.33Å; D35-I37 VanDerWaalsContact C-N 3.26Å; D35-I37 PolarHBondContact O-N 3.03Å; D35-R235 IonicContact OD1-NH1 3.65Å; D35-R235 PolarHBondContact OD1-NH1 3.02Å
36	K	37.5	Very low	45.6	Very low	95 Å²	95	96 Å²	96	41%	0.413	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.7	172.4	-69.5	-169.4	176.3	-161.5	0	114.3	Q39	K36-Q39 PolarHBondContact O-N 3.39Å
37	I	43	Very low	48.5	Very low	80 Å²	80	93 Å²	93	41%	0.41	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-37.1	-177.2	-62.4	174	0	0	0	111.3	D35 T50	D35-I37 VanDerWaalsContact C-N 3.26Å; D35-I37 PolarHBondContact O-N 3.03Å; I37-T50 HydrophobicContact CD1-CG2 3.81Å; I37-T50 HydrophobicContact CG1-CG2 4.13Å
38	L	45.5	Very low	51.6	Low	45 Å²	45	89.7 Å²	89.7	24%	0.236	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.5	177.9	-91.7	82.1	0	0	0	113.4	L238 Q242	L38-L238 HydrophobicContact CD2-CB 4.3Å; L38-L238 HydrophobicContact CD2-CD2 3.24Å; L38-L238 HydrophobicContact CD2-CG 3.6Å; L38-Q242 PolarHBondContact O-NE2 2.97Å; L38-Q242 VanDerWaalsContact O-NE2 3.15Å
39	Q	45.6	Very low	54.6	Low	116 Å²	116	88.8 Å²	88.8	54%	0.542	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-0.5	-171.9	-75.2	179.7	-17.1	0	0	114.5	K36 D41	K36-Q39 PolarHBondContact O-N 3.39Å; Q39-D41 VanDerWaalsContact C-N 3.27Å; Q39-D41 PolarHBondContact O-N 3.32Å
40	G	44.1	Very low	57.4	Low	44 Å²	44	84.6 Å²	84.6	45%	0.454	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	9.4	171.2	0	0	0	0	0	115.7	W42	G40-W42 PolarHBondContact O-N 3.14Å; G40-W42 VanDerWaalsContact O-N 3.15Å
41	D	48.5	Very low	60.3	Low	114 Å²	114	84.1 Å²	84.1	61%	0.61	43%	0.428	S	S	*	.			trans	-84.1	82.8	171.6	-87.9	-7.5	0	0	0	110	Q39 S43	Q39-D41 VanDerWaalsContact C-N 3.27Å; Q39-D41 PolarHBondContact O-N 3.32Å; D41-S43 PolarHBondContact O-N 2.91Å
42	W	60.7	Low	63.3	Low	173 Å²	173	80.2 Å²	80.2	66%	0.655	41%	0.412	S	S	*	.			trans	-82.4	89.4	-178.4	-62.5	91.4	0	0	0	111.6	G40 I47	G40-W42 PolarHBondContact O-N 3.14Å; G40-W42 VanDerWaalsContact O-N 3.15Å; W42-I47 HydrophobicContact CB-CD1 4.12Å; W42-I47 HydrophobicContact CB-CG1 4.23Å; W42-I47 HydrophobicContact CD2-CG1 4.28Å; W42-I47 HydrophobicContact CE3-CB 4.48Å; W42-I47 HydrophobicContact CE3-CD1 4.24Å; W42-I47 HydrophobicContact CE3-CG1 3.38Å; W42-I47 HydrophobicContact CZ3-CG1 4.04Å
43	S	78.3	Confident	66.1	Low	64 Å²	64	74.9 Å²	74.9	45%	0.448	39%	0.387	S	S	.	.			trans	-74.8	144.7	159.7	77.1	0	0	0	0	109.9	D41 G45 A46 I47	D41-S43 PolarHBondContact O-N 2.91Å; S43-G45 PolarHBondContact O-N 2.76Å; S43-G45 VanDerWaalsContact O-N 3.14Å; S43-A46 WeakPolarHBondContact O-CB 3.46Å; S43-A46 PolarHBondContact O-N 3.07Å; S43-A46 PolarHBondContact OG-N 3.16Å; S43-I47 PolarHBondContact O-N 3.11Å
44	W	79.1	Confident	68.5	Low	205 Å²	205	76.3 Å²	76.3	78%	0.777	39%	0.388	S	S	*	.	H	α-helix	trans	-52.1	-37.2	177.2	-78.1	103.4	0	0	0	113	I47 I48	W44-I47 HydrophobicContact CE3-CD1 4.32Å; W44-I47 PolarHBondContact O-N 3.2Å; W44-I48 VanDerWaalsContact O-CG1 3.31Å; W44-I48 WeakPolarHBondContact O-CG1 3.23Å; W44-I48 PolarHBondContact O-N 3.34Å
45	G	80.2	Confident	71.3	Confident	50 Å²	50	78.8 Å²	78.8	52%	0.515	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-37.3	175	0	0	0	0	0	113.7	S43 W49	S43-G45 PolarHBondContact O-N 2.76Å; S43-G45 VanDerWaalsContact O-N 3.14Å; G45-W49 VanDerWaalsContact O-CB 3.28Å; G45-W49 WeakPolarHBondContact O-CB 3.49Å; G45-W49 PolarHBondContact O-N 3.15Å
46	A	77.9	Confident	73.9	Confident	18 Å²	18	78.9 Å²	78.9	15%	0.149	41%	0.408	C	S	.	.	H	α-helix	trans	-70	-38.1	175.9	0	0	0	0	0	111.9	S43 T50	S43-A46 WeakPolarHBondContact O-CB 3.46Å; S43-A46 PolarHBondContact O-N 3.07Å; S43-A46 PolarHBondContact OG-N 3.16Å; A46-T50 WeakPolarHBondContact O-CB 3.29Å; A46-T50 VanDerWaalsContact O-CG2 3.3Å; A46-T50 WeakPolarHBondContact O-CG2 3.28Å; A46-T50 PolarHBondContact O-N 3.32Å; A46-T50 PolarHBondContact O-OG1 3Å
47	I	84.9	Confident	76.7	Confident	56 Å²	56	74.4 Å²	74.4	29%	0.287	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-52.3	173.2	-65	165.3	0	0	0	110.1	W42 S43 W44 W49 T50 S51	W42-I47 HydrophobicContact CB-CD1 4.12Å; W42-I47 HydrophobicContact CB-CG1 4.23Å; W42-I47 HydrophobicContact CD2-CG1 4.28Å; W42-I47 HydrophobicContact CE3-CB 4.48Å; W42-I47 HydrophobicContact CE3-CD1 4.24Å; W42-I47 HydrophobicContact CE3-CG1 3.38Å; W42-I47 HydrophobicContact CZ3-CG1 4.04Å; S43-I47 PolarHBondContact O-N 3.11Å; W44-I47 HydrophobicContact CE3-CD1 4.32Å; W44-I47 PolarHBondContact O-N 3.2Å; I47-W49 PolarHBondContact O-N 2.96Å; I47-T50 PolarHBondContact O-N 2.74Å; I47-T50 PolarHBondContact O-OG1 2.91Å; I47-S51 VanDerWaalsContact O-CB 3.29Å; I47-S51 WeakPolarHBondContact O-CB 3.27Å; I47-S51 PolarHBondContact O-N 3.37Å
48	I	87.2	Confident	79.3	Confident	96 Å²	96	73.8 Å²	73.8	49%	0.492	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-46.4	-177.9	-67.5	166	0	0	0	110.4	W44 T50 S51 I52	W44-I48 VanDerWaalsContact O-CG1 3.31Å; W44-I48 WeakPolarHBondContact O-CG1 3.23Å; W44-I48 PolarHBondContact O-N 3.34Å; I48-T50 PolarHBondContact O-N 2.85Å; I48-S51 PolarHBondContact O-N 3.17Å; I48-I52 HydrophobicContact CG2-CD1 3.79Å; I48-I52 HydrophobicContact CG2-CG1 4.45Å; I48-I52 VanDerWaalsContact O-CG1 3.27Å; I48-I52 WeakPolarHBondContact O-CG1 3.39Å; I48-I52 PolarHBondContact O-N 3.44Å
49	W	85.5	Confident	81.7	Confident	94 Å²	94	73.5 Å²	73.5	36%	0.356	40%	0.396	S	S	.	.	H	α-helix	trans	-62	-41.9	-179.5	-173.5	-103.6	0	0	0	113.1	G45 I47 G53 W188 Y530	G45-W49 VanDerWaalsContact O-CB 3.28Å; G45-W49 WeakPolarHBondContact O-CB 3.49Å; G45-W49 PolarHBondContact O-N 3.15Å; I47-W49 PolarHBondContact O-N 2.96Å; W49-G53 PolarHBondContact O-N 2.98Å; W49-G53 VanDerWaalsContact O-N 3.14Å; W49-W188 AromaticContact CD2-CD1 3.86Å; W49-W188 AromaticContact CD2-NE1 3.52Å; W49-W188 AromaticContact CE2-CD1 3.31Å; W49-W188 AromaticContact CE2-NE1 3.18Å; W49-W188 AromaticContact CE3-NE1 3.65Å; W49-W188 AromaticContact CH2-CE2 3.89Å; W49-W188 HydrophobicContact CH2-CZ2 4.15Å; W49-W188 AromaticContact CH2-NE1 3.2Å; W49-W188 AromaticContact CZ2-CD1 3.46Å; W49-W188 VanDerWaalsContact CZ2-CD1 3.46Å; W49-W188 AromaticContact CZ2-NE1 3.04Å; W49-W188 HydrophobicContact CZ3-CZ2 4.35Å; W49-W188 AromaticContact CZ3-NE1 3.49Å; W49-W188 AromaticContact NE1-CD1 3.48Å; W49-W188 AromaticContact NE1-NE1 3.87Å; W49-Y530 HydrophobicContact CH2-CE1 4.42Å; W49-Y530 HydrophobicContact CZ2-CE1 4.38Å
50	T	86.9	Confident	84.2	Confident	19 Å²	19	68.8 Å²	68.8	12%	0.117	38%	0.375	C	S	.	.	H	α-helix	trans	-71.1	-40.1	177.2	51.3	0	0	0	0	111.7	I37 A46 I47 I48 I52 G53 W54	I37-T50 HydrophobicContact CD1-CG2 3.81Å; I37-T50 HydrophobicContact CG1-CG2 4.13Å; A46-T50 WeakPolarHBondContact O-CB 3.29Å; A46-T50 VanDerWaalsContact O-CG2 3.3Å; A46-T50 WeakPolarHBondContact O-CG2 3.28Å; A46-T50 PolarHBondContact O-N 3.32Å; A46-T50 PolarHBondContact O-OG1 3Å; I47-T50 PolarHBondContact O-N 2.74Å; I47-T50 PolarHBondContact O-OG1 2.91Å; I48-T50 PolarHBondContact O-N 2.85Å; T50-I52 VanDerWaalsContact C-N 3.34Å; T50-I52 PolarHBondContact O-N 2.97Å; T50-G53 PolarHBondContact O-N 2.98Å; T50-W54 VanDerWaalsContact O-CD1 3.25Å; T50-W54 PolarHBondContact O-N 3.4Å
51	S	90.9	Very high	86.7	Confident	66 Å²	66	66.7 Å²	66.7	46%	0.462	35%	0.353	S	S	.	.	H	α-helix	trans	-60	-43.1	174.6	-174	0	0	0	0	111.8	I47 I48 W54 S55	I47-S51 VanDerWaalsContact O-CB 3.29Å; I47-S51 WeakPolarHBondContact O-CB 3.27Å; I47-S51 PolarHBondContact O-N 3.37Å; I48-S51 PolarHBondContact O-N 3.17Å; S51-W54 PolarHBondContact O-N 3.47Å; S51-S55 PolarHBondContact O-N 2.88Å; S51-S55 PolarHBondContact O-OG 3.47Å; S51-S55 VanDerWaalsContact O-OG 3.08Å
52	I	93.3	Very high	89	Confident	71 Å²	71	66 Å²	66	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-60.6	-48	175.5	-69.9	165.9	0	0	0	110.2	I48 T50 W54 S55 V56 W188	I48-I52 HydrophobicContact CG2-CD1 3.79Å; I48-I52 HydrophobicContact CG2-CG1 4.45Å; I48-I52 VanDerWaalsContact O-CG1 3.27Å; I48-I52 WeakPolarHBondContact O-CG1 3.39Å; I48-I52 PolarHBondContact O-N 3.44Å; T50-I52 VanDerWaalsContact C-N 3.34Å; T50-I52 PolarHBondContact O-N 2.97Å; I52-W54 VanDerWaalsContact C-N 3.33Å; I52-W54 PolarHBondContact O-N 3.16Å; I52-S55 PolarHBondContact O-N 3.09Å; I52-V56 HydrophobicContact CG2-CG2 4.23Å; I52-V56 WeakPolarHBondContact O-CB 3.39Å; I52-V56 VanDerWaalsContact O-CG2 3.29Å; I52-V56 WeakPolarHBondContact O-CG2 3.39Å; I52-V56 PolarHBondContact O-N 3.29Å; I52-W188 HydrophobicContact CG2-CZ2 4.28Å
53	G	94.2	Very high	90.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.9	-40.7	179	0	0	0	0	0	113.2	W49 T50 S57 Y178	W49-G53 PolarHBondContact O-N 2.98Å; W49-G53 VanDerWaalsContact O-N 3.14Å; T50-G53 PolarHBondContact O-N 2.98Å; G53-S57 WeakPolarHBondContact O-CB 3.31Å; G53-S57 PolarHBondContact O-N 3.24Å; G53-Y178 PolarHBondContact O-OH 2.71Å
54	W	95.1	Very high	91.5	Very high	135 Å²	135	59.2 Å²	59.2	51%	0.511	32%	0.32	S	S	.	.	H	α-helix	trans	-64.8	-45.8	173.8	-82	111.9	0	0	0	112.6	T50 S51 I52 V56 S57 V58 L179	T50-W54 VanDerWaalsContact O-CD1 3.25Å; T50-W54 PolarHBondContact O-N 3.4Å; S51-W54 PolarHBondContact O-N 3.47Å; I52-W54 VanDerWaalsContact C-N 3.33Å; I52-W54 PolarHBondContact O-N 3.16Å; W54-V56 VanDerWaalsContact C-N 3.33Å; W54-V56 PolarHBondContact O-N 3.38Å; W54-S57 WeakPolarHBondContact O-CB 3.49Å; W54-S57 PolarHBondContact O-N 2.91Å; W54-V58 WeakPolarHBondContact O-CG2 3.44Å; W54-V58 PolarHBondContact O-N 2.94Å; W54-L179 HydrophobicContact CE3-CD2 4.35Å; W54-L179 HydrophobicContact CH2-CD1 3.81Å; W54-L179 HydrophobicContact CH2-CD2 3.69Å; W54-L179 HydrophobicContact CH2-CG 4.41Å; W54-L179 HydrophobicContact CZ2-CD2 4.16Å; W54-L179 HydrophobicContact CZ3-CD1 3.89Å; W54-L179 HydrophobicContact CZ3-CD2 3.8Å; W54-L179 HydrophobicContact CZ3-CG 4.4Å
55	S	96.3	Very high	92.3	Very high	77 Å²	77	50.2 Å²	50.2	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-60.7	-41.8	176.9	-63.4	0	0	0	0	112.1	S51 I52 G59	S51-S55 PolarHBondContact O-N 2.88Å; S51-S55 PolarHBondContact O-OG 3.47Å; S51-S55 VanDerWaalsContact O-OG 3.08Å; I52-S55 PolarHBondContact O-N 3.09Å; S55-G59 PolarHBondContact O-N 3.38Å
56	V	96.7	Very high	93	Very high	39 Å²	39	52.7 Å²	52.7	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-41.5	175.3	172.5	0	0	0	0	110.9	I52 W54 G59 L60 Y178 W188 L192	I52-V56 HydrophobicContact CG2-CG2 4.23Å; I52-V56 WeakPolarHBondContact O-CB 3.39Å; I52-V56 VanDerWaalsContact O-CG2 3.29Å; I52-V56 WeakPolarHBondContact O-CG2 3.39Å; I52-V56 PolarHBondContact O-N 3.29Å; W54-V56 VanDerWaalsContact C-N 3.33Å; W54-V56 PolarHBondContact O-N 3.38Å; V56-G59 PolarHBondContact O-N 2.96Å; V56-L60 HydrophobicContact CG1-CD1 3.87Å; V56-L60 HydrophobicContact CG1-CG 4.37Å; V56-L60 WeakPolarHBondContact O-CB 3.32Å; V56-L60 WeakPolarHBondContact O-CG 3.29Å; V56-L60 PolarHBondContact O-N 3.39Å; V56-Y178 HydrophobicContact CG1-CE2 3.92Å; V56-W188 HydrophobicContact CG1-CE3 4.42Å; V56-W188 HydrophobicContact CG1-CZ3 4.5Å; V56-W188 HydrophobicContact CG2-CZ3 4.38Å; V56-L192 HydrophobicContact CG1-CB 4.38Å; V56-L192 HydrophobicContact CG1-CD1 4.27Å
57	S	96.9	Very high	93.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-51.2	177.1	-171.2	0	0	0	0	111.7	G53 W54 L60 G61 I175 Y178	G53-S57 WeakPolarHBondContact O-CB 3.31Å; G53-S57 PolarHBondContact O-N 3.24Å; W54-S57 WeakPolarHBondContact O-CB 3.49Å; W54-S57 PolarHBondContact O-N 2.91Å; S57-L60 PolarHBondContact O-N 3.34Å; S57-G61 PolarHBondContact O-N 3.08Å; S57-I175 WeakPolarHBondContact O-CG1 2.99Å; S57-Y178 WeakPolarHBondContact OG-CD1 3.41Å
58	V	97.1	Very high	94.3	Very high	68 Å²	68	49.9 Å²	49.9	41%	0.412	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-44.5	178	175.1	0	0	0	0	110.9	W54 L60 G61 L62	W54-V58 WeakPolarHBondContact O-CG2 3.44Å; W54-V58 PolarHBondContact O-N 2.94Å; V58-L60 PolarHBondContact O-N 3.23Å; V58-G61 PolarHBondContact O-N 3.32Å; V58-L62 HydrophobicContact CG1-CD1 3.89Å; V58-L62 HydrophobicContact CG1-CG 4.27Å; V58-L62 WeakPolarHBondContact O-CB 3.5Å; V58-L62 WeakPolarHBondContact O-CG 3.34Å; V58-L62 PolarHBondContact O-N 3.22Å
59	G	97.3	Very high	94.6	Very high	38 Å²	38	46.4 Å²	46.4	39%	0.392	26%	0.256	S	S	.	.	H	α-helix	trans	-58.6	-44.3	178.2	0	0	0	0	0	113.1	S55 V56 L63	S55-G59 PolarHBondContact O-N 3.38Å; V56-G59 PolarHBondContact O-N 2.96Å; G59-L63 VanDerWaalsContact O-CB 3.29Å; G59-L63 WeakPolarHBondContact O-CB 3.46Å; G59-L63 PolarHBondContact O-N 2.96Å
60	L	96.5	Very high	95.1	Very high	18 Å²	18	44.4 Å²	44.4	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-39.9	175.9	-74.9	168.4	0	0	0	112.9	V56 S57 V58 L63 C64 Y178 L192	V56-L60 HydrophobicContact CG1-CD1 3.87Å; V56-L60 HydrophobicContact CG1-CG 4.37Å; V56-L60 WeakPolarHBondContact O-CB 3.32Å; V56-L60 WeakPolarHBondContact O-CG 3.29Å; V56-L60 PolarHBondContact O-N 3.39Å; S57-L60 PolarHBondContact O-N 3.34Å; V58-L60 PolarHBondContact O-N 3.23Å; L60-L63 PolarHBondContact O-N 3.24Å; L60-C64 WeakPolarHBondContact O-CB 3.3Å; L60-C64 PolarHBondContact O-N 3.14Å; L60-Y178 HydrophobicContact CD1-CD2 3.82Å; L60-Y178 HydrophobicContact CD1-CE2 3.74Å; L60-L192 HydrophobicContact CD1-CB 4.38Å; L60-L192 HydrophobicContact CD1-CD1 3.57Å; L60-L192 HydrophobicContact CD2-CD1 3.95Å; L60-L192 HydrophobicContact CG-CD1 4.19Å
61	G	96.9	Very high	95.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-49.5	175.1	0	0	0	0	0	111.3	S57 V58 C64 S65 A171	S57-G61 PolarHBondContact O-N 3.08Å; V58-G61 PolarHBondContact O-N 3.32Å; G61-C64 PolarHBondContact O-N 3.45Å; G61-S65 PolarHBondContact O-N 3.43Å; G61-A171 WeakPolarHBondContact O-CA 3.34Å; G61-A171 WeakPolarHBondContact O-CB 3.44Å
62	L	97	Very high	95.6	Very high	98 Å²	98	40.7 Å²	40.7	51%	0.513	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-43.7	176.7	-69.6	175.1	0	0	0	111.7	V58 C64 S65 I66	V58-L62 HydrophobicContact CG1-CD1 3.89Å; V58-L62 HydrophobicContact CG1-CG 4.27Å; V58-L62 WeakPolarHBondContact O-CB 3.5Å; V58-L62 WeakPolarHBondContact O-CG 3.34Å; V58-L62 PolarHBondContact O-N 3.22Å; L62-C64 VanDerWaalsContact C-N 3.3Å; L62-C64 PolarHBondContact O-N 2.87Å; L62-S65 PolarHBondContact O-N 3.16Å; L62-I66 WeakPolarHBondContact O-CG1 3.15Å; L62-I66 PolarHBondContact O-N 3.39Å
63	L	95.7	Very high	95.6	Very high	96 Å²	96	39.3 Å²	39.3	50%	0.503	22%	0.22	S	C	.	.	H	α-helix	trans	-56.6	-44.6	175	179.8	67	0	0	0	111.3	G59 L60 I66 Y67 I199	G59-L63 VanDerWaalsContact O-CB 3.29Å; G59-L63 WeakPolarHBondContact O-CB 3.46Å; G59-L63 PolarHBondContact O-N 2.96Å; L60-L63 PolarHBondContact O-N 3.24Å; L63-I66 PolarHBondContact O-N 3.25Å; L63-Y67 WeakPolarHBondContact O-CB 3.45Å; L63-Y67 PolarHBondContact O-N 2.95Å; L63-I199 HydrophobicContact CD2-CD1 4.26Å
64	C	95.4	Very high	95.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-43.2	177.5	-174.8	0	0	0	0	112.1	L60 G61 L62 Y67 V68 V174 I199	L60-C64 WeakPolarHBondContact O-CB 3.3Å; L60-C64 PolarHBondContact O-N 3.14Å; G61-C64 PolarHBondContact O-N 3.45Å; L62-C64 VanDerWaalsContact C-N 3.3Å; L62-C64 PolarHBondContact O-N 2.87Å; C64-Y67 PolarHBondContact O-N 3.16Å; C64-V68 WeakPolarHBondContact O-CG2 3.41Å; C64-V68 PolarHBondContact O-N 2.94Å; C64-V174 HydrophobicContact CB-CG2 3.92Å; C64-I199 HydrophobicContact CB-CD1 4.2Å; C64-I199 HydrophobicContact CB-CG1 4.11Å
65	S	96.3	Very high	95.4	Very high	15 Å²	15	36.2 Å²	36.2	11%	0.105	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-46.6	177.3	179	0	0	0	0	111.7	G61 L62 A69 F167 S168	G61-S65 PolarHBondContact O-N 3.43Å; L62-S65 PolarHBondContact O-N 3.16Å; S65-A69 WeakPolarHBondContact O-CB 3.29Å; S65-A69 PolarHBondContact O-N 3.45Å; S65-F167 WeakPolarHBondContact CB-O 3.42Å; S65-F167 PolarHBondContact OG-O 3.31Å; S65-F167 VanDerWaalsContact OG-O 3.12Å; S65-S168 PolarHBondContact OG-N 3.22Å
66	I	95.6	Very high	95.1	Very high	103 Å²	103	34.1 Å²	34.1	53%	0.528	20%	0.196	S	C	.	.	H	α-helix	trans	-62.5	-47.5	178.1	-68.3	166.5	0	0	0	109.6	L62 L63 V68 A69 T70	L62-I66 WeakPolarHBondContact O-CG1 3.15Å; L62-I66 PolarHBondContact O-N 3.39Å; L63-I66 PolarHBondContact O-N 3.25Å; I66-V68 PolarHBondContact O-N 2.9Å; I66-A69 WeakPolarHBondContact O-CB 3.44Å; I66-A69 PolarHBondContact O-N 3.46Å; I66-A69 VanDerWaalsContact O-N 3.12Å; I66-T70 PolarHBondContact O-N 3.38Å; I66-T70 PolarHBondContact O-OG1 3.03Å
67	Y	94.4	Very high	94.9	Very high	15 Å²	15	38 Å²	38	6%	0.059	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-45.5	-179	175.9	-86.1	0	0	0	112.3	L63 C64 A69 T70 L71 R202 L548 E551 L552	L63-Y67 WeakPolarHBondContact O-CB 3.45Å; L63-Y67 PolarHBondContact O-N 2.95Å; C64-Y67 PolarHBondContact O-N 3.16Å; Y67-A69 VanDerWaalsContact C-N 3.35Å; Y67-A69 PolarHBondContact O-N 3.3Å; Y67-T70 PolarHBondContact O-N 2.96Å; Y67-L71 HydrophobicContact CD1-CD1 3.97Å; Y67-L71 HydrophobicContact CD1-CG 4.35Å; Y67-L71 HydrophobicContact CE1-CD1 3.19Å; Y67-L71 HydrophobicContact CE1-CG 3.81Å; Y67-L71 HydrophobicContact CE2-CG 4.46Å; Y67-L71 WeakPolarHBondContact O-CG 3.39Å; Y67-L71 PolarHBondContact O-N 3.17Å; Y67-R202 VanDerWaalsContact CD1-NH1 3.34Å; Y67-R202 VanDerWaalsContact CE1-NE 3.34Å; Y67-L548 HydrophobicContact CD2-CD1 4.34Å; Y67-L548 HydrophobicContact CE2-CD1 3.33Å; Y67-L548 HydrophobicContact CE2-CD2 4.12Å; Y67-L548 HydrophobicContact CE2-CG 3.65Å; Y67-L548 VanDerWaalsContact CZ-CD1 3.43Å; Y67-L548 WeakPolarHBondContact OH-CD1 3.31Å; Y67-E551 PolarHBondContact OH-OE2 2.84Å; Y67-L552 HydrophobicContact CD2-CD1 3.92Å; Y67-L552 HydrophobicContact CD2-CD2 3.86Å; Y67-L552 HydrophobicContact CD2-CG 4.19Å; Y67-L552 HydrophobicContact CE2-CD1 3.76Å; Y67-L552 HydrophobicContact CE2-CD2 3.7Å; Y67-L552 HydrophobicContact CE2-CG 3.72Å
68	V	94.6	Very high	94.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-41.4	175.6	170.7	0	0	0	0	111.5	C64 I66 T70 L71 H72 F167 R202 V208 E209	C64-V68 WeakPolarHBondContact O-CG2 3.41Å; C64-V68 PolarHBondContact O-N 2.94Å; I66-V68 PolarHBondContact O-N 2.9Å; V68-T70 VanDerWaalsContact C-N 3.33Å; V68-L71 PolarHBondContact O-N 2.86Å; V68-H72 WeakPolarHBondContact O-CB 3.37Å; V68-H72 PolarHBondContact O-N 3.03Å; V68-F167 HydrophobicContact CB-CD1 4.48Å; V68-F167 HydrophobicContact CG1-CD1 3.5Å; V68-F167 HydrophobicContact CG1-CE1 3.58Å; V68-F167 HydrophobicContact CG1-CG 4.25Å; V68-F167 HydrophobicContact CG1-CZ 4.38Å; V68-R202 VanDerWaalsContact CG2-NH2 3.31Å; V68-V208 HydrophobicContact CB-CG1 4.46Å; V68-V208 HydrophobicContact CG1-CG1 3.48Å; V68-V208 VanDerWaalsContact CG1-CG1 3.48Å; V68-V208 HydrophobicContact CG2-CG1 4.12Å; V68-E209 HydrophobicContact CG1-CB 4.44Å
69	A	94.9	Very high	94.3	Very high	22 Å²	22	37 Å²	37	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-40	178.4	0	0	0	0	0	111.7	S65 I66 Y67 H72 E73 F167	S65-A69 WeakPolarHBondContact O-CB 3.29Å; S65-A69 PolarHBondContact O-N 3.45Å; I66-A69 WeakPolarHBondContact O-CB 3.44Å; I66-A69 PolarHBondContact O-N 3.46Å; I66-A69 VanDerWaalsContact O-N 3.12Å; Y67-A69 VanDerWaalsContact C-N 3.35Å; Y67-A69 PolarHBondContact O-N 3.3Å; A69-H72 PolarHBondContact O-N 3.32Å; A69-E73 PolarHBondContact O-N 3.25Å; A69-F167 HydrophobicContact CB-CD2 3.54Å; A69-F167 HydrophobicContact CB-CE2 3.95Å; A69-F167 HydrophobicContact CB-CG 4.31Å
70	T	94.9	Very high	94	Very high	52 Å²	52	40.4 Å²	40.4	32%	0.319	21%	0.212	S	C	.	.	H	α-helix	trans	-66.5	-43.3	176.1	-56.8	0	0	0	0	111.6	I66 Y67 V68 H72 E73 N74 L552	I66-T70 PolarHBondContact O-N 3.38Å; I66-T70 PolarHBondContact O-OG1 3.03Å; Y67-T70 PolarHBondContact O-N 2.96Å; V68-T70 VanDerWaalsContact C-N 3.33Å; T70-H72 VanDerWaalsContact C-N 3.35Å; T70-H72 PolarHBondContact O-N 2.96Å; T70-E73 PolarHBondContact O-N 3.49Å; T70-N74 WeakPolarHBondContact O-CB 3.36Å; T70-N74 PolarHBondContact O-N 3.41Å; T70-N74 PolarHBondContact O-OD1 3.48Å; T70-L552 HydrophobicContact CG2-CD2 3.81Å
71	L	93.4	Very high	93.8	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-47	174	-76	-177.9	0	0	0	111.8	Y67 V68 E73 N74 D75 E209 E551 L552	Y67-L71 HydrophobicContact CD1-CD1 3.97Å; Y67-L71 HydrophobicContact CD1-CG 4.35Å; Y67-L71 HydrophobicContact CE1-CD1 3.19Å; Y67-L71 HydrophobicContact CE1-CG 3.81Å; Y67-L71 HydrophobicContact CE2-CG 4.46Å; Y67-L71 WeakPolarHBondContact O-CG 3.39Å; Y67-L71 PolarHBondContact O-N 3.17Å; V68-L71 PolarHBondContact O-N 2.86Å; L71-E73 VanDerWaalsContact C-N 3.3Å; L71-E73 PolarHBondContact O-N 3.36Å; L71-N74 PolarHBondContact O-N 3.35Å; L71-D75 WeakPolarHBondContact O-CB 3.17Å; L71-D75 PolarHBondContact O-N 3.33Å; L71-E209 WeakPolarHBondContact CD1-OE2 3.48Å; L71-E551 HydrophobicContact CD2-CG 3.85Å; L71-L552 HydrophobicContact CD2-CD2 3.96Å; L71-L552 HydrophobicContact CG-CD2 4.3Å
72	H	94.1	Very high	93.5	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.028	24%	0.242	C	C	.	.	H	α-helix	trans	-58.4	-43.2	177.7	179.1	77.1	0	0	0	112.4	V68 A69 T70 L76 F78 F167 E209 I212	V68-H72 WeakPolarHBondContact O-CB 3.37Å; V68-H72 PolarHBondContact O-N 3.03Å; A69-H72 PolarHBondContact O-N 3.32Å; T70-H72 VanDerWaalsContact C-N 3.35Å; T70-H72 PolarHBondContact O-N 2.96Å; H72-L76 WeakPolarHBondContact CE1-CD1 3.42Å; H72-L76 PolarHBondContact O-N 3.41Å; H72-F78 AromaticContact NE2-CD2 3.47Å; H72-F78 WeakPolarHBondContact NE2-CD2 3.49Å; H72-F78 AromaticContact NE2-CE2 3.83Å; H72-F78 AromaticContact NE2-CG 3.56Å; H72-F167 HydrophobicContact CB-CE2 4.2Å; H72-F167 HydrophobicContact CB-CZ 3.71Å; H72-F167 AromaticContact CG-CZ 3.72Å; H72-E209 PolarHBondContact ND1-O 3.32Å; H72-I212 WeakPolarHBondContact CE1-CD1 3.27Å
73	E	94.3	Very high	93.2	Very high	41 Å²	41	48.1 Å²	48.1	19%	0.192	24%	0.243	C	C	.	.	H	α-helix	trans	-64.3	-45.4	176.1	-178	58.1	-146.7	0	0	111.6	A69 T70 L71 W77 F78 S79	A69-E73 PolarHBondContact O-N 3.25Å; T70-E73 PolarHBondContact O-N 3.49Å; L71-E73 VanDerWaalsContact C-N 3.3Å; L71-E73 PolarHBondContact O-N 3.36Å; E73-W77 WeakPolarHBondContact O-CA 3.34Å; E73-W77 PolarHBondContact O-N 2.98Å; E73-F78 PolarHBondContact O-N 3.18Å; E73-F78 PolarHBondContact OE1-N 3.1Å; E73-S79 VanDerWaalsContact CD-OG 3.31Å; E73-S79 VanDerWaalsContact OE1-CB 3.24Å; E73-S79 WeakPolarHBondContact OE1-CB 3.38Å; E73-S79 PolarHBondContact OE1-N 3.16Å; E73-S79 PolarHBondContact OE1-OG 3.45Å; E73-S79 WeakPolarHBondContact OE2-CB 3.37Å; E73-S79 PolarHBondContact OE2-N 2.94Å; E73-S79 VanDerWaalsContact OE2-N 3.09Å
74	N	93.6	Very high	92.9	Very high	24 Å²	24	46 Å²	46	13%	0.128	23%	0.234	C	C	.	.	H	α-helix	trans	-69.3	-36.1	-177.8	-71	-5.1	0	0	0	113.1	T70 L71 L552 L555 R556	T70-N74 WeakPolarHBondContact O-CB 3.36Å; T70-N74 PolarHBondContact O-N 3.41Å; T70-N74 PolarHBondContact O-OD1 3.48Å; L71-N74 PolarHBondContact O-N 3.35Å; N74-L552 PolarHBondContact ND2-O 2.63Å; N74-L555 HydrophobicContact CB-CD2 4.11Å; N74-R556 PolarHBondContact O-N 2.8Å; N74-R556 VanDerWaalsContact O-O 3.06Å
75	D	90.6	Very high	92.7	Very high	47 Å²	47	47.7 Å²	47.7	25%	0.251	24%	0.242	S	C	.	.	H	α-helix	trans	-75.9	-31	-178	-91.1	-38.5	0	0	0	113.2	L71 R556	L71-D75 WeakPolarHBondContact O-CB 3.17Å; L71-D75 PolarHBondContact O-N 3.33Å; D75-R556 VanDerWaalsContact O-CB 3.31Å; D75-R556 WeakPolarHBondContact O-CB 3.31Å; D75-R556 IonicContact OD1-CZ 3.84Å; D75-R556 IonicContact OD1-NH1 3.51Å; D75-R556 PolarHBondContact OD1-NH1 3.12Å; D75-R556 VanDerWaalsContact OD1-NH1 3.17Å
76	L	90.5	Very high	92.6	Very high	32 Å²	32	48 Å²	48	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-110.9	-11.5	-174.5	-59.9	-177.8	0	0	0	113.5	H72 F78 F558	H72-L76 WeakPolarHBondContact CE1-CD1 3.42Å; H72-L76 PolarHBondContact O-N 3.41Å; L76-F78 HydrophobicContact CB-CB 4.14Å; L76-F78 HydrophobicContact CB-CD2 4.41Å; L76-F78 HydrophobicContact CD1-CD2 4.04Å; L76-F78 PolarHBondContact O-N 3.17Å; L76-F558 HydrophobicContact CB-CB 4.21Å; L76-F558 HydrophobicContact CD2-CB 4.01Å; L76-F558 HydrophobicContact CD2-CD2 4.01Å; L76-F558 HydrophobicContact CD2-CG 4.35Å; L76-F558 WeakPolarHBondContact O-CB 3.18Å; L76-F558 PolarHBondContact O-N 2.88Å; L76-F558 VanDerWaalsContact O-N 3.15Å
77	W	92.1	Very high	92.5	Very high	121 Å²	121	43.4 Å²	43.4	46%	0.458	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	40.4	-164.1	-153.9	3.9	0	0	0	111.9	E73 S79 N80 I81 R556 E557	E73-W77 WeakPolarHBondContact O-CA 3.34Å; E73-W77 PolarHBondContact O-N 2.98Å; W77-S79 PolarHBondContact O-N 3.35Å; W77-S79 VanDerWaalsContact O-N 3.1Å; W77-N80 HydrophobicContact CD2-CB 4.16Å; W77-N80 HydrophobicContact CG-CB 4.04Å; W77-N80 HydrophobicContact CZ2-CB 4.44Å; W77-N80 VanDerWaalsContact NE1-CG 3.27Å; W77-N80 PolarHBondContact NE1-ND2 2.9Å; W77-N80 PolarHBondContact O-N 3.24Å; W77-I81 PolarHBondContact O-N 2.94Å; W77-R556 PolarHBondContact N-O 3.43Å; W77-E557 HydrophobicContact CB-CG 4.49Å; W77-E557 HydrophobicContact CE3-CB 3.88Å; W77-E557 HydrophobicContact CE3-CG 3.75Å; W77-E557 HydrophobicContact CZ3-CG 4.45Å
78	F	91.1	Very high	92.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-36.8	-159.1	-168	-97.4	0	0	0	112.8	H72 E73 L76 N80 I81 R86 F90 V159 Y160 I163	H72-F78 AromaticContact NE2-CD2 3.47Å; H72-F78 WeakPolarHBondContact NE2-CD2 3.49Å; H72-F78 AromaticContact NE2-CE2 3.83Å; H72-F78 AromaticContact NE2-CG 3.56Å; E73-F78 PolarHBondContact O-N 3.18Å; E73-F78 PolarHBondContact OE1-N 3.1Å; L76-F78 HydrophobicContact CB-CB 4.14Å; L76-F78 HydrophobicContact CB-CD2 4.41Å; L76-F78 HydrophobicContact CD1-CD2 4.04Å; L76-F78 PolarHBondContact O-N 3.17Å; F78-N80 VanDerWaalsContact C-N 3.32Å; F78-N80 PolarHBondContact O-N 3.13Å; F78-I81 HydrophobicContact CD2-CD1 4.44Å; F78-I81 VanDerWaalsContact O-CG1 3.29Å; F78-I81 WeakPolarHBondContact O-CG1 3.49Å; F78-R86 HydrophobicContact CD1-CG 4.44Å; F78-R86 HydrophobicContact CD2-CB 4.43Å; F78-R86 HydrophobicContact CD2-CG 4.16Å; F78-R86 HydrophobicContact CE1-CB 4.47Å; F78-R86 HydrophobicContact CE1-CG 4.18Å; F78-R86 HydrophobicContact CE2-CB 3.72Å; F78-R86 HydrophobicContact CE2-CG 3.89Å; F78-R86 HydrophobicContact CG-CG 4.44Å; F78-R86 HydrophobicContact CZ-CB 3.75Å; F78-R86 HydrophobicContact CZ-CG 3.9Å; F78-R86 PolarHBondContact O-NE 2.72Å; F78-F90 HydrophobicContact CE2-CE2 4.39Å; F78-F90 HydrophobicContact CZ-CE2 4.16Å; F78-V159 HydrophobicContact CE1-CG1 4.31Å; F78-V159 HydrophobicContact CE1-CG2 4.01Å; F78-V159 HydrophobicContact CZ-CG2 3.7Å; F78-Y160 HydrophobicContact CD1-CD1 4.45Å; F78-Y160 AromaticContact CD1-CE1 3.81Å; F78-Y160 HydrophobicContact CD1-CE1 3.81Å; F78-Y160 HydrophobicContact CE1-CD1 4.35Å; F78-Y160 HydrophobicContact CE1-CE1 4Å; F78-I163 HydrophobicContact CD1-CD1 4.06Å; F78-I163 HydrophobicContact CE1-CD1 3.71Å; F78-I163 HydrophobicContact CZ-CD1 4.35Å
79	S	90.9	Very high	92.3	Very high	48 Å²	48	44 Å²	44	34%	0.336	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-22.5	-179.3	67.5	0	0	0	0	115.1	E73 W77 R86 Y160	E73-S79 VanDerWaalsContact CD-OG 3.31Å; E73-S79 VanDerWaalsContact OE1-CB 3.24Å; E73-S79 WeakPolarHBondContact OE1-CB 3.38Å; E73-S79 PolarHBondContact OE1-N 3.16Å; E73-S79 PolarHBondContact OE1-OG 3.45Å; E73-S79 WeakPolarHBondContact OE2-CB 3.37Å; E73-S79 PolarHBondContact OE2-N 2.94Å; E73-S79 VanDerWaalsContact OE2-N 3.09Å; W77-S79 PolarHBondContact O-N 3.35Å; W77-S79 VanDerWaalsContact O-N 3.1Å; S79-R86 PolarHBondContact O-NH2 3.23Å; S79-Y160 VanDerWaalsContact CA-OH 3.22Å; S79-Y160 WeakPolarHBondContact CA-OH 3.47Å
80	N	91.2	Very high	92.2	Very high	108 Å²	108	43.3 Å²	43.3	58%	0.578	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-15	-173.4	-67.7	-82.2	0	0	0	113.7	W77 F78	W77-N80 HydrophobicContact CD2-CB 4.16Å; W77-N80 HydrophobicContact CG-CB 4.04Å; W77-N80 HydrophobicContact CZ2-CB 4.44Å; W77-N80 VanDerWaalsContact NE1-CG 3.27Å; W77-N80 PolarHBondContact NE1-ND2 2.9Å; W77-N80 PolarHBondContact O-N 3.24Å; F78-N80 VanDerWaalsContact C-N 3.32Å; F78-N80 PolarHBondContact O-N 3.13Å
81	I	91.3	Very high	91.8	Very high	8 Å²	8	48 Å²	48	4%	0.041	23%	0.227	C	C	.	.	S	Bend	trans	-82	160.6	175.9	59.4	168.1	0	0	0	112.5	W77 F78 E85 R86 E557 F558	W77-I81 PolarHBondContact O-N 2.94Å; F78-I81 HydrophobicContact CD2-CD1 4.44Å; F78-I81 VanDerWaalsContact O-CG1 3.29Å; F78-I81 WeakPolarHBondContact O-CG1 3.49Å; I81-E85 HydrophobicContact CB-CB 4.06Å; I81-E85 HydrophobicContact CD1-CB 4.03Å; I81-E85 HydrophobicContact CG1-CB 4.41Å; I81-R86 HydrophobicContact CD1-CB 4.47Å; I81-R86 HydrophobicContact CD1-CG 3.8Å; I81-R86 HydrophobicContact CG1-CG 3.65Å; I81-R86 PolarHBondContact O-NE 2.7Å; I81-R86 PolarHBondContact O-NH2 3.01Å; I81-E557 HydrophobicContact CG2-CG 4.48Å; I81-F558 HydrophobicContact CD1-CB 4.31Å; I81-F558 HydrophobicContact CD1-CD1 4.48Å
82	K	90.9	Very high	91.6	Very high	155 Å²	155	49.9 Å²	49.9	67%	0.674	24%	0.239	S	C	*	.			trans	-72.3	159.1	-178.1	-63.8	171.7	-177.2	165.1	0	111.7	V84 E85 R86	K82-V84 VanDerWaalsContact C-N 3.29Å; K82-V84 PolarHBondContact O-N 3.29Å; K82-E85 WeakPolarHBondContact CB-OE2 3.39Å; K82-E85 PolarHBondContact N-OE2 2.71Å; K82-E85 WeakPolarHBondContact O-CB 3.46Å; K82-E85 PolarHBondContact O-N 2.69Å; K82-R86 PolarHBondContact O-N 2.92Å
83	E	90.5	Very high	91.4	Very high	115 Å²	115	51.2 Å²	51.2	54%	0.537	25%	0.245	S	C	.	.	H	α-helix	trans	-51.9	-45.6	178.3	-173.1	-174.9	162.8	0	0	112.5	E85 R86 E87 K102	E83-E85 VanDerWaalsContact C-N 3.3Å; E83-E85 PolarHBondContact O-N 3.07Å; E83-R86 WeakPolarHBondContact O-CB 3.14Å; E83-R86 PolarHBondContact O-N 3.43Å; E83-E87 WeakPolarHBondContact O-CB 3.31Å; E83-E87 WeakPolarHBondContact O-CG 3.45Å; E83-E87 PolarHBondContact O-N 2.87Å; E83-K102 IonicContact OE1-NZ 2.9Å; E83-K102 PolarHBondContact OE1-NZ 2.95Å
84	V	90.1	Very high	91.3	Very high	52 Å²	52	49.5 Å²	49.5	32%	0.315	24%	0.237	S	C	.	.	H	α-helix	trans	-62.2	-38.2	179	178.4	0	0	0	0	111.6	K82 E87 I88 M567	K82-V84 VanDerWaalsContact C-N 3.29Å; K82-V84 PolarHBondContact O-N 3.29Å; V84-E87 PolarHBondContact O-N 3.07Å; V84-I88 HydrophobicContact CG1-CD1 3.84Å; V84-I88 HydrophobicContact CG1-CG1 4.44Å; V84-I88 WeakPolarHBondContact O-CD1 3.22Å; V84-I88 WeakPolarHBondContact O-CG1 3.46Å; V84-I88 PolarHBondContact O-N 3.19Å; V84-M567 HydrophobicContact CG1-CB 4.29Å
85	E	91.9	Very high	91.3	Very high	35 Å²	35	48.4 Å²	48.4	16%	0.164	23%	0.231	C	C	.	.	H	α-helix	trans	-69.5	-42.2	177.4	-68.5	164.2	150.9	0	0	110.9	I81 K82 E83 E87 I88 S89 F558 V564	I81-E85 HydrophobicContact CB-CB 4.06Å; I81-E85 HydrophobicContact CD1-CB 4.03Å; I81-E85 HydrophobicContact CG1-CB 4.41Å; K82-E85 WeakPolarHBondContact CB-OE2 3.39Å; K82-E85 PolarHBondContact N-OE2 2.71Å; K82-E85 WeakPolarHBondContact O-CB 3.46Å; K82-E85 PolarHBondContact O-N 2.69Å; E83-E85 VanDerWaalsContact C-N 3.3Å; E83-E85 PolarHBondContact O-N 3.07Å; E85-E87 VanDerWaalsContact C-N 3.28Å; E85-E87 PolarHBondContact O-N 3.46Å; E85-I88 PolarHBondContact O-N 2.88Å; E85-S89 PolarHBondContact O-N 3.3Å; E85-S89 VanDerWaalsContact O-N 3.11Å; E85-F558 HydrophobicContact CB-CD1 4.5Å; E85-V564 HydrophobicContact CG-CG2 3.68Å
86	R	93.7	Very high	91.4	Very high	23 Å²	23	46.1 Å²	46.1	9%	0.087	22%	0.219	C	C	.	.	H	α-helix	trans	-56.7	-45	172.1	-65.4	-177.4	-168.7	151.5	5.3	110.6	F78 S79 I81 K82 E83 S89 F90 E157 Y160	F78-R86 HydrophobicContact CD1-CG 4.44Å; F78-R86 HydrophobicContact CD2-CB 4.43Å; F78-R86 HydrophobicContact CD2-CG 4.16Å; F78-R86 HydrophobicContact CE1-CB 4.47Å; F78-R86 HydrophobicContact CE1-CG 4.18Å; F78-R86 HydrophobicContact CE2-CB 3.72Å; F78-R86 HydrophobicContact CE2-CG 3.89Å; F78-R86 HydrophobicContact CG-CG 4.44Å; F78-R86 HydrophobicContact CZ-CB 3.75Å; F78-R86 HydrophobicContact CZ-CG 3.9Å; F78-R86 PolarHBondContact O-NE 2.72Å; S79-R86 PolarHBondContact O-NH2 3.23Å; I81-R86 HydrophobicContact CD1-CB 4.47Å; I81-R86 HydrophobicContact CD1-CG 3.8Å; I81-R86 HydrophobicContact CG1-CG 3.65Å; I81-R86 PolarHBondContact O-NE 2.7Å; I81-R86 PolarHBondContact O-NH2 3.01Å; K82-R86 PolarHBondContact O-N 2.92Å; E83-R86 WeakPolarHBondContact O-CB 3.14Å; E83-R86 PolarHBondContact O-N 3.43Å; R86-S89 WeakPolarHBondContact O-CB 3.48Å; R86-S89 PolarHBondContact O-N 2.89Å; R86-S89 PolarHBondContact O-OG 3.44Å; R86-F90 VanDerWaalsContact O-CD2 3.28Å; R86-F90 WeakPolarHBondContact O-CD2 3.23Å; R86-E157 IonicContact NH1-OE1 3.99Å; R86-E157 IonicContact NH1-OE2 2.83Å; R86-E157 PolarHBondContact NH1-OE2 3.25Å; R86-Y160 PolarHBondContact NH1-OH 3.22Å; R86-Y160 PolarHBondContact NH2-OH 3.44Å; R86-Y160 VanDerWaalsContact NH2-OH 3.11Å
87	E	93.6	Very high	91.6	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.023	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-38.8	179.6	-74.4	-172.2	156.7	0	0	113.2	E83 V84 E85 S89 F90 Y98 K102 L592 C593	E83-E87 WeakPolarHBondContact O-CB 3.31Å; E83-E87 WeakPolarHBondContact O-CG 3.45Å; E83-E87 PolarHBondContact O-N 2.87Å; V84-E87 PolarHBondContact O-N 3.07Å; E85-E87 VanDerWaalsContact C-N 3.28Å; E85-E87 PolarHBondContact O-N 3.46Å; E87-S89 PolarHBondContact O-N 3.48Å; E87-F90 WeakPolarHBondContact O-CB 3.37Å; E87-F90 PolarHBondContact O-N 3.47Å; E87-F90 VanDerWaalsContact O-N 3.1Å; E87-Y98 HydrophobicContact CG-CE1 4.45Å; E87-K102 IonicContact OE1-NZ 2.72Å; E87-K102 PolarHBondContact OE1-NZ 2.91Å; E87-K102 IonicContact OE2-NZ 4Å; E87-L592 HydrophobicContact CB-CD2 3.84Å; E87-L592 HydrophobicContact CB-CG 3.96Å; E87-L592 HydrophobicContact CG-CD1 4.33Å; E87-L592 HydrophobicContact CG-CD2 4.1Å; E87-L592 HydrophobicContact CG-CG 4.05Å; E87-L592 WeakPolarHBondContact O-CD2 3.25Å; E87-C593 WeakPolarHBondContact OE2-CA 3.47Å
88	I	92.6	Very high	91.8	Very high	11 Å²	11	39.5 Å²	39.5	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-29.6	175.1	-68.6	163	0	0	0	111.1	V84 E85 F90 F558 T563 V564 M567	V84-I88 HydrophobicContact CG1-CD1 3.84Å; V84-I88 HydrophobicContact CG1-CG1 4.44Å; V84-I88 WeakPolarHBondContact O-CD1 3.22Å; V84-I88 WeakPolarHBondContact O-CG1 3.46Å; V84-I88 PolarHBondContact O-N 3.19Å; E85-I88 PolarHBondContact O-N 2.88Å; I88-F90 PolarHBondContact O-N 2.95Å; I88-F558 HydrophobicContact CB-CE1 4.18Å; I88-F558 HydrophobicContact CB-CZ 4.45Å; I88-F558 HydrophobicContact CG2-CE1 3.93Å; I88-F558 HydrophobicContact CG2-CZ 3.79Å; I88-T563 HydrophobicContact CD1-CG2 4.02Å; I88-T563 HydrophobicContact CG1-CG2 4.07Å; I88-T563 HydrophobicContact CG2-CG2 3.71Å; I88-V564 HydrophobicContact CD1-CB 4.23Å; I88-V564 HydrophobicContact CD1-CG2 3.51Å; I88-M567 HydrophobicContact CD1-CG 4.16Å; I88-M567 HydrophobicContact CG1-CG 4.24Å
89	S	92.1	Very high	92	Very high	18 Å²	18	40 Å²	40	13%	0.126	20%	0.195	C	C	.	.	H	α-helix	trans	-64.9	-25	175.8	83.4	0	0	0	0	113	E85 R86 E87 R91	E85-S89 PolarHBondContact O-N 3.3Å; E85-S89 VanDerWaalsContact O-N 3.11Å; R86-S89 WeakPolarHBondContact O-CB 3.48Å; R86-S89 PolarHBondContact O-N 2.89Å; R86-S89 PolarHBondContact O-OG 3.44Å; E87-S89 PolarHBondContact O-N 3.48Å; S89-R91 VanDerWaalsContact C-N 3.29Å; S89-R91 PolarHBondContact O-N 3.36Å
90	F	92.7	Very high	92.2	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.026	18%	0.179	C	C	.	.	S	Bend	trans	-75.5	78.2	170.1	-68.1	-90.4	0	0	0	111.3	F78 R86 E87 I88 C94 G95 Y98 V159 Y162 I163 L592	F78-F90 HydrophobicContact CE2-CE2 4.39Å; F78-F90 HydrophobicContact CZ-CE2 4.16Å; R86-F90 VanDerWaalsContact O-CD2 3.28Å; R86-F90 WeakPolarHBondContact O-CD2 3.23Å; E87-F90 WeakPolarHBondContact O-CB 3.37Å; E87-F90 PolarHBondContact O-N 3.47Å; E87-F90 VanDerWaalsContact O-N 3.1Å; I88-F90 PolarHBondContact O-N 2.95Å; F90-C94 HydrophobicContact CB-CB 4.29Å; F90-C94 HydrophobicContact CD1-CB 4.14Å; F90-G95 WeakPolarHBondContact O-CA 3.3Å; F90-G95 PolarHBondContact O-N 3.14Å; F90-G95 VanDerWaalsContact O-N 3.16Å; F90-Y98 HydrophobicContact CD2-CD1 4.36Å; F90-Y98 HydrophobicContact CE1-CG 4.49Å; F90-Y98 HydrophobicContact CE2-CD1 4.36Å; F90-V159 HydrophobicContact CE2-CG2 3.92Å; F90-V159 HydrophobicContact CZ-CG2 4.07Å; F90-Y162 HydrophobicContact CE1-CE1 4.36Å; F90-I163 HydrophobicContact CE1-CG2 4.28Å; F90-I163 HydrophobicContact CZ-CG2 3.76Å; F90-L592 HydrophobicContact CB-CD2 3.85Å; F90-L592 HydrophobicContact CD2-CD2 4.39Å; F90-L592 HydrophobicContact CG-CD2 4.38Å
91	R	87.5	Confident	92.4	Very high	151 Å²	151	32.5 Å²	32.5	57%	0.57	15%	0.152	S	C	*	.			trans	-73.2	156.1	179.9	-64.6	-177.7	174.4	176.6	-2.5	112.7	S89 E93 C94 D560	S89-R91 VanDerWaalsContact C-N 3.29Å; S89-R91 PolarHBondContact O-N 3.36Å; R91-E93 PolarHBondContact O-N 2.93Å; R91-C94 VanDerWaalsContact O-CB 3.3Å; R91-C94 WeakPolarHBondContact O-CB 3.36Å; R91-C94 PolarHBondContact O-N 3.02Å; R91-C94 VanDerWaalsContact O-N 3.09Å; R91-D560 IonicContact NH2-OD2 2.95Å
92	T	88.4	Confident	92.6	Very high	41 Å²	41	34 Å²	34	25%	0.252	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	-130.5	170.6	72.9	0	0	0	0	113.3	C94 G95 Q585 A588	T92-C94 PolarHBondContact O-N 3.37Å; T92-G95 PolarHBondContact O-N 2.8Å; T92-Q585 HydrophobicContact CG2-CB 3.88Å; T92-Q585 HydrophobicContact CG2-CG 3.64Å; T92-A588 WeakPolarHBondContact O-CB 3.18Å
93	E	89.6	Confident	92.8	Very high	35 Å²	35	27.4 Å²	27.4	16%	0.164	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-29.1	179.9	-66.4	176.3	-141.2	0	0	112.7	R91 G95 L96 Y97 L214 P602	R91-E93 PolarHBondContact O-N 2.93Å; E93-G95 VanDerWaalsContact C-N 3.32Å; E93-G95 PolarHBondContact O-N 3.44Å; E93-L96 WeakPolarHBondContact O-CB 3.26Å; E93-L96 PolarHBondContact O-N 3.01Å; E93-Y97 HydrophobicContact CB-CD2 4.34Å; E93-Y97 HydrophobicContact CB-CE2 3.68Å; E93-Y97 WeakPolarHBondContact O-CD2 3.46Å; E93-Y97 PolarHBondContact O-N 3.2Å; E93-Y97 PolarHBondContact OE2-OH 2.84Å; E93-L214 HydrophobicContact CB-CD2 4.34Å; E93-P602 HydrophobicContact CG-CB 3.59Å
94	C	92.9	Very high	93.1	Very high	5 Å²	5	22 Å²	22	3%	0.034	10%	0.104	C	C	.	.	H	α-helix	trans	-64.3	-40.2	-177	-59.9	0	0	0	0	111.8	F90 R91 T92 L96 Y97 Y98	F90-C94 HydrophobicContact CB-CB 4.29Å; F90-C94 HydrophobicContact CD1-CB 4.14Å; R91-C94 VanDerWaalsContact O-CB 3.3Å; R91-C94 WeakPolarHBondContact O-CB 3.36Å; R91-C94 PolarHBondContact O-N 3.02Å; R91-C94 VanDerWaalsContact O-N 3.09Å; T92-C94 PolarHBondContact O-N 3.37Å; C94-L96 VanDerWaalsContact C-N 3.33Å; C94-Y97 PolarHBondContact O-N 3.38Å; C94-Y98 WeakPolarHBondContact O-CB 3.31Å; C94-Y98 PolarHBondContact O-N 2.93Å
95	G	93.1	Very high	93.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.9	-38.8	176.4	0	0	0	0	0	111.8	F90 T92 E93 S99	F90-G95 WeakPolarHBondContact O-CA 3.3Å; F90-G95 PolarHBondContact O-N 3.14Å; F90-G95 VanDerWaalsContact O-N 3.16Å; T92-G95 PolarHBondContact O-N 2.8Å; E93-G95 VanDerWaalsContact C-N 3.32Å; E93-G95 PolarHBondContact O-N 3.44Å; G95-S99 WeakPolarHBondContact O-CB 3.46Å; G95-S99 PolarHBondContact O-N 2.94Å
96	L	92.6	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-63.2	-48.7	176.7	-167.9	67.3	0	0	0	111.3	E93 C94 S99 Y100 T123 A588 K591 L598 H601	E93-L96 WeakPolarHBondContact O-CB 3.26Å; E93-L96 PolarHBondContact O-N 3.01Å; C94-L96 VanDerWaalsContact C-N 3.33Å; L96-S99 WeakPolarHBondContact O-CB 3.42Å; L96-S99 PolarHBondContact O-N 3.19Å; L96-S99 PolarHBondContact O-OG 3.16Å; L96-Y100 HydrophobicContact CD1-CE2 4.44Å; L96-Y100 WeakPolarHBondContact CD1-OH 3.47Å; L96-Y100 HydrophobicContact CD2-CE2 4.44Å; L96-Y100 HydrophobicContact CG-CE2 3.82Å; L96-Y100 WeakPolarHBondContact CG-OH 3.48Å; L96-Y100 VanDerWaalsContact O-CD2 3.24Å; L96-Y100 WeakPolarHBondContact O-CD2 3.37Å; L96-Y100 WeakPolarHBondContact O-CE2 3.35Å; L96-Y100 PolarHBondContact O-N 2.68Å; L96-T123 HydrophobicContact CD1-CG2 4.24Å; L96-A588 HydrophobicContact CB-CB 4.24Å; L96-K591 HydrophobicContact CD1-CG 4.36Å; L96-L598 HydrophobicContact CD1-CD1 4.49Å; L96-H601 HydrophobicContact CD2-CB 4.17Å
97	Y	94.9	Very high	93.4	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.008	12%	0.119	C	C	.	.	H	α-helix	trans	-62.1	-47.6	178.7	-58.4	-39.5	0	0	0	112	E93 C94 S99 Y100 Y101 I137 E140 S213 R215	E93-Y97 HydrophobicContact CB-CD2 4.34Å; E93-Y97 HydrophobicContact CB-CE2 3.68Å; E93-Y97 WeakPolarHBondContact O-CD2 3.46Å; E93-Y97 PolarHBondContact O-N 3.2Å; E93-Y97 PolarHBondContact OE2-OH 2.84Å; C94-Y97 PolarHBondContact O-N 3.38Å; Y97-S99 PolarHBondContact O-N 3.45Å; Y97-Y100 PolarHBondContact O-N 2.95Å; Y97-Y100 VanDerWaalsContact O-N 3.12Å; Y97-Y101 PolarHBondContact O-N 3.45Å; Y97-I137 HydrophobicContact CD1-CG2 4.26Å; Y97-E140 WeakPolarHBondContact O-CG 3.49Å; Y97-S213 WeakPolarHBondContact CD2-O 3.46Å; Y97-R215 VanDerWaalsContact CD1-CZ 3.44Å; Y97-R215 HydrophobicContact CE2-CG 4.14Å
98	Y	95.9	Very high	93.5	Very high	12 Å²	12	29.6 Å²	29.6	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-30	178.8	-173.3	-112.9	0	0	0	112.2	E87 F90 C94 Y100 Y101 K102 V159 Y162 L592	E87-Y98 HydrophobicContact CG-CE1 4.45Å; F90-Y98 HydrophobicContact CD2-CD1 4.36Å; F90-Y98 HydrophobicContact CE1-CG 4.49Å; F90-Y98 HydrophobicContact CE2-CD1 4.36Å; C94-Y98 WeakPolarHBondContact O-CB 3.31Å; C94-Y98 PolarHBondContact O-N 2.93Å; Y98-Y100 VanDerWaalsContact C-N 3.31Å; Y98-Y100 PolarHBondContact O-N 3.18Å; Y98-Y101 AromaticContact CD2-CD1 3.87Å; Y98-Y101 HydrophobicContact CD2-CD1 3.87Å; Y98-Y101 AromaticContact CE2-CD1 3.48Å; Y98-Y101 HydrophobicContact CE2-CD1 3.48Å; Y98-Y101 VanDerWaalsContact CE2-CD1 3.48Å; Y98-Y101 AromaticContact CE2-CE1 3.88Å; Y98-Y101 HydrophobicContact CE2-CE1 3.88Å; Y98-Y101 WeakPolarHBondContact O-CB 3.31Å; Y98-Y101 PolarHBondContact O-N 3.45Å; Y98-K102 PolarHBondContact O-N 2.95Å; Y98-V159 HydrophobicContact CE1-CG2 4.44Å; Y98-V159 HydrophobicContact CE2-CG2 4.35Å; Y98-V159 VanDerWaalsContact OH-CA 3.3Å; Y98-V159 WeakPolarHBondContact OH-CA 3.18Å; Y98-V159 VanDerWaalsContact OH-CB 3.25Å; Y98-V159 WeakPolarHBondContact OH-CB 3.26Å; Y98-V159 PolarHBondContact OH-N 3.37Å; Y98-Y162 AromaticContact CD2-CD1 3.85Å; Y98-Y162 HydrophobicContact CD2-CD1 3.85Å; Y98-Y162 HydrophobicContact CD2-CD2 4.21Å; Y98-Y162 HydrophobicContact CD2-CE1 4.14Å; Y98-Y162 HydrophobicContact CD2-CE2 4.49Å; Y98-Y162 AromaticContact CD2-CG 3.88Å; Y98-Y162 HydrophobicContact CD2-CG 3.88Å; Y98-Y162 HydrophobicContact CE2-CD1 4.25Å; Y98-Y162 HydrophobicContact CE2-CG 4.03Å; Y98-L592 HydrophobicContact CD1-CD1 3.43Å; Y98-L592 VanDerWaalsContact CD1-CD1 3.43Å; Y98-L592 HydrophobicContact CD1-CD2 3.81Å; Y98-L592 HydrophobicContact CD1-CG 4.26Å; Y98-L592 HydrophobicContact CE1-CD1 4.01Å; Y98-L592 HydrophobicContact CG-CD1 4.38Å
99	S	95.1	Very high	93.6	Very high	9 Å²	9	31.2 Å²	31.2	6%	0.063	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-34.5	175	80.2	0	0	0	0	113.3	G95 L96 Y97 K102 Q103	G95-S99 WeakPolarHBondContact O-CB 3.46Å; G95-S99 PolarHBondContact O-N 2.94Å; L96-S99 WeakPolarHBondContact O-CB 3.42Å; L96-S99 PolarHBondContact O-N 3.19Å; L96-S99 PolarHBondContact O-OG 3.16Å; Y97-S99 PolarHBondContact O-N 3.45Å; S99-K102 PolarHBondContact O-N 3.24Å; S99-Q103 WeakPolarHBondContact O-CB 3.39Å; S99-Q103 PolarHBondContact O-N 3.32Å
100	Y	95.3	Very high	93.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-73	-36.4	176.6	-55.5	-50.6	0	0	0	112.3	L96 Y97 Y98 K102 Q103 M104 L117 T123 L131 I137	L96-Y100 HydrophobicContact CD1-CE2 4.44Å; L96-Y100 WeakPolarHBondContact CD1-OH 3.47Å; L96-Y100 HydrophobicContact CD2-CE2 4.44Å; L96-Y100 HydrophobicContact CG-CE2 3.82Å; L96-Y100 WeakPolarHBondContact CG-OH 3.48Å; L96-Y100 VanDerWaalsContact O-CD2 3.24Å; L96-Y100 WeakPolarHBondContact O-CD2 3.37Å; L96-Y100 WeakPolarHBondContact O-CE2 3.35Å; L96-Y100 PolarHBondContact O-N 2.68Å; Y97-Y100 PolarHBondContact O-N 2.95Å; Y97-Y100 VanDerWaalsContact O-N 3.12Å; Y98-Y100 VanDerWaalsContact C-N 3.31Å; Y98-Y100 PolarHBondContact O-N 3.18Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; Y100-Q103 PolarHBondContact O-N 3.07Å; Y100-M104 PolarHBondContact O-N 3.4Å; Y100-M104 VanDerWaalsContact O-N 3.08Å; Y100-L117 HydrophobicContact CD1-CD2 4.09Å; Y100-L117 HydrophobicContact CG-CD2 4.47Å; Y100-T123 HydrophobicContact CE1-CG2 4.49Å; Y100-T123 WeakPolarHBondContact OH-CG2 3.2Å; Y100-L131 HydrophobicContact CD1-CD1 3.6Å; Y100-L131 HydrophobicContact CE1-CD1 3.36Å; Y100-L131 HydrophobicContact CE1-CD2 3.94Å; Y100-L131 HydrophobicContact CE1-CG 4.26Å; Y100-L131 HydrophobicContact CG-CD1 4.48Å; Y100-I137 HydrophobicContact CD2-CB 4.41Å; Y100-I137 HydrophobicContact CD2-CD1 4.21Å; Y100-I137 HydrophobicContact CD2-CG2 3.46Å; Y100-I137 VanDerWaalsContact CD2-CG2 3.46Å; Y100-I137 HydrophobicContact CE2-CG2 3.87Å; Y100-I137 HydrophobicContact CG-CD1 4.12Å; Y100-I137 HydrophobicContact CG-CG2 4.36Å
101	Y	96.5	Very high	93.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-46.7	169.9	173.5	-104.5	0	0	0	110.6	Y97 Y98 Q103 M104 L105 E140 L143 P158 Y162	Y97-Y101 PolarHBondContact O-N 3.45Å; Y98-Y101 AromaticContact CD2-CD1 3.87Å; Y98-Y101 HydrophobicContact CD2-CD1 3.87Å; Y98-Y101 AromaticContact CE2-CD1 3.48Å; Y98-Y101 HydrophobicContact CE2-CD1 3.48Å; Y98-Y101 VanDerWaalsContact CE2-CD1 3.48Å; Y98-Y101 AromaticContact CE2-CE1 3.88Å; Y98-Y101 HydrophobicContact CE2-CE1 3.88Å; Y98-Y101 WeakPolarHBondContact O-CB 3.31Å; Y98-Y101 PolarHBondContact O-N 3.45Å; Y101-Q103 PolarHBondContact O-N 3.5Å; Y101-M104 PolarHBondContact O-N 2.84Å; Y101-L105 HydrophobicContact CD1-CD1 4.08Å; Y101-L105 HydrophobicContact CE1-CD1 3.5Å; Y101-L105 VanDerWaalsContact CE1-CD1 3.5Å; Y101-L105 HydrophobicContact CE1-CG 4.44Å; Y101-L105 HydrophobicContact CE2-CD1 4.21Å; Y101-L105 HydrophobicContact CE2-CG 4.48Å; Y101-L105 WeakPolarHBondContact O-CG 3.45Å; Y101-L105 PolarHBondContact O-N 2.95Å; Y101-E140 WeakPolarHBondContact CD2-O 3.35Å; Y101-L143 HydrophobicContact CD2-CB 4.34Å; Y101-L143 HydrophobicContact CE2-CB 3.95Å; Y101-P158 HydrophobicContact CE1-CB 3.89Å; Y101-P158 WeakPolarHBondContact CE1-O 3.37Å; Y101-P158 PolarHBondContact OH-O 2.64Å; Y101-Y162 HydrophobicContact CD1-CD2 4.15Å; Y101-Y162 HydrophobicContact CD2-CD2 4.21Å; Y101-Y162 HydrophobicContact CE1-CD2 4.43Å; Y101-Y162 HydrophobicContact CG-CD2 4.02Å
102	K	95.2	Very high	94.3	Very high	39 Å²	39	37.4 Å²	37.4	17%	0.17	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-42.7	176.1	-169	170.9	-173.2	166.5	0	112	E83 E87 Y98 S99 Y100 M104 L105 Q106 L592	E83-K102 IonicContact OE1-NZ 2.9Å; E83-K102 PolarHBondContact OE1-NZ 2.95Å; E87-K102 IonicContact OE1-NZ 2.72Å; E87-K102 PolarHBondContact OE1-NZ 2.91Å; E87-K102 IonicContact OE2-NZ 4Å; Y98-K102 PolarHBondContact O-N 2.95Å; S99-K102 PolarHBondContact O-N 3.24Å; Y100-K102 VanDerWaalsContact C-N 3.34Å; K102-M104 PolarHBondContact O-N 3.29Å; K102-L105 PolarHBondContact O-N 3.44Å; K102-Q106 HydrophobicContact CG-CG 4.35Å; K102-Q106 WeakPolarHBondContact O-CB 3.43Å; K102-Q106 VanDerWaalsContact O-CG 3.31Å; K102-Q106 WeakPolarHBondContact O-CG 3.28Å; K102-Q106 PolarHBondContact O-N 3.38Å; K102-L592 HydrophobicContact CD-CD1 4.41Å
103	Q	94.7	Very high	94.6	Very high	17 Å²	17	35.5 Å²	35.5	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-57.8	-46.3	176.6	-177.1	174.5	-7.8	0	0	112	S99 Y100 Y101 L105 Q106 A107 E116 L117	S99-Q103 WeakPolarHBondContact O-CB 3.39Å; S99-Q103 PolarHBondContact O-N 3.32Å; Y100-Q103 PolarHBondContact O-N 3.07Å; Y101-Q103 PolarHBondContact O-N 3.5Å; Q103-L105 VanDerWaalsContact C-N 3.29Å; Q103-L105 PolarHBondContact O-N 3.05Å; Q103-Q106 PolarHBondContact O-N 3.21Å; Q103-A107 PolarHBondContact O-N 3.2Å; Q103-E116 PolarHBondContact NE2-OE2 3.05Å; Q103-L117 HydrophobicContact CG-CD2 4.44Å
104	M	95.8	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-33.7	176.8	-79.1	-69	-61	0	0	113.9	Y100 Y101 K102 I110 L114 L117 V141 S144 V145 R148	Y100-M104 PolarHBondContact O-N 3.4Å; Y100-M104 VanDerWaalsContact O-N 3.08Å; Y101-M104 PolarHBondContact O-N 2.84Å; K102-M104 PolarHBondContact O-N 3.29Å; M104-I110 HydrophobicContact CE-CG2 4.39Å; M104-L114 HydrophobicContact CE-CD2 4.26Å; M104-L114 HydrophobicContact CE-CG 4.14Å; M104-L114 HydrophobicContact SD-CD2 4.47Å; M104-L114 HydrophobicContact SD-CG 4.5Å; M104-L117 HydrophobicContact CG-CD1 3.52Å; M104-L117 HydrophobicContact CG-CG 4.35Å; M104-L117 HydrophobicContact SD-CD1 3.55Å; M104-L117 VanDerWaalsContact SD-CD1 3.55Å; M104-L117 HydrophobicContact SD-CG 4.19Å; M104-V141 HydrophobicContact CE-CG1 4.26Å; M104-V141 HydrophobicContact CG-CG2 4.34Å; M104-S144 VanDerWaalsContact CB-CB 3.46Å; M104-S144 VanDerWaalsContact CB-OG 3.23Å; M104-S144 WeakPolarHBondContact CB-OG 3.33Å; M104-S144 WeakPolarHBondContact CE-OG 3.26Å; M104-V145 HydrophobicContact CE-CG2 4.35Å; M104-R148 PolarHBondContact O-NH1 2.92Å
105	L	95.2	Very high	95	Very high	39 Å²	39	39 Å²	39	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-75.9	-34.5	177.3	-67	-175.7	0	0	0	112.6	Y101 K102 Q103 Y147 R148 P158	Y101-L105 HydrophobicContact CD1-CD1 4.08Å; Y101-L105 HydrophobicContact CE1-CD1 3.5Å; Y101-L105 VanDerWaalsContact CE1-CD1 3.5Å; Y101-L105 HydrophobicContact CE1-CG 4.44Å; Y101-L105 HydrophobicContact CE2-CD1 4.21Å; Y101-L105 HydrophobicContact CE2-CG 4.48Å; Y101-L105 WeakPolarHBondContact O-CG 3.45Å; Y101-L105 PolarHBondContact O-N 2.95Å; K102-L105 PolarHBondContact O-N 3.44Å; Q103-L105 VanDerWaalsContact C-N 3.29Å; Q103-L105 PolarHBondContact O-N 3.05Å; L105-Y147 HydrophobicContact CD1-CD1 4.12Å; L105-Y147 HydrophobicContact CD1-CE1 4.38Å; L105-Y147 HydrophobicContact CD2-CD1 3.7Å; L105-Y147 HydrophobicContact CD2-CG 4.48Å; L105-R148 HydrophobicContact CD2-CG 3.74Å; L105-P158 HydrophobicContact CD1-CB 3.52Å; L105-P158 HydrophobicContact CD1-CG 3.96Å
106	Q	93.6	Very high	95.1	Very high	138 Å²	138	42.2 Å²	42.2	65%	0.645	22%	0.221	S	C	*	.	H	α-helix	trans	-77.5	-22.8	178.5	-71	178	-16	0	0	112.9	K102 Q103	K102-Q106 HydrophobicContact CG-CG 4.35Å; K102-Q106 WeakPolarHBondContact O-CB 3.43Å; K102-Q106 VanDerWaalsContact O-CG 3.31Å; K102-Q106 WeakPolarHBondContact O-CG 3.28Å; K102-Q106 PolarHBondContact O-N 3.38Å; Q103-Q106 PolarHBondContact O-N 3.21Å
107	A	94.8	Very high	95.2	Very high	5 Å²	5	42.2 Å²	42.2	4%	0.041	22%	0.221	C	C	.	.	S	Bend	trans	-63.4	137.3	177.3	0	0	0	0	0	111.7	Q103 S109 G113 R148	Q103-A107 PolarHBondContact O-N 3.2Å; A107-S109 PolarHBondContact O-N 2.89Å; A107-G113 VanDerWaalsContact CB-CA 3.42Å; A107-R148 PolarHBondContact O-NH1 2.96Å; A107-R148 PolarHBondContact O-NH2 3.18Å
108	P	94.9	Very high	95.2	Very high	93 Å²	93	44.1 Å²	44.1	60%	0.604	23%	0.231	S	C	*	.	S	Bend	trans	-61.4	-32.2	-175.3	27.8	-38.3	0	0	0	112.6	E112 R148	P108-E112 HydrophobicContact CG-CB 4.34Å; P108-E112 HydrophobicContact CG-CG 4.18Å; P108-E112 WeakPolarHBondContact CG-OE2 3.32Å; P108-R148 PolarHBondContact O-NH2 3.19Å
109	S	95.6	Very high	95.1	Very high	45 Å²	45	49.2 Å²	49.2	32%	0.315	26%	0.255	S	S	.	.	S	Bend	trans	-134.8	159.9	174	74.1	0	0	0	0	111.9	A107 Q111 E112 G113 R148	A107-S109 PolarHBondContact O-N 2.89Å; S109-Q111 VanDerWaalsContact C-N 3.28Å; S109-Q111 PolarHBondContact O-N 3.3Å; S109-E112 PolarHBondContact O-N 2.9Å; S109-E112 VanDerWaalsContact OG-CB 3.26Å; S109-E112 WeakPolarHBondContact OG-CB 3.44Å; S109-E112 PolarHBondContact OG-N 3.4Å; S109-E112 VanDerWaalsContact OG-N 3.07Å; S109-G113 PolarHBondContact O-N 2.91Å; S109-R148 VanDerWaalsContact C-NH1 3.33Å; S109-R148 PolarHBondContact O-NH1 3.4Å
110	I	95.3	Very high	95	Very high	49 Å²	49	48.9 Å²	48.9	25%	0.251	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-39.8	175.6	-66.5	169.9	0	0	0	110.4	M104 G113 L114 V145 L149	M104-I110 HydrophobicContact CE-CG2 4.39Å; I110-G113 PolarHBondContact O-N 3.29Å; I110-L114 HydrophobicContact CG2-CD1 4.08Å; I110-L114 HydrophobicContact CG2-CG 4.47Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 WeakPolarHBondContact O-CG 3.39Å; I110-L114 PolarHBondContact O-N 2.89Å; I110-V145 HydrophobicContact CD1-CG1 4.26Å; I110-V145 HydrophobicContact CD1-CG2 4.42Å; I110-V145 HydrophobicContact CG2-CG2 3.8Å; I110-L149 HydrophobicContact CD1-CD2 4.21Å; I110-L149 HydrophobicContact CD1-CG 4.36Å
111	Q	95.4	Very high	94.8	Very high	162 Å²	162	53.3 Å²	53.3	76%	0.757	28%	0.276	S	S	*	.	H	α-helix	trans	-64.7	-42.6	179.4	-176.2	177.2	4.1	0	0	111.6	S109 L114 S115	S109-Q111 VanDerWaalsContact C-N 3.28Å; S109-Q111 PolarHBondContact O-N 3.3Å; Q111-L114 PolarHBondContact O-N 3.49Å; Q111-S115 WeakPolarHBondContact O-CB 3.35Å; Q111-S115 PolarHBondContact O-N 3.32Å
112	E	95.8	Very high	94.3	Very high	95 Å²	95	56.6 Å²	56.6	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-66.7	-44.9	177.2	-169	164.2	168.6	0	0	111.2	P108 S109 L114 S115 E116	P108-E112 HydrophobicContact CG-CB 4.34Å; P108-E112 HydrophobicContact CG-CG 4.18Å; P108-E112 WeakPolarHBondContact CG-OE2 3.32Å; S109-E112 PolarHBondContact O-N 2.9Å; S109-E112 VanDerWaalsContact OG-CB 3.26Å; S109-E112 WeakPolarHBondContact OG-CB 3.44Å; S109-E112 PolarHBondContact OG-N 3.4Å; S109-E112 VanDerWaalsContact OG-N 3.07Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 2.88Å; E112-S115 WeakPolarHBondContact O-CB 3.41Å; E112-S115 PolarHBondContact O-N 3.36Å; E112-S115 VanDerWaalsContact O-N 3.08Å; E112-E116 WeakPolarHBondContact O-CG 3.5Å; E112-E116 PolarHBondContact O-N 3.34Å
113	G	95.2	Very high	94.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.3	-43	174.6	0	0	0	0	0	112.9	A107 S109 I110 E116 L117	A107-G113 VanDerWaalsContact CB-CA 3.42Å; S109-G113 PolarHBondContact O-N 2.91Å; I110-G113 PolarHBondContact O-N 3.29Å; G113-E116 PolarHBondContact O-N 3.14Å; G113-L117 WeakPolarHBondContact O-CG 3.37Å; G113-L117 PolarHBondContact O-N 3.21Å
114	L	95.3	Very high	93.9	Very high	52 Å²	52	54 Å²	54	27%	0.272	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-43	173.9	-75.6	171.9	0	0	0	111.8	M104 I110 Q111 E112 E116 L117 I118 L132 V141	M104-L114 HydrophobicContact CE-CD2 4.26Å; M104-L114 HydrophobicContact CE-CG 4.14Å; M104-L114 HydrophobicContact SD-CD2 4.47Å; M104-L114 HydrophobicContact SD-CG 4.5Å; I110-L114 HydrophobicContact CG2-CD1 4.08Å; I110-L114 HydrophobicContact CG2-CG 4.47Å; I110-L114 WeakPolarHBondContact O-CB 3.45Å; I110-L114 WeakPolarHBondContact O-CG 3.39Å; I110-L114 PolarHBondContact O-N 2.89Å; Q111-L114 PolarHBondContact O-N 3.49Å; E112-L114 VanDerWaalsContact C-N 3.34Å; E112-L114 PolarHBondContact O-N 2.88Å; L114-E116 VanDerWaalsContact C-N 3.34Å; L114-E116 PolarHBondContact O-N 3.42Å; L114-L117 PolarHBondContact O-N 2.76Å; L114-I118 WeakPolarHBondContact O-CB 3.3Å; L114-I118 WeakPolarHBondContact O-CD1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 2.86Å; L114-L132 HydrophobicContact CD2-CD1 4.28Å; L114-V141 HydrophobicContact CD2-CG1 3.57Å
115	S	95.6	Very high	93.8	Very high	61 Å²	61	54.1 Å²	54.1	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-62.5	-41.3	177.6	-176.4	0	0	0	0	111.9	Q111 E112 I118 H119	Q111-S115 WeakPolarHBondContact O-CB 3.35Å; Q111-S115 PolarHBondContact O-N 3.32Å; E112-S115 WeakPolarHBondContact O-CB 3.41Å; E112-S115 PolarHBondContact O-N 3.36Å; E112-S115 VanDerWaalsContact O-N 3.08Å; S115-I118 PolarHBondContact O-N 3.34Å; S115-H119 PolarHBondContact O-N 2.7Å; S115-H119 PolarHBondContact O-ND1 3.31Å
116	E	94.6	Very high	93.5	Very high	68 Å²	68	59.3 Å²	59.3	32%	0.318	30%	0.304	S	S	.	.	H	α-helix	trans	-64	-40.1	175.7	-72.6	-178.2	-174.2	0	0	112.3	Q103 E112 G113 L114 H119 D120	Q103-E116 PolarHBondContact NE2-OE2 3.05Å; E112-E116 WeakPolarHBondContact O-CG 3.5Å; E112-E116 PolarHBondContact O-N 3.34Å; G113-E116 PolarHBondContact O-N 3.14Å; L114-E116 VanDerWaalsContact C-N 3.34Å; L114-E116 PolarHBondContact O-N 3.42Å; E116-H119 CarbonylContact O-C 3.56Å; E116-H119 VanDerWaalsContact O-C 3.31Å; E116-D120 WeakPolarHBondContact O-CA 3.4Å; E116-D120 WeakPolarHBondContact O-CB 3.47Å; E116-D120 PolarHBondContact O-N 3.04Å
117	L	95	Very high	93.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.5	-32.2	176.3	-69	-177.9	0	0	0	113.1	Y100 Q103 M104 G113 L114 L131 I137 V141	Y100-L117 HydrophobicContact CD1-CD2 4.09Å; Y100-L117 HydrophobicContact CG-CD2 4.47Å; Q103-L117 HydrophobicContact CG-CD2 4.44Å; M104-L117 HydrophobicContact CG-CD1 3.52Å; M104-L117 HydrophobicContact CG-CG 4.35Å; M104-L117 HydrophobicContact SD-CD1 3.55Å; M104-L117 VanDerWaalsContact SD-CD1 3.55Å; M104-L117 HydrophobicContact SD-CG 4.19Å; G113-L117 WeakPolarHBondContact O-CG 3.37Å; G113-L117 PolarHBondContact O-N 3.21Å; L114-L117 PolarHBondContact O-N 2.76Å; L117-L131 HydrophobicContact CB-CD1 4.46Å; L117-L131 HydrophobicContact CD2-CD1 3.62Å; L117-L131 WeakPolarHBondContact O-CB 3.49Å; L117-L131 WeakPolarHBondContact O-CG 3.45Å; L117-L131 PolarHBondContact O-N 2.99Å; L117-I137 HydrophobicContact CD1-CD1 3.89Å; L117-I137 HydrophobicContact CD2-CD1 4.2Å; L117-I137 HydrophobicContact CG-CD1 4.5Å; L117-V141 HydrophobicContact CD1-CG2 3.52Å
118	I	94.8	Very high	93	Very high	42 Å²	42	61.6 Å²	61.6	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-74.7	-34.9	177.1	-68.9	166.6	0	0	0	111.1	L114 S115 N130 L132 F308	L114-I118 WeakPolarHBondContact O-CB 3.3Å; L114-I118 WeakPolarHBondContact O-CD1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 2.86Å; S115-I118 PolarHBondContact O-N 3.34Å; I118-N130 WeakPolarHBondContact O-CA 3.42Å; I118-N130 WeakPolarHBondContact O-CB 3.21Å; I118-L132 HydrophobicContact CD1-CD1 4.3Å; I118-L132 HydrophobicContact CG1-CD1 3.9Å; I118-F308 HydrophobicContact CD1-CZ 3.99Å; I118-F308 HydrophobicContact CG1-CZ 4.3Å
119	H	94.1	Very high	92.8	Very high	119 Å²	119	58.1 Å²	58.1	55%	0.551	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	47.8	179.6	-57.2	94.7	0	0	0	111.1	S115 E116 N121 T128	S115-H119 PolarHBondContact O-N 2.7Å; S115-H119 PolarHBondContact O-ND1 3.31Å; E116-H119 CarbonylContact O-C 3.56Å; E116-H119 VanDerWaalsContact O-C 3.31Å; H119-N121 PolarHBondContact O-N 3.45Å; H119-T128 HydrophobicContact CB-CG2 4.16Å
120	D	92.8	Very high	92.7	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.011	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-74.7	120.1	-172.9	-179.8	71.8	0	0	0	111.2	E116 L122 T123 T128 I129 L131	E116-D120 WeakPolarHBondContact O-CA 3.4Å; E116-D120 WeakPolarHBondContact O-CB 3.47Å; E116-D120 PolarHBondContact O-N 3.04Å; D120-L122 PolarHBondContact OD1-N 2.64Å; D120-L122 PolarHBondContact OD2-N 2.97Å; D120-T123 WeakPolarHBondContact OD2-CA 3.48Å; D120-T123 WeakPolarHBondContact OD2-CB 3.31Å; D120-T123 PolarHBondContact OD2-N 2.98Å; D120-T123 PolarHBondContact OD2-OG1 2.73Å; D120-T128 CarbonylContact O-C 3.55Å; D120-T128 VanDerWaalsContact O-CA 3.25Å; D120-T128 WeakPolarHBondContact O-CA 3.34Å; D120-I129 HydrophobicContact CB-CG1 4.49Å; D120-I129 PolarHBondContact N-O 2.88Å; D120-I129 PolarHBondContact O-N 3.37Å; D120-L131 HydrophobicContact CB-CD1 3.56Å; D120-L131 HydrophobicContact CB-CG 3.77Å
121	N	90.4	Very high	92.5	Very high	94 Å²	94	55 Å²	55	50%	0.503	27%	0.273	S	S	.	.			trans	-113.6	7	172.1	66.7	4.3	0	0	0	112.4	H119	H119-N121 PolarHBondContact O-N 3.45Å
122	L	87.4	Confident	92.3	Very high	68 Å²	68	47.8 Å²	47.8	36%	0.356	24%	0.239	S	C	.	.	S	Bend	trans	-101.3	-13.8	-174.7	-60.3	-179.6	0	0	0	112.7	D120 K591 V597	D120-L122 PolarHBondContact OD1-N 2.64Å; D120-L122 PolarHBondContact OD2-N 2.97Å; L122-K591 VanDerWaalsContact C-NZ 3.29Å; L122-K591 VanDerWaalsContact CB-NZ 3.35Å; L122-K591 PolarHBondContact O-NZ 3.41Å; L122-V597 HydrophobicContact CD2-CG2 4.36Å; L122-V597 WeakPolarHBondContact O-CA 3.24Å
123	T	90.1	Very high	92	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	S	Bend	trans	-89.7	-58	178.1	-54.5	0	0	0	0	110.7	L96 Y100 D120 L598	L96-T123 HydrophobicContact CD1-CG2 4.24Å; Y100-T123 HydrophobicContact CE1-CG2 4.49Å; Y100-T123 WeakPolarHBondContact OH-CG2 3.2Å; D120-T123 WeakPolarHBondContact OD2-CA 3.48Å; D120-T123 WeakPolarHBondContact OD2-CB 3.31Å; D120-T123 PolarHBondContact OD2-N 2.98Å; D120-T123 PolarHBondContact OD2-OG1 2.73Å; T123-L598 VanDerWaalsContact O-CB 3.3Å; T123-L598 WeakPolarHBondContact O-CB 3.15Å; T123-L598 PolarHBondContact O-N 3.39Å; T123-L598 VanDerWaalsContact O-N 3.12Å
124	E	91.5	Very high	91.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-104.4	118.5	-179.3	-70.4	-172	-173.9	0	0	111.6	R127 I129 R134 H601 L609	E124-R127 HydrophobicContact CB-CB 4.25Å; E124-R127 PolarHBondContact O-N 2.94Å; E124-R127 VanDerWaalsContact O-O 3.12Å; E124-I129 HydrophobicContact CB-CD1 4.49Å; E124-I129 HydrophobicContact CG-CD1 3.93Å; E124-R134 IonicContact OE1-CZ 3.97Å; E124-R134 IonicContact OE1-NH1 3.43Å; E124-R134 PolarHBondContact OE1-NH1 2.96Å; E124-R134 IonicContact OE1-NH2 3.78Å; E124-R134 PolarHBondContact OE1-NH2 3.47Å; E124-R134 IonicContact OE2-NH1 2.69Å; E124-H601 IonicContact OE1-CE1 2.73Å; E124-H601 IonicContact OE1-NE2 3.6Å; E124-H601 PolarHBondContact OE1-NE2 3.23Å; E124-L609 HydrophobicContact CG-CD1 4.5Å
125	S	91.8	Very high	90.9	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.028	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	145.4	-179.7	96.3	0	0	0	0	112	R127 V579 L598 R612 V635	S125-R127 PolarHBondContact O-N 3.45Å; S125-V579 VanDerWaalsContact CB-CG1 3.49Å; S125-L598 PolarHBondContact N-O 3.1Å; S125-R612 PolarHBondContact O-NH1 2.58Å; S125-R612 PolarHBondContact O-NH2 3.34Å; S125-R612 PolarHBondContact OG-NH2 2.94Å; S125-V635 PolarHBondContact OG-O 3.19Å
126	K	89.3	Confident	90.7	Very high	148 Å²	148	43.7 Å²	43.7	64%	0.643	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	10.7	-176.5	-58.4	-179.2	172.1	173.7	0	115.2	K633 A634	K126-K633 PolarHBondContact NZ-O 3.46Å; K126-A634 PolarHBondContact NZ-O 3.44Å
127	R	88.8	Confident	90.6	Very high	95 Å²	95	40.4 Å²	40.4	36%	0.358	20%	0.195	S	C	.	.			trans	-133.8	154.9	-179.6	-67.3	-176.6	172.4	-156	-10	110.1	E124 S125 I129 D608	E124-R127 HydrophobicContact CB-CB 4.25Å; E124-R127 PolarHBondContact O-N 2.94Å; E124-R127 VanDerWaalsContact O-O 3.12Å; S125-R127 PolarHBondContact O-N 3.45Å; R127-I129 HydrophobicContact CB-CG2 4.43Å; R127-D608 IonicContact CZ-OD2 2.98Å; R127-D608 IonicContact NH1-OD2 3.17Å; R127-D608 PolarHBondContact NH1-OD2 3.34Å; R127-D608 IonicContact NH2-OD2 3.53Å; R127-D608 PolarHBondContact NH2-OD2 3.4Å
128	T	90.1	Very high	90.6	Very high	95 Å²	95	42.1 Å²	42.1	58%	0.583	20%	0.202	S	C	*	.			trans	-117.9	124.4	167.7	-58.4	0	0	0	0	107	H119 D120	H119-T128 HydrophobicContact CB-CG2 4.16Å; D120-T128 CarbonylContact O-C 3.55Å; D120-T128 VanDerWaalsContact O-CA 3.25Å; D120-T128 WeakPolarHBondContact O-CA 3.34Å
129	I	91.1	Very high	90.6	Very high	21 Å²	21	40.7 Å²	40.7	11%	0.108	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-126.3	146.6	-175.3	62	171.5	0	0	0	110.8	D120 E124 R127 L131 M135	D120-I129 HydrophobicContact CB-CG1 4.49Å; D120-I129 PolarHBondContact N-O 2.88Å; D120-I129 PolarHBondContact O-N 3.37Å; E124-I129 HydrophobicContact CB-CD1 4.49Å; E124-I129 HydrophobicContact CG-CD1 3.93Å; R127-I129 HydrophobicContact CB-CG2 4.43Å; I129-L131 HydrophobicContact CD1-CD2 3.56Å; I129-L131 HydrophobicContact CG1-CD2 3.92Å; I129-L131 HydrophobicContact CG1-CG 4.44Å; I129-L131 PolarHBondContact O-N 3.49Å; I129-M135 HydrophobicContact CD1-CE 4.2Å
130	N	92.3	Very high	90.7	Very high	28 Å²	28	35 Å²	35	15%	0.15	17%	0.168	C	C	.	.			trans	-87.1	104.7	169.2	-177.7	-18	0	0	0	109.2	I118 L132 Q133 R134	I118-N130 WeakPolarHBondContact O-CA 3.42Å; I118-N130 WeakPolarHBondContact O-CB 3.21Å; N130-L132 VanDerWaalsContact C-N 3.34Å; N130-L132 PolarHBondContact O-N 3.33Å; N130-L132 WeakPolarHBondContact OD1-CB 3.46Å; N130-L132 PolarHBondContact OD1-N 3.32Å; N130-Q133 HydrophobicContact CB-CB 3.94Å; N130-Q133 PolarHBondContact O-N 2.81Å; N130-Q133 PolarHBondContact OD1-N 3.5Å; N130-R134 PolarHBondContact O-N 2.89Å
131	L	91.6	Very high	90.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.1	-34.1	-177.9	-63.3	172.3	0	0	0	112.2	Y100 L117 D120 I129 Q133 R134 M135 I137	Y100-L131 HydrophobicContact CD1-CD1 3.6Å; Y100-L131 HydrophobicContact CE1-CD1 3.36Å; Y100-L131 HydrophobicContact CE1-CD2 3.94Å; Y100-L131 HydrophobicContact CE1-CG 4.26Å; Y100-L131 HydrophobicContact CG-CD1 4.48Å; L117-L131 HydrophobicContact CB-CD1 4.46Å; L117-L131 HydrophobicContact CD2-CD1 3.62Å; L117-L131 WeakPolarHBondContact O-CB 3.49Å; L117-L131 WeakPolarHBondContact O-CG 3.45Å; L117-L131 PolarHBondContact O-N 2.99Å; D120-L131 HydrophobicContact CB-CD1 3.56Å; D120-L131 HydrophobicContact CB-CG 3.77Å; I129-L131 HydrophobicContact CD1-CD2 3.56Å; I129-L131 HydrophobicContact CG1-CD2 3.92Å; I129-L131 HydrophobicContact CG1-CG 4.44Å; I129-L131 PolarHBondContact O-N 3.49Å; L131-Q133 VanDerWaalsContact C-N 3.3Å; L131-Q133 PolarHBondContact O-N 3.49Å; L131-R134 PolarHBondContact O-N 3.36Å; L131-M135 HydrophobicContact CB-CG 4.49Å; L131-M135 HydrophobicContact CD2-CE 4.46Å; L131-M135 HydrophobicContact CD2-CG 3.88Å; L131-M135 WeakPolarHBondContact O-CB 3.44Å; L131-M135 PolarHBondContact O-N 2.94Å; L131-I137 HydrophobicContact CB-CD1 3.67Å; L131-I137 HydrophobicContact CB-CG1 4.46Å
132	L	91	Very high	91.2	Very high	10 Å²	10	37.7 Å²	37.7	5%	0.052	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-32.5	176.6	-75.5	173.4	0	0	0	112.4	L114 I118 N130 I137 Y138 V141 F308	L114-L132 HydrophobicContact CD2-CD1 4.28Å; I118-L132 HydrophobicContact CD1-CD1 4.3Å; I118-L132 HydrophobicContact CG1-CD1 3.9Å; N130-L132 VanDerWaalsContact C-N 3.34Å; N130-L132 PolarHBondContact O-N 3.33Å; N130-L132 WeakPolarHBondContact OD1-CB 3.46Å; N130-L132 PolarHBondContact OD1-N 3.32Å; L132-I137 HydrophobicContact CD2-CD1 4.46Å; L132-I137 HydrophobicContact CD2-CG1 3.99Å; L132-Y138 HydrophobicContact CD2-CD1 4.21Å; L132-Y138 HydrophobicContact CD2-CE1 4Å; L132-Y138 HydrophobicContact CD2-CE2 4.38Å; L132-Y138 HydrophobicContact CD2-CG 4.49Å; L132-Y138 WeakPolarHBondContact O-CE2 3.29Å; L132-Y138 VanDerWaalsContact O-CZ 3.3Å; L132-Y138 PolarHBondContact O-OH 3Å; L132-V141 HydrophobicContact CD2-CG2 3.96Å; L132-F308 HydrophobicContact CB-CD2 4.32Å; L132-F308 HydrophobicContact CB-CE2 3.78Å; L132-F308 HydrophobicContact CD1-CE2 4.14Å
133	Q	88.9	Confident	91.6	Very high	70 Å²	70	34.7 Å²	34.7	33%	0.327	16%	0.161	S	C	.	.	H	α-helix	trans	-72.4	-37.1	174.8	-175.9	174.2	30.3	0	0	111.8	N130 L131 Q307 F308 N310	N130-Q133 HydrophobicContact CB-CB 3.94Å; N130-Q133 PolarHBondContact O-N 2.81Å; N130-Q133 PolarHBondContact OD1-N 3.5Å; L131-Q133 VanDerWaalsContact C-N 3.3Å; L131-Q133 PolarHBondContact O-N 3.49Å; Q133-Q307 WeakPolarHBondContact CG-O 3.18Å; Q133-F308 HydrophobicContact CB-CB 4.39Å; Q133-F308 HydrophobicContact CB-CD2 4.45Å; Q133-F308 HydrophobicContact CG-CB 4.4Å; Q133-F308 PolarHBondContact NE2-O 3.42Å; Q133-N310 HydrophobicContact CG-CB 4.18Å; Q133-N310 PolarHBondContact O-ND2 2.92Å
134	R	84.5	Confident	91.9	Very high	44 Å²	44	34.7 Å²	34.7	17%	0.166	16%	0.161	C	C	.	.	H	α-helix	trans	-104	-35.7	-165.8	-173.7	168.8	165.2	-152.1	-14.3	116	E124 N130 L131 H603 D606	E124-R134 IonicContact OE1-CZ 3.97Å; E124-R134 IonicContact OE1-NH1 3.43Å; E124-R134 PolarHBondContact OE1-NH1 2.96Å; E124-R134 IonicContact OE1-NH2 3.78Å; E124-R134 PolarHBondContact OE1-NH2 3.47Å; E124-R134 IonicContact OE2-NH1 2.69Å; N130-R134 PolarHBondContact O-N 2.89Å; L131-R134 PolarHBondContact O-N 3.36Å; R134-H603 PolarHBondContact O-CE1 2.88Å; R134-H603 PolarHBondContact O-NE2 3.33Å; R134-D606 VanDerWaalsContact CZ-CB 3.47Å; R134-D606 IonicContact NH2-OD1 3.37Å
135	M	84	Confident	92.1	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.171	C	C	.	.	S	Bend	trans	-105.4	5.1	-162.8	-59.2	-70.5	174.1	0	0	114.7	I129 L131 I137 R215 H601 H603	I129-M135 HydrophobicContact CD1-CE 4.2Å; L131-M135 HydrophobicContact CB-CG 4.49Å; L131-M135 HydrophobicContact CD2-CE 4.46Å; L131-M135 HydrophobicContact CD2-CG 3.88Å; L131-M135 WeakPolarHBondContact O-CB 3.44Å; L131-M135 PolarHBondContact O-N 2.94Å; M135-I137 VanDerWaalsContact C-N 3.26Å; M135-I137 HydrophobicContact CB-CG2 3.63Å; M135-I137 PolarHBondContact O-N 2.95Å; M135-R215 PolarHBondContact O-NH2 3.31Å; M135-H601 VanDerWaalsContact CE-CE1 3.46Å; M135-H601 WeakPolarHBondContact CE-CE1 3.22Å; M135-H603 HydrophobicContact CE-CB 4.27Å; M135-H603 HydrophobicContact SD-CB 3.74Å; M135-H603 PolarHBondContact SD-CD2 3.09Å
136	N	89.8	Confident	92.3	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.037	18%	0.184	C	C	.	.			trans	46.7	45.3	-174	-71.5	71.5	0	0	0	113	Y138 Q139 R215 L259 Q262 Q307	N136-Y138 VanDerWaalsContact C-N 3.31Å; N136-Y138 PolarHBondContact O-N 3.3Å; N136-Q139 PolarHBondContact O-OE1 2.81Å; N136-R215 PolarHBondContact O-NH2 3.48Å; N136-L259 PolarHBondContact ND2-O 3.3Å; N136-Q262 WeakPolarHBondContact OD1-CB 3.43Å; N136-Q307 PolarHBondContact ND2-NE2 3.12Å
137	I	93.4	Very high	92.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.155	C	C	.	.			trans	-90	23	-174.9	61.3	163	0	0	0	114.8	Y97 Y100 L117 L131 L132 M135 Q139 E140 V141 R215	Y97-I137 HydrophobicContact CD1-CG2 4.26Å; Y100-I137 HydrophobicContact CD2-CB 4.41Å; Y100-I137 HydrophobicContact CD2-CD1 4.21Å; Y100-I137 HydrophobicContact CD2-CG2 3.46Å; Y100-I137 VanDerWaalsContact CD2-CG2 3.46Å; Y100-I137 HydrophobicContact CE2-CG2 3.87Å; Y100-I137 HydrophobicContact CG-CD1 4.12Å; Y100-I137 HydrophobicContact CG-CG2 4.36Å; L117-I137 HydrophobicContact CD1-CD1 3.89Å; L117-I137 HydrophobicContact CD2-CD1 4.2Å; L117-I137 HydrophobicContact CG-CD1 4.5Å; L131-I137 HydrophobicContact CB-CD1 3.67Å; L131-I137 HydrophobicContact CB-CG1 4.46Å; L132-I137 HydrophobicContact CD2-CD1 4.46Å; L132-I137 HydrophobicContact CD2-CG1 3.99Å; M135-I137 VanDerWaalsContact C-N 3.26Å; M135-I137 HydrophobicContact CB-CG2 3.63Å; M135-I137 PolarHBondContact O-N 2.95Å; I137-Q139 VanDerWaalsContact C-N 3.33Å; I137-Q139 PolarHBondContact O-N 2.89Å; I137-E140 WeakPolarHBondContact CA-OE2 3.39Å; I137-E140 WeakPolarHBondContact CB-OE2 3.41Å; I137-E140 PolarHBondContact O-N 3.38Å; I137-V141 PolarHBondContact O-N 3.24Å; I137-V141 VanDerWaalsContact O-N 3.1Å; I137-R215 VanDerWaalsContact CA-NH2 3.33Å
138	Y	94.7	Very high	92.8	Very high	36 Å²	36	31 Å²	31	14%	0.141	15%	0.15	C	C	.	.	H	α-helix	trans	-66.9	-35.1	-173.5	-70.9	-93.2	0	0	0	112.4	L132 N136 V141 F142 L259 L306 Q307	L132-Y138 HydrophobicContact CD2-CD1 4.21Å; L132-Y138 HydrophobicContact CD2-CE1 4Å; L132-Y138 HydrophobicContact CD2-CE2 4.38Å; L132-Y138 HydrophobicContact CD2-CG 4.49Å; L132-Y138 WeakPolarHBondContact O-CE2 3.29Å; L132-Y138 VanDerWaalsContact O-CZ 3.3Å; L132-Y138 PolarHBondContact O-OH 3Å; N136-Y138 VanDerWaalsContact C-N 3.31Å; N136-Y138 PolarHBondContact O-N 3.3Å; Y138-V141 PolarHBondContact O-N 3.25Å; Y138-F142 VanDerWaalsContact O-CB 3.23Å; Y138-F142 WeakPolarHBondContact O-CB 3.39Å; Y138-F142 PolarHBondContact O-N 3.45Å; Y138-L259 HydrophobicContact CD1-CD1 3.86Å; Y138-L259 HydrophobicContact CD1-CD2 4.36Å; Y138-L259 HydrophobicContact CD1-CG 4.35Å; Y138-L259 HydrophobicContact CD2-CD1 3.6Å; Y138-L259 HydrophobicContact CD2-CG 3.99Å; Y138-L259 HydrophobicContact CE1-CD1 4.18Å; Y138-L259 HydrophobicContact CE2-CD1 3.99Å; Y138-L259 HydrophobicContact CG-CD1 3.57Å; Y138-L259 HydrophobicContact CG-CD2 4.09Å; Y138-L259 HydrophobicContact CG-CG 3.76Å; Y138-L306 PolarHBondContact OH-O 3.33Å; Y138-Q307 HydrophobicContact CE2-CG 3.68Å; Y138-Q307 WeakPolarHBondContact OH-CA 3.25Å
139	Q	95.1	Very high	93	Very high	11 Å²	11	32.4 Å²	32.4	5%	0.051	15%	0.153	C	C	.	.	H	α-helix	trans	-65.4	-39.4	175.6	54.6	-92.2	43.4	0	0	111.8	N136 I137 F142 L143 R215 W218 T260	N136-Q139 PolarHBondContact O-OE1 2.81Å; I137-Q139 VanDerWaalsContact C-N 3.33Å; I137-Q139 PolarHBondContact O-N 2.89Å; Q139-F142 PolarHBondContact O-N 2.92Å; Q139-L143 WeakPolarHBondContact O-CB 3.49Å; Q139-L143 VanDerWaalsContact O-CG 3.3Å; Q139-L143 WeakPolarHBondContact O-CG 3.35Å; Q139-L143 PolarHBondContact O-N 3.36Å; Q139-R215 VanDerWaalsContact CD-NH1 3.35Å; Q139-W218 HydrophobicContact CB-CD2 4.06Å; Q139-W218 HydrophobicContact CB-CE3 3.78Å; Q139-W218 HydrophobicContact CB-CH2 4.46Å; Q139-W218 HydrophobicContact CB-CZ3 4.03Å; Q139-W218 HydrophobicContact CG-CD2 3.78Å; Q139-W218 HydrophobicContact CG-CE3 4.06Å; Q139-W218 HydrophobicContact CG-CG 4.15Å; Q139-W218 HydrophobicContact CG-CZ2 4.32Å; Q139-T260 PolarHBondContact NE2-O 3.02Å
140	E	96.8	Very high	93.1	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-45.9	175.1	-72.1	70.2	-139.5	0	0	110.8	Y97 Y101 I137 L143 S144 Y162 R215	Y97-E140 WeakPolarHBondContact O-CG 3.49Å; Y101-E140 WeakPolarHBondContact CD2-O 3.35Å; I137-E140 WeakPolarHBondContact CA-OE2 3.39Å; I137-E140 WeakPolarHBondContact CB-OE2 3.41Å; I137-E140 PolarHBondContact O-N 3.38Å; E140-L143 PolarHBondContact O-N 3.06Å; E140-S144 WeakPolarHBondContact O-CB 3.43Å; E140-S144 PolarHBondContact O-N 3.05Å; E140-S144 PolarHBondContact O-OG 3.35Å; E140-Y162 HydrophobicContact CG-CE2 4.07Å; E140-Y162 PolarHBondContact OE1-OH 2.91Å; E140-R215 IonicContact OE1-CZ 3.46Å; E140-R215 IonicContact OE1-NH1 3.45Å; E140-R215 PolarHBondContact OE1-NH1 3.31Å; E140-R215 IonicContact OE2-CZ 3.89Å; E140-R215 IonicContact OE2-NH1 3.14Å; E140-R215 PolarHBondContact OE2-NH1 3.43Å; E140-R215 IonicContact OE2-NH2 2.63Å; E140-R215 PolarHBondContact OE2-NH2 3.02Å
141	V	96.5	Very high	93	Very high	18 Å²	18	38.7 Å²	38.7	11%	0.109	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-47.8	177.5	171.2	0	0	0	0	110.9	M104 L114 L117 L132 I137 Y138 L143 S144 V145	M104-V141 HydrophobicContact CE-CG1 4.26Å; M104-V141 HydrophobicContact CG-CG2 4.34Å; L114-V141 HydrophobicContact CD2-CG1 3.57Å; L117-V141 HydrophobicContact CD1-CG2 3.52Å; L132-V141 HydrophobicContact CD2-CG2 3.96Å; I137-V141 PolarHBondContact O-N 3.24Å; I137-V141 VanDerWaalsContact O-N 3.1Å; Y138-V141 PolarHBondContact O-N 3.25Å; V141-L143 PolarHBondContact O-N 3.02Å; V141-S144 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-OG 3.41Å; V141-V145 WeakPolarHBondContact O-CG2 3.27Å; V141-V145 PolarHBondContact O-N 3.43Å
142	F	95.9	Very high	92.9	Very high	134 Å²	134	40.8 Å²	40.8	59%	0.588	20%	0.204	S	C	*	.	H	α-helix	trans	-57.6	-46.7	177.9	176.6	-102.3	0	0	0	111.9	Y138 Q139 V145 L146	Y138-F142 VanDerWaalsContact O-CB 3.23Å; Y138-F142 WeakPolarHBondContact O-CB 3.39Å; Y138-F142 PolarHBondContact O-N 3.45Å; Q139-F142 PolarHBondContact O-N 2.92Å; F142-V145 PolarHBondContact O-N 3.14Å; F142-L146 HydrophobicContact CE1-CD2 4.28Å; F142-L146 WeakPolarHBondContact O-CB 3.33Å; F142-L146 PolarHBondContact O-N 2.88Å
143	L	96.4	Very high	92.8	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-67.5	-37.6	178	-69.9	-173.3	0	0	0	113.2	Y101 Q139 E140 V141 V145 L146 Y147 F161 Y162 T165 W218	Y101-L143 HydrophobicContact CD2-CB 4.34Å; Y101-L143 HydrophobicContact CE2-CB 3.95Å; Q139-L143 WeakPolarHBondContact O-CB 3.49Å; Q139-L143 VanDerWaalsContact O-CG 3.3Å; Q139-L143 WeakPolarHBondContact O-CG 3.35Å; Q139-L143 PolarHBondContact O-N 3.36Å; E140-L143 PolarHBondContact O-N 3.06Å; V141-L143 PolarHBondContact O-N 3.02Å; L143-V145 VanDerWaalsContact C-N 3.3Å; L143-V145 PolarHBondContact O-N 3.26Å; L143-L146 HydrophobicContact CD2-CD2 4.38Å; L143-L146 PolarHBondContact O-N 2.95Å; L143-Y147 VanDerWaalsContact O-CB 3.28Å; L143-Y147 WeakPolarHBondContact O-CB 3.08Å; L143-Y147 PolarHBondContact O-N 2.9Å; L143-F161 HydrophobicContact CB-CE1 4.16Å; L143-F161 HydrophobicContact CD2-CE1 4.05Å; L143-F161 HydrophobicContact CD2-CZ 4.23Å; L143-Y162 HydrophobicContact CD1-CD2 4.24Å; L143-T165 HydrophobicContact CD1-CG2 3.92Å; L143-T165 HydrophobicContact CD2-CG2 3.94Å; L143-W218 HydrophobicContact CD1-CH2 3.35Å; L143-W218 HydrophobicContact CD1-CZ2 4.31Å; L143-W218 HydrophobicContact CD1-CZ3 3.96Å; L143-W218 HydrophobicContact CG-CH2 4.44Å
144	S	96.3	Very high	92.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-39.8	177.1	71.6	0	0	0	0	111.4	M104 E140 V141 R148	M104-S144 VanDerWaalsContact CB-CB 3.46Å; M104-S144 VanDerWaalsContact CB-OG 3.23Å; M104-S144 WeakPolarHBondContact CB-OG 3.33Å; M104-S144 WeakPolarHBondContact CE-OG 3.26Å; E140-S144 WeakPolarHBondContact O-CB 3.43Å; E140-S144 PolarHBondContact O-N 3.05Å; E140-S144 PolarHBondContact O-OG 3.35Å; V141-S144 PolarHBondContact O-N 2.93Å; V141-S144 PolarHBondContact O-OG 3.41Å; S144-R148 WeakPolarHBondContact O-CB 3.29Å; S144-R148 VanDerWaalsContact O-CG 3.26Å; S144-R148 WeakPolarHBondContact O-CG 3.37Å; S144-R148 PolarHBondContact O-N 3.38Å
145	V	95.8	Very high	93	Very high	35 Å²	35	54 Å²	54	21%	0.212	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-47.5	174.7	170.5	0	0	0	0	110.3	M104 I110 V141 F142 L143 Y147 R148 L149	M104-V145 HydrophobicContact CE-CG2 4.35Å; I110-V145 HydrophobicContact CD1-CG1 4.26Å; I110-V145 HydrophobicContact CD1-CG2 4.42Å; I110-V145 HydrophobicContact CG2-CG2 3.8Å; V141-V145 WeakPolarHBondContact O-CG2 3.27Å; V141-V145 PolarHBondContact O-N 3.43Å; F142-V145 PolarHBondContact O-N 3.14Å; L143-V145 VanDerWaalsContact C-N 3.3Å; L143-V145 PolarHBondContact O-N 3.26Å; V145-Y147 VanDerWaalsContact C-N 3.33Å; V145-Y147 PolarHBondContact O-N 2.89Å; V145-R148 PolarHBondContact O-N 2.88Å; V145-L149 HydrophobicContact CG1-CD1 3.61Å; V145-L149 HydrophobicContact CG1-CG 4.21Å; V145-L149 WeakPolarHBondContact O-CB 3.44Å; V145-L149 VanDerWaalsContact O-CG 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.45Å; V145-L149 PolarHBondContact O-N 3.47Å
146	L	95.6	Very high	93.5	Very high	57 Å²	57	56.2 Å²	56.2	30%	0.298	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-43.3	178.9	-171.3	61.2	0	0	0	111.9	F142 L143 R148 L149 L150 F161	F142-L146 HydrophobicContact CE1-CD2 4.28Å; F142-L146 WeakPolarHBondContact O-CB 3.33Å; F142-L146 PolarHBondContact O-N 2.88Å; L143-L146 HydrophobicContact CD2-CD2 4.38Å; L143-L146 PolarHBondContact O-N 2.95Å; L146-R148 VanDerWaalsContact C-N 3.35Å; L146-R148 PolarHBondContact O-N 2.8Å; L146-L149 PolarHBondContact O-N 3.36Å; L146-L150 HydrophobicContact CD1-CD1 3.44Å; L146-L150 VanDerWaalsContact CD1-CD1 3.44Å; L146-L150 HydrophobicContact CD1-CG 3.9Å; L146-L150 HydrophobicContact CG-CD1 3.8Å; L146-L150 HydrophobicContact CG-CG 4.44Å; L146-L150 WeakPolarHBondContact O-CB 3.18Å; L146-L150 WeakPolarHBondContact O-CG 3.23Å; L146-L150 PolarHBondContact O-N 3.41Å; L146-F161 HydrophobicContact CD2-CZ 3.97Å; L146-F161 HydrophobicContact CG-CZ 4.23Å
147	Y	95.5	Very high	93.6	Very high	12 Å²	12	60.2 Å²	60.2	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-67.4	-31.9	178.4	-172.9	-98.9	0	0	0	113.3	L105 L143 V145 L152 Q153 L156 P158 F161	L105-Y147 HydrophobicContact CD1-CD1 4.12Å; L105-Y147 HydrophobicContact CD1-CE1 4.38Å; L105-Y147 HydrophobicContact CD2-CD1 3.7Å; L105-Y147 HydrophobicContact CD2-CG 4.48Å; L143-Y147 VanDerWaalsContact O-CB 3.28Å; L143-Y147 WeakPolarHBondContact O-CB 3.08Å; L143-Y147 PolarHBondContact O-N 2.9Å; V145-Y147 VanDerWaalsContact C-N 3.33Å; V145-Y147 PolarHBondContact O-N 2.89Å; Y147-L152 HydrophobicContact CD2-CB 3.97Å; Y147-L152 HydrophobicContact CD2-CD1 4.37Å; Y147-L152 HydrophobicContact CE2-CB 4.02Å; Y147-Q153 HydrophobicContact CD1-CG 4.18Å; Y147-Q153 HydrophobicContact CE1-CG 3.52Å; Y147-L156 WeakPolarHBondContact CE2-O 3.46Å; Y147-L156 PolarHBondContact OH-O 3.01Å; Y147-P158 HydrophobicContact CE1-CB 4.19Å; Y147-P158 HydrophobicContact CE1-CG 3.74Å; Y147-P158 VanDerWaalsContact OH-CD 3.31Å; Y147-P158 WeakPolarHBondContact OH-CD 3.33Å; Y147-F161 HydrophobicContact CD2-CB 3.86Å; Y147-F161 AromaticContact CD2-CD1 3.58Å; Y147-F161 HydrophobicContact CD2-CD1 3.58Å; Y147-F161 HydrophobicContact CD2-CD2 4.42Å; Y147-F161 HydrophobicContact CD2-CE1 4.21Å; Y147-F161 AromaticContact CD2-CG 3.68Å; Y147-F161 HydrophobicContact CD2-CG 3.68Å; Y147-F161 HydrophobicContact CE2-CB 4Å; Y147-F161 HydrophobicContact CE2-CG 4.29Å; Y147-F161 HydrophobicContact CG-CD1 4.09Å
148	R	93.8	Very high	93.7	Very high	66 Å²	66	62.3 Å²	62.3	25%	0.249	32%	0.318	C	S	.	.	H	α-helix	trans	-78.9	-30.8	175.9	-72.3	179.6	70.3	158.2	9.1	113.5	M104 L105 A107 P108 S109 S144 V145 L146	M104-R148 PolarHBondContact O-NH1 2.92Å; L105-R148 HydrophobicContact CD2-CG 3.74Å; A107-R148 PolarHBondContact O-NH1 2.96Å; A107-R148 PolarHBondContact O-NH2 3.18Å; P108-R148 PolarHBondContact O-NH2 3.19Å; S109-R148 VanDerWaalsContact C-NH1 3.33Å; S109-R148 PolarHBondContact O-NH1 3.4Å; S144-R148 WeakPolarHBondContact O-CB 3.29Å; S144-R148 VanDerWaalsContact O-CG 3.26Å; S144-R148 WeakPolarHBondContact O-CG 3.37Å; S144-R148 PolarHBondContact O-N 3.38Å; V145-R148 PolarHBondContact O-N 2.88Å; L146-R148 VanDerWaalsContact C-N 3.35Å; L146-R148 PolarHBondContact O-N 2.8Å
149	L	93.8	Very high	93.7	Very high	124 Å²	124	61.1 Å²	61.1	65%	0.649	31%	0.314	S	S	*	.	H	α-helix	trans	-85.9	-31.5	-177.5	-69.3	178.6	0	0	0	113.1	I110 V145 L146	I110-L149 HydrophobicContact CD1-CD2 4.21Å; I110-L149 HydrophobicContact CD1-CG 4.36Å; V145-L149 HydrophobicContact CG1-CD1 3.61Å; V145-L149 HydrophobicContact CG1-CG 4.21Å; V145-L149 WeakPolarHBondContact O-CB 3.44Å; V145-L149 VanDerWaalsContact O-CG 3.29Å; V145-L149 WeakPolarHBondContact O-CG 3.45Å; V145-L149 PolarHBondContact O-N 3.47Å; L146-L149 PolarHBondContact O-N 3.36Å
150	L	92.9	Very high	93.6	Very high	80 Å²	80	61.7 Å²	61.7	42%	0.419	32%	0.316	S	S	.	.	S	Bend	trans	-90.8	152.5	178.6	-62.4	-178.6	0	0	0	111.2	L146 L152	L146-L150 HydrophobicContact CD1-CD1 3.44Å; L146-L150 VanDerWaalsContact CD1-CD1 3.44Å; L146-L150 HydrophobicContact CD1-CG 3.9Å; L146-L150 HydrophobicContact CG-CD1 3.8Å; L146-L150 HydrophobicContact CG-CG 4.44Å; L146-L150 WeakPolarHBondContact O-CB 3.18Å; L146-L150 WeakPolarHBondContact O-CG 3.23Å; L146-L150 PolarHBondContact O-N 3.41Å; L150-L152 HydrophobicContact CB-CD1 3.91Å; L150-L152 HydrophobicContact CB-CG 3.73Å; L150-L152 HydrophobicContact CD1-CD1 3.93Å; L150-L152 HydrophobicContact CD1-CG 4.4Å; L150-L152 PolarHBondContact O-N 3.15Å
151	P	90.7	Very high	93.6	Very high	101 Å²	101	62.7 Å²	62.7	66%	0.656	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-74.8	37.9	177.7	33.6	-37.3	0	0	0	112.9	Y155	P151-Y155 WeakPolarHBondContact O-CD2 3.16Å
152	L	90.4	Very high	93.6	Very high	45 Å²	45	61.9 Å²	61.9	24%	0.236	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-76.4	-24.4	-177	-65.4	174.2	0	0	0	112.7	Y147 L150 A154 Y155 L156 F161	Y147-L152 HydrophobicContact CD2-CB 3.97Å; Y147-L152 HydrophobicContact CD2-CD1 4.37Å; Y147-L152 HydrophobicContact CE2-CB 4.02Å; L150-L152 HydrophobicContact CB-CD1 3.91Å; L150-L152 HydrophobicContact CB-CG 3.73Å; L150-L152 HydrophobicContact CD1-CD1 3.93Å; L150-L152 HydrophobicContact CD1-CG 4.4Å; L150-L152 PolarHBondContact O-N 3.15Å; L152-A154 PolarHBondContact O-N 3.45Å; L152-A154 VanDerWaalsContact O-N 3.12Å; L152-Y155 PolarHBondContact O-N 3.42Å; L152-L156 PolarHBondContact O-N 3.23Å; L152-F161 HydrophobicContact CD1-CD2 3.88Å; L152-F161 HydrophobicContact CD1-CE2 3.45Å; L152-F161 VanDerWaalsContact CD1-CE2 3.45Å; L152-F161 HydrophobicContact CD1-CZ 3.82Å
153	Q	87.3	Confident	93.6	Very high	122 Å²	122	55.6 Å²	55.6	57%	0.57	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.6	-24.4	178.7	-66.8	174.9	8.5	0	0	113.3	Y147 Y155	Y147-Q153 HydrophobicContact CD1-CG 4.18Å; Y147-Q153 HydrophobicContact CE1-CG 3.52Å; Q153-Y155 VanDerWaalsContact C-N 3.33Å
154	A	89.1	Confident	93.5	Very high	82 Å²	82	60.1 Å²	60.1	68%	0.678	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-76.5	-19.3	177.3	0	0	0	0	0	113.7	L152	L152-A154 PolarHBondContact O-N 3.45Å; L152-A154 VanDerWaalsContact O-N 3.12Å
155	Y	89.8	Confident	93.5	Very high	197 Å²	197	61.7 Å²	61.7	77%	0.773	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-27.1	-169.7	-57.4	-74.8	0	0	0	113.8	P151 L152 Q153	P151-Y155 WeakPolarHBondContact O-CD2 3.16Å; L152-Y155 PolarHBondContact O-N 3.42Å; Q153-Y155 VanDerWaalsContact C-N 3.33Å
156	L	92.9	Very high	93.5	Very high	47 Å²	47	60 Å²	60	25%	0.246	31%	0.305	C	S	.	.			trans	-143.3	128.5	-168.3	-162.4	64.2	0	0	0	111.5	Y147 L152 Y160 F161 Y164	Y147-L156 WeakPolarHBondContact CE2-O 3.46Å; Y147-L156 PolarHBondContact OH-O 3.01Å; L152-L156 PolarHBondContact O-N 3.23Å; L156-Y160 VanDerWaalsContact CD1-CB 3.47Å; L156-Y160 HydrophobicContact CD1-CD2 4.38Å; L156-Y160 HydrophobicContact CD1-CG 4.24Å; L156-F161 HydrophobicContact CD2-CB 3.79Å; L156-F161 HydrophobicContact CD2-CD2 4.2Å; L156-F161 HydrophobicContact CG-CB 4.36Å; L156-Y164 HydrophobicContact CD1-CD2 4.33Å; L156-Y164 HydrophobicContact CD1-CE2 4.12Å; L156-Y164 HydrophobicContact CD2-CD2 4.28Å
157	E	93.4	Very high	93.6	Very high	92 Å²	92	57.4 Å²	57.4	43%	0.43	29%	0.291	S	S	.	.			trans	-63.9	151.5	172.3	-58	177.2	-158.3	0	0	110.7	R86 V159 Y160 F161	R86-E157 IonicContact NH1-OE1 3.99Å; R86-E157 IonicContact NH1-OE2 2.83Å; R86-E157 PolarHBondContact NH1-OE2 3.25Å; E157-V159 HydrophobicContact CB-CG1 4.37Å; E157-V159 PolarHBondContact O-N 2.8Å; E157-V159 VanDerWaalsContact O-N 3.14Å; E157-Y160 HydrophobicContact CB-CD2 3.69Å; E157-Y160 HydrophobicContact CB-CE2 4.11Å; E157-Y160 HydrophobicContact CG-CD2 4.09Å; E157-Y160 HydrophobicContact CG-CE2 4.1Å; E157-Y160 PolarHBondContact O-N 3.21Å; E157-Y160 VanDerWaalsContact O-N 3.14Å; E157-F161 PolarHBondContact O-N 3.07Å; E157-F161 VanDerWaalsContact O-N 3.15Å
158	P	94.2	Very high	93.6	Very high	44 Å²	44	59.9 Å²	59.9	29%	0.286	31%	0.31	S	S	.	.	H	α-helix	trans	-55.2	-36.4	-177.3	-26.4	33.3	0	0	0	114.4	Y101 L105 Y147 F161 Y162	Y101-P158 HydrophobicContact CE1-CB 3.89Å; Y101-P158 WeakPolarHBondContact CE1-O 3.37Å; Y101-P158 PolarHBondContact OH-O 2.64Å; L105-P158 HydrophobicContact CD1-CB 3.52Å; L105-P158 HydrophobicContact CD1-CG 3.96Å; Y147-P158 HydrophobicContact CE1-CB 4.19Å; Y147-P158 HydrophobicContact CE1-CG 3.74Å; Y147-P158 VanDerWaalsContact OH-CD 3.31Å; Y147-P158 WeakPolarHBondContact OH-CD 3.33Å; P158-F161 PolarHBondContact O-N 3.4Å; P158-Y162 WeakPolarHBondContact O-CB 3.18Å; P158-Y162 PolarHBondContact O-N 3.26Å; P158-Y162 VanDerWaalsContact O-N 3.1Å
159	V	94.6	Very high	93.7	Very high	10 Å²	10	57.9 Å²	57.9	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-66.1	-43.4	-179.1	69	0	0	0	0	111.5	F78 F90 Y98 E157 Y162 I163	F78-V159 HydrophobicContact CE1-CG1 4.31Å; F78-V159 HydrophobicContact CE1-CG2 4.01Å; F78-V159 HydrophobicContact CZ-CG2 3.7Å; F90-V159 HydrophobicContact CE2-CG2 3.92Å; F90-V159 HydrophobicContact CZ-CG2 4.07Å; Y98-V159 HydrophobicContact CE1-CG2 4.44Å; Y98-V159 HydrophobicContact CE2-CG2 4.35Å; Y98-V159 VanDerWaalsContact OH-CA 3.3Å; Y98-V159 WeakPolarHBondContact OH-CA 3.18Å; Y98-V159 VanDerWaalsContact OH-CB 3.25Å; Y98-V159 WeakPolarHBondContact OH-CB 3.26Å; Y98-V159 PolarHBondContact OH-N 3.37Å; E157-V159 HydrophobicContact CB-CG1 4.37Å; E157-V159 PolarHBondContact O-N 2.8Å; E157-V159 VanDerWaalsContact O-N 3.14Å; V159-Y162 WeakPolarHBondContact O-CB 3.41Å; V159-Y162 PolarHBondContact O-N 3.02Å; V159-I163 WeakPolarHBondContact O-CG2 3.32Å; V159-I163 PolarHBondContact O-N 3.32Å
160	Y	94.7	Very high	93.8	Very high	23 Å²	23	52.1 Å²	52.1	9%	0.09	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-41.1	178.4	-63.7	-63.6	0	0	0	111.5	F78 S79 R86 L156 E157 Y162 I163 Y164	F78-Y160 HydrophobicContact CD1-CD1 4.45Å; F78-Y160 AromaticContact CD1-CE1 3.81Å; F78-Y160 HydrophobicContact CD1-CE1 3.81Å; F78-Y160 HydrophobicContact CE1-CD1 4.35Å; F78-Y160 HydrophobicContact CE1-CE1 4Å; S79-Y160 VanDerWaalsContact CA-OH 3.22Å; S79-Y160 WeakPolarHBondContact CA-OH 3.47Å; R86-Y160 PolarHBondContact NH1-OH 3.22Å; R86-Y160 PolarHBondContact NH2-OH 3.44Å; R86-Y160 VanDerWaalsContact NH2-OH 3.11Å; L156-Y160 VanDerWaalsContact CD1-CB 3.47Å; L156-Y160 HydrophobicContact CD1-CD2 4.38Å; L156-Y160 HydrophobicContact CD1-CG 4.24Å; E157-Y160 HydrophobicContact CB-CD2 3.69Å; E157-Y160 HydrophobicContact CB-CE2 4.11Å; E157-Y160 HydrophobicContact CG-CD2 4.09Å; E157-Y160 HydrophobicContact CG-CE2 4.1Å; E157-Y160 PolarHBondContact O-N 3.21Å; E157-Y160 VanDerWaalsContact O-N 3.14Å; Y160-Y162 PolarHBondContact O-N 3.2Å; Y160-I163 HydrophobicContact CD1-CD1 4.08Å; Y160-I163 PolarHBondContact O-N 3.47Å; Y160-Y164 HydrophobicContact CD1-CE2 4.36Å; Y160-Y164 HydrophobicContact CG-CE2 4.42Å; Y160-Y164 WeakPolarHBondContact O-CB 3.23Å; Y160-Y164 WeakPolarHBondContact O-CD2 3.4Å; Y160-Y164 PolarHBondContact O-N 2.86Å
161	F	95.9	Very high	94	Very high	23 Å²	23	48.7 Å²	48.7	10%	0.101	26%	0.257	C	S	.	.	H	α-helix	trans	-57.2	-43.3	175	-179	-112.9	0	0	0	111.6	L143 L146 Y147 L152 L156 E157 P158 T165	L143-F161 HydrophobicContact CB-CE1 4.16Å; L143-F161 HydrophobicContact CD2-CE1 4.05Å; L143-F161 HydrophobicContact CD2-CZ 4.23Å; L146-F161 HydrophobicContact CD2-CZ 3.97Å; L146-F161 HydrophobicContact CG-CZ 4.23Å; Y147-F161 HydrophobicContact CD2-CB 3.86Å; Y147-F161 AromaticContact CD2-CD1 3.58Å; Y147-F161 HydrophobicContact CD2-CD1 3.58Å; Y147-F161 HydrophobicContact CD2-CD2 4.42Å; Y147-F161 HydrophobicContact CD2-CE1 4.21Å; Y147-F161 AromaticContact CD2-CG 3.68Å; Y147-F161 HydrophobicContact CD2-CG 3.68Å; Y147-F161 HydrophobicContact CE2-CB 4Å; Y147-F161 HydrophobicContact CE2-CG 4.29Å; Y147-F161 HydrophobicContact CG-CD1 4.09Å; L152-F161 HydrophobicContact CD1-CD2 3.88Å; L152-F161 HydrophobicContact CD1-CE2 3.45Å; L152-F161 VanDerWaalsContact CD1-CE2 3.45Å; L152-F161 HydrophobicContact CD1-CZ 3.82Å; L156-F161 HydrophobicContact CD2-CB 3.79Å; L156-F161 HydrophobicContact CD2-CD2 4.2Å; L156-F161 HydrophobicContact CG-CB 4.36Å; E157-F161 PolarHBondContact O-N 3.07Å; E157-F161 VanDerWaalsContact O-N 3.15Å; P158-F161 PolarHBondContact O-N 3.4Å; F161-T165 WeakPolarHBondContact O-CB 3.1Å; F161-T165 PolarHBondContact O-N 3.05Å; F161-T165 PolarHBondContact O-OG1 3.42Å
162	Y	96.1	Very high	94.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-53.8	178.6	-178.1	-87.6	0	0	0	112.1	F90 Y98 Y101 E140 L143 P158 V159 Y160 T165 V166 S213 W218	F90-Y162 HydrophobicContact CE1-CE1 4.36Å; Y98-Y162 AromaticContact CD2-CD1 3.85Å; Y98-Y162 HydrophobicContact CD2-CD1 3.85Å; Y98-Y162 HydrophobicContact CD2-CD2 4.21Å; Y98-Y162 HydrophobicContact CD2-CE1 4.14Å; Y98-Y162 HydrophobicContact CD2-CE2 4.49Å; Y98-Y162 AromaticContact CD2-CG 3.88Å; Y98-Y162 HydrophobicContact CD2-CG 3.88Å; Y98-Y162 HydrophobicContact CE2-CD1 4.25Å; Y98-Y162 HydrophobicContact CE2-CG 4.03Å; Y101-Y162 HydrophobicContact CD1-CD2 4.15Å; Y101-Y162 HydrophobicContact CD2-CD2 4.21Å; Y101-Y162 HydrophobicContact CE1-CD2 4.43Å; Y101-Y162 HydrophobicContact CG-CD2 4.02Å; E140-Y162 HydrophobicContact CG-CE2 4.07Å; E140-Y162 PolarHBondContact OE1-OH 2.91Å; L143-Y162 HydrophobicContact CD1-CD2 4.24Å; P158-Y162 WeakPolarHBondContact O-CB 3.18Å; P158-Y162 PolarHBondContact O-N 3.26Å; P158-Y162 VanDerWaalsContact O-N 3.1Å; V159-Y162 WeakPolarHBondContact O-CB 3.41Å; V159-Y162 PolarHBondContact O-N 3.02Å; Y160-Y162 PolarHBondContact O-N 3.2Å; Y162-T165 PolarHBondContact O-N 3.37Å; Y162-V166 PolarHBondContact O-N 3.01Å; Y162-S213 WeakPolarHBondContact CE1-OG 3.19Å; Y162-S213 WeakPolarHBondContact OH-CB 3.33Å; Y162-S213 PolarHBondContact OH-OG 3.34Å; Y162-W218 AromaticContact CE2-CZ2 3.95Å; Y162-W218 HydrophobicContact CE2-CZ2 3.95Å; Y162-W218 AromaticContact CZ-CZ2 3.91Å
163	I	95.3	Very high	94.6	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-68.9	-39.9	-176.6	70.2	-176.8	0	0	0	112.5	F78 F90 V159 Y160 T165 V166 F167 I212	F78-I163 HydrophobicContact CD1-CD1 4.06Å; F78-I163 HydrophobicContact CE1-CD1 3.71Å; F78-I163 HydrophobicContact CZ-CD1 4.35Å; F90-I163 HydrophobicContact CE1-CG2 4.28Å; F90-I163 HydrophobicContact CZ-CG2 3.76Å; V159-I163 WeakPolarHBondContact O-CG2 3.32Å; V159-I163 PolarHBondContact O-N 3.32Å; Y160-I163 HydrophobicContact CD1-CD1 4.08Å; Y160-I163 PolarHBondContact O-N 3.47Å; I163-T165 VanDerWaalsContact C-N 3.26Å; I163-T165 PolarHBondContact O-N 2.94Å; I163-V166 PolarHBondContact O-N 3.36Å; I163-V166 VanDerWaalsContact O-N 3.09Å; I163-F167 HydrophobicContact CB-CE2 4.26Å; I163-F167 HydrophobicContact CB-CZ 4.47Å; I163-F167 HydrophobicContact CD1-CE2 4.41Å; I163-F167 HydrophobicContact CG1-CE2 4.22Å; I163-F167 WeakPolarHBondContact O-CG 3.49Å; I163-F167 PolarHBondContact O-N 3.32Å; I163-I212 HydrophobicContact CB-CD1 4.13Å; I163-I212 HydrophobicContact CB-CG2 4.23Å; I163-I212 HydrophobicContact CG2-CD1 3.73Å; I163-I212 HydrophobicContact CG2-CG2 4.2Å
164	Y	95.4	Very high	95.1	Very high	100 Å²	100	38.7 Å²	38.7	39%	0.392	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-29	179.3	-66.6	-20.7	0	0	0	112.2	L156 Y160 F167 S168	L156-Y164 HydrophobicContact CD1-CD2 4.33Å; L156-Y164 HydrophobicContact CD1-CE2 4.12Å; L156-Y164 HydrophobicContact CD2-CD2 4.28Å; Y160-Y164 HydrophobicContact CD1-CE2 4.36Å; Y160-Y164 HydrophobicContact CG-CE2 4.42Å; Y160-Y164 WeakPolarHBondContact O-CB 3.23Å; Y160-Y164 WeakPolarHBondContact O-CD2 3.4Å; Y160-Y164 PolarHBondContact O-N 2.86Å; Y164-F167 AromaticContact CD1-CD2 3.94Å; Y164-F167 HydrophobicContact CD1-CD2 3.94Å; Y164-F167 HydrophobicContact CD1-CE2 4.32Å; Y164-F167 PolarHBondContact O-N 3.05Å; Y164-S168 VanDerWaalsContact O-CB 3.31Å; Y164-S168 WeakPolarHBondContact O-CB 3.4Å; Y164-S168 PolarHBondContact O-N 3.38Å; Y164-S168 PolarHBondContact O-OG 2.9Å
165	T	96.2	Very high	95.5	Very high	34 Å²	34	36.4 Å²	36.4	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-43.6	171	-60.3	0	0	0	0	111.2	L143 F161 Y162 I163 S168 L169 W218	L143-T165 HydrophobicContact CD1-CG2 3.92Å; L143-T165 HydrophobicContact CD2-CG2 3.94Å; F161-T165 WeakPolarHBondContact O-CB 3.1Å; F161-T165 PolarHBondContact O-N 3.05Å; F161-T165 PolarHBondContact O-OG1 3.42Å; Y162-T165 PolarHBondContact O-N 3.37Å; I163-T165 VanDerWaalsContact C-N 3.26Å; I163-T165 PolarHBondContact O-N 2.94Å; T165-S168 WeakPolarHBondContact O-CB 3.43Å; T165-S168 PolarHBondContact O-N 3.4Å; T165-L169 PolarHBondContact O-N 2.72Å; T165-W218 HydrophobicContact CG2-CH2 4.22Å; T165-W218 HydrophobicContact CG2-CZ3 4.09Å
166	V	96.3	Very high	95.9	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.5	-40.1	177.8	-177.4	0	0	0	0	111.8	Y162 I163 S168 L169 Q170 V208 I212 N217 W218	Y162-V166 PolarHBondContact O-N 3.01Å; I163-V166 PolarHBondContact O-N 3.36Å; I163-V166 VanDerWaalsContact O-N 3.09Å; V166-S168 VanDerWaalsContact C-N 3.34Å; V166-L169 WeakPolarHBondContact O-CB 3.42Å; V166-L169 PolarHBondContact O-N 2.63Å; V166-Q170 PolarHBondContact O-N 2.89Å; V166-Q170 PolarHBondContact O-NE2 2.84Å; V166-V208 HydrophobicContact CG1-CG2 3.72Å; V166-I212 HydrophobicContact CB-CG2 3.68Å; V166-I212 HydrophobicContact CG1-CG2 3.82Å; V166-I212 WeakPolarHBondContact CG1-O 3.41Å; V166-I212 HydrophobicContact CG2-CG2 3.86Å; V166-N217 HydrophobicContact CG1-CB 4.01Å; V166-W218 HydrophobicContact CG2-CD2 4.32Å; V166-W218 HydrophobicContact CG2-CH2 3.5Å; V166-W218 VanDerWaalsContact CG2-CH2 3.5Å; V166-W218 HydrophobicContact CG2-CZ2 3.15Å; V166-W218 HydrophobicContact CG2-CZ3 4.3Å
167	F	96.4	Very high	96.1	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-40.6	174.6	-60.4	-28.4	0	0	0	111.6	S65 V68 A69 H72 I163 Y164 L169 Q170 A171 V208 I212	S65-F167 WeakPolarHBondContact CB-O 3.42Å; S65-F167 PolarHBondContact OG-O 3.31Å; S65-F167 VanDerWaalsContact OG-O 3.12Å; V68-F167 HydrophobicContact CB-CD1 4.48Å; V68-F167 HydrophobicContact CG1-CD1 3.5Å; V68-F167 HydrophobicContact CG1-CE1 3.58Å; V68-F167 HydrophobicContact CG1-CG 4.25Å; V68-F167 HydrophobicContact CG1-CZ 4.38Å; A69-F167 HydrophobicContact CB-CD2 3.54Å; A69-F167 HydrophobicContact CB-CE2 3.95Å; A69-F167 HydrophobicContact CB-CG 4.31Å; H72-F167 HydrophobicContact CB-CE2 4.2Å; H72-F167 HydrophobicContact CB-CZ 3.71Å; H72-F167 AromaticContact CG-CZ 3.72Å; I163-F167 HydrophobicContact CB-CE2 4.26Å; I163-F167 HydrophobicContact CB-CZ 4.47Å; I163-F167 HydrophobicContact CD1-CE2 4.41Å; I163-F167 HydrophobicContact CG1-CE2 4.22Å; I163-F167 WeakPolarHBondContact O-CG 3.49Å; I163-F167 PolarHBondContact O-N 3.32Å; Y164-F167 AromaticContact CD1-CD2 3.94Å; Y164-F167 HydrophobicContact CD1-CD2 3.94Å; Y164-F167 HydrophobicContact CD1-CE2 4.32Å; Y164-F167 PolarHBondContact O-N 3.05Å; F167-L169 VanDerWaalsContact C-N 3.27Å; F167-L169 PolarHBondContact O-N 2.69Å; F167-Q170 WeakPolarHBondContact O-CA 3.4Å; F167-Q170 VanDerWaalsContact O-CB 3.27Å; F167-Q170 WeakPolarHBondContact O-CB 3.3Å; F167-Q170 PolarHBondContact O-N 3.43Å; F167-A171 PolarHBondContact O-N 2.92Å; F167-V208 HydrophobicContact CD1-CG2 3.94Å; F167-V208 HydrophobicContact CE1-CG2 4.05Å; F167-I212 HydrophobicContact CE1-CD1 4.45Å; F167-I212 HydrophobicContact CE1-CG1 4Å; F167-I212 HydrophobicContact CE1-CG2 4.45Å; F167-I212 HydrophobicContact CZ-CD1 4.07Å; F167-I212 HydrophobicContact CZ-CG1 4.11Å
168	S	96.1	Very high	96.3	Very high	64 Å²	64	20.8 Å²	20.8	45%	0.448	11%	0.112	S	C	.	.	H	α-helix	trans	-61.7	-34.7	174.9	-59.6	0	0	0	0	112.2	S65 Y164 T165 V166 Q170 A171 V172	S65-S168 PolarHBondContact OG-N 3.22Å; Y164-S168 VanDerWaalsContact O-CB 3.31Å; Y164-S168 WeakPolarHBondContact O-CB 3.4Å; Y164-S168 PolarHBondContact O-N 3.38Å; Y164-S168 PolarHBondContact O-OG 2.9Å; T165-S168 WeakPolarHBondContact O-CB 3.43Å; T165-S168 PolarHBondContact O-N 3.4Å; V166-S168 VanDerWaalsContact C-N 3.34Å; S168-Q170 PolarHBondContact O-N 3.33Å; S168-A171 VanDerWaalsContact O-CB 3.24Å; S168-A171 WeakPolarHBondContact O-CB 3.44Å; S168-A171 PolarHBondContact O-N 3.48Å; S168-A171 VanDerWaalsContact O-N 3.1Å; S168-V172 PolarHBondContact O-N 2.94Å
169	L	96.2	Very high	96.5	Very high	23 Å²	23	19.8 Å²	19.8	12%	0.12	10%	0.104	C	C	.	.	H	α-helix	trans	-64.2	-27.1	173	-76.7	174.9	0	0	0	113	T165 V166 F167 A171 V172 Y173 W218 P221 F222	T165-L169 PolarHBondContact O-N 2.72Å; V166-L169 WeakPolarHBondContact O-CB 3.42Å; V166-L169 PolarHBondContact O-N 2.63Å; F167-L169 VanDerWaalsContact C-N 3.27Å; F167-L169 PolarHBondContact O-N 2.69Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.08Å; L169-V172 WeakPolarHBondContact O-CB 3.36Å; L169-V172 PolarHBondContact O-N 3.46Å; L169-Y173 PolarHBondContact O-N 2.99Å; L169-W218 HydrophobicContact CD1-CD2 4.15Å; L169-W218 HydrophobicContact CD1-CE3 3.31Å; L169-W218 HydrophobicContact CD1-CZ3 3.63Å; L169-P221 HydrophobicContact CB-CG 4.05Å; L169-P221 WeakPolarHBondContact O-CB 3.49Å; L169-P221 WeakPolarHBondContact O-CG 3.35Å; L169-F222 HydrophobicContact CD2-CZ 4.14Å
170	Q	95.4	Very high	96.6	Very high	3 Å²	3	19.4 Å²	19.4	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-68.6	-31.7	172.9	-51.9	-52.1	-52.5	0	0	111.9	V166 F167 S168 V172 Y173 V174 V208 N217	V166-Q170 PolarHBondContact O-N 2.89Å; V166-Q170 PolarHBondContact O-NE2 2.84Å; F167-Q170 WeakPolarHBondContact O-CA 3.4Å; F167-Q170 VanDerWaalsContact O-CB 3.27Å; F167-Q170 WeakPolarHBondContact O-CB 3.3Å; F167-Q170 PolarHBondContact O-N 3.43Å; S168-Q170 PolarHBondContact O-N 3.33Å; Q170-V172 VanDerWaalsContact C-N 3.31Å; Q170-V172 PolarHBondContact O-N 2.95Å; Q170-Y173 WeakPolarHBondContact O-CB 3.47Å; Q170-Y173 PolarHBondContact O-N 3.46Å; Q170-V174 PolarHBondContact O-N 2.84Å; Q170-V208 HydrophobicContact CG-CB 4.38Å; Q170-V208 HydrophobicContact CG-CG1 4.06Å; Q170-V208 HydrophobicContact CG-CG2 4.05Å; Q170-N217 PolarHBondContact NE2-O 3.49Å; Q170-N217 VanDerWaalsContact NE2-O 3.15Å
171	A	96.7	Very high	96.7	Very high	9 Å²	9	18.3 Å²	18.3	7%	0.074	10%	0.098	C	C	.	.	H	α-helix	trans	-59.6	-45.4	170.8	0	0	0	0	0	110.8	G61 F167 S168 L169 Y173 V174 I175	G61-A171 WeakPolarHBondContact O-CA 3.34Å; G61-A171 WeakPolarHBondContact O-CB 3.44Å; F167-A171 PolarHBondContact O-N 2.92Å; S168-A171 VanDerWaalsContact O-CB 3.24Å; S168-A171 WeakPolarHBondContact O-CB 3.44Å; S168-A171 PolarHBondContact O-N 3.48Å; S168-A171 VanDerWaalsContact O-N 3.1Å; L169-A171 VanDerWaalsContact C-N 3.3Å; L169-A171 PolarHBondContact O-N 3.08Å; A171-Y173 VanDerWaalsContact C-N 3.28Å; A171-Y173 PolarHBondContact O-N 3.37Å; A171-V174 PolarHBondContact O-N 3.39Å; A171-I175 WeakPolarHBondContact O-CB 3.03Å; A171-I175 WeakPolarHBondContact O-CD1 3.48Å; A171-I175 WeakPolarHBondContact O-CG1 3.42Å; A171-I175 PolarHBondContact O-N 3.38Å
172	V	97.1	Very high	96.6	Very high	47 Å²	47	18.2 Å²	18.2	29%	0.285	10%	0.097	S	C	.	.	H	α-helix	trans	-60	-40.6	176.4	179.4	0	0	0	0	111	S168 L169 Q170 I175 A176 P221 L225	S168-V172 PolarHBondContact O-N 2.94Å; L169-V172 WeakPolarHBondContact O-CB 3.36Å; L169-V172 PolarHBondContact O-N 3.46Å; Q170-V172 VanDerWaalsContact C-N 3.31Å; Q170-V172 PolarHBondContact O-N 2.95Å; V172-I175 PolarHBondContact O-N 2.98Å; V172-A176 WeakPolarHBondContact O-CB 3.34Å; V172-A176 PolarHBondContact O-N 3.26Å; V172-P221 HydrophobicContact CB-CB 4.42Å; V172-P221 HydrophobicContact CG1-CB 4.39Å; V172-L225 HydrophobicContact CG1-CD1 3.54Å; V172-L225 HydrophobicContact CG1-CD2 4.35Å; V172-L225 HydrophobicContact CG1-CG 4.02Å
173	Y	96.9	Very high	96.5	Very high	10 Å²	10	20.1 Å²	20.1	4%	0.039	11%	0.107	C	C	.	.	H	α-helix	trans	-62.7	-48.9	177.8	-172.3	-161.6	0	0	0	112.2	L169 Q170 A171 I175 A176 L177 Y198 L220 A224	L169-Y173 PolarHBondContact O-N 2.99Å; Q170-Y173 WeakPolarHBondContact O-CB 3.47Å; Q170-Y173 PolarHBondContact O-N 3.46Å; A171-Y173 VanDerWaalsContact C-N 3.28Å; A171-Y173 PolarHBondContact O-N 3.37Å; Y173-I175 VanDerWaalsContact C-N 3.34Å; Y173-I175 PolarHBondContact O-N 3.21Å; Y173-A176 WeakPolarHBondContact O-CB 3.39Å; Y173-A176 PolarHBondContact O-N 3.48Å; Y173-L177 HydrophobicContact CD2-CD1 4.11Å; Y173-L177 HydrophobicContact CD2-CG 4.04Å; Y173-L177 HydrophobicContact CE2-CD1 3.72Å; Y173-L177 HydrophobicContact CE2-CD2 4Å; Y173-L177 HydrophobicContact CE2-CG 3.78Å; Y173-L177 PolarHBondContact O-N 2.99Å; Y173-Y198 AromaticContact CD1-CE2 4Å; Y173-Y198 HydrophobicContact CD1-CE2 4Å; Y173-Y198 AromaticContact CD1-CZ 3.88Å; Y173-Y198 WeakPolarHBondContact CD1-OH 3.49Å; Y173-Y198 AromaticContact CE1-CE2 3.71Å; Y173-Y198 HydrophobicContact CE1-CE2 3.71Å; Y173-Y198 AromaticContact CE1-CZ 3.97Å; Y173-Y198 WeakPolarHBondContact CE1-OH 3.45Å; Y173-L220 HydrophobicContact CE1-CB 4.38Å; Y173-A224 HydrophobicContact CD2-CB 3.36Å; Y173-A224 HydrophobicContact CE2-CB 3.48Å; Y173-A224 VanDerWaalsContact CE2-CB 3.48Å
174	V	97.6	Very high	96.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-62.8	-41.1	177.9	174	0	0	0	0	111.4	C64 Q170 A171 A176 L177 Y178 Y198	C64-V174 HydrophobicContact CB-CG2 3.92Å; Q170-V174 PolarHBondContact O-N 2.84Å; A171-V174 PolarHBondContact O-N 3.39Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 3.14Å; V174-L177 PolarHBondContact O-N 2.94Å; V174-Y178 VanDerWaalsContact O-CB 3.26Å; V174-Y178 WeakPolarHBondContact O-CB 3.41Å; V174-Y178 PolarHBondContact O-N 3Å; V174-Y198 HydrophobicContact CG2-CD1 3.42Å; V174-Y198 VanDerWaalsContact CG2-CD1 3.42Å; V174-Y198 HydrophobicContact CG2-CE1 3.53Å; V174-Y198 HydrophobicContact CG2-CG 4.04Å
175	I	98	Very high	96.2	Very high	33 Å²	33	15.7 Å²	15.7	17%	0.169	9%	0.091	C	C	.	.	H	α-helix	trans	-59.5	-44.6	174.8	-70.9	164.3	0	0	0	110.4	S57 A171 V172 Y173 L177 Y178 L179	S57-I175 WeakPolarHBondContact O-CG1 2.99Å; A171-I175 WeakPolarHBondContact O-CB 3.03Å; A171-I175 WeakPolarHBondContact O-CD1 3.48Å; A171-I175 WeakPolarHBondContact O-CG1 3.42Å; A171-I175 PolarHBondContact O-N 3.38Å; V172-I175 PolarHBondContact O-N 2.98Å; Y173-I175 VanDerWaalsContact C-N 3.34Å; Y173-I175 PolarHBondContact O-N 3.21Å; I175-L177 PolarHBondContact O-N 3.07Å; I175-Y178 WeakPolarHBondContact O-CB 3.32Å; I175-Y178 PolarHBondContact O-N 2.6Å; I175-L179 HydrophobicContact CG2-CD1 3.88Å; I175-L179 HydrophobicContact CG2-CG 4.29Å; I175-L179 WeakPolarHBondContact O-CB 3.23Å; I175-L179 VanDerWaalsContact O-CG 3.22Å; I175-L179 WeakPolarHBondContact O-CG 3.3Å; I175-L179 PolarHBondContact O-N 3.01Å
176	A	97.8	Very high	95.7	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-63	-43.9	178.4	0	0	0	0	0	112.6	V172 Y173 V174 L179 T180 A224 L225 T228	V172-A176 WeakPolarHBondContact O-CB 3.34Å; V172-A176 PolarHBondContact O-N 3.26Å; Y173-A176 WeakPolarHBondContact O-CB 3.39Å; Y173-A176 PolarHBondContact O-N 3.48Å; V174-A176 VanDerWaalsContact C-N 3.33Å; V174-A176 PolarHBondContact O-N 3.14Å; A176-L179 PolarHBondContact O-N 3.41Å; A176-T180 WeakPolarHBondContact O-CB 3.44Å; A176-T180 PolarHBondContact O-N 2.89Å; A176-T180 PolarHBondContact O-OG1 3.49Å; A176-A224 HydrophobicContact CB-CB 3.62Å; A176-L225 HydrophobicContact CB-CD2 3.8Å; A176-L225 HydrophobicContact CB-CG 4.01Å; A176-T228 PolarHBondContact O-OG1 3.47Å
177	L	97.6	Very high	95.4	Very high	7 Å²	7	15 Å²	15	4%	0.037	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-42.4	175.3	-67.6	177.1	0	0	0	111.8	Y173 V174 I175 L179 T180 A181 T194 Y198	Y173-L177 HydrophobicContact CD2-CD1 4.11Å; Y173-L177 HydrophobicContact CD2-CG 4.04Å; Y173-L177 HydrophobicContact CE2-CD1 3.72Å; Y173-L177 HydrophobicContact CE2-CD2 4Å; Y173-L177 HydrophobicContact CE2-CG 3.78Å; Y173-L177 PolarHBondContact O-N 2.99Å; V174-L177 PolarHBondContact O-N 2.94Å; I175-L177 PolarHBondContact O-N 3.07Å; L177-L179 PolarHBondContact O-N 3.1Å; L177-T180 PolarHBondContact O-N 3.44Å; L177-A181 PolarHBondContact O-N 3.41Å; L177-T194 HydrophobicContact CB-CG2 3.95Å; L177-Y198 HydrophobicContact CD1-CD2 3.59Å; L177-Y198 HydrophobicContact CD1-CE2 3.87Å
178	Y	98.1	Very high	95.3	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-56.5	-50.1	174.5	-179.8	-73.9	0	0	0	111.2	G53 V56 S57 L60 V174 I175 A181 W182 W188 G191 L192	G53-Y178 PolarHBondContact O-OH 2.71Å; V56-Y178 HydrophobicContact CG1-CE2 3.92Å; S57-Y178 WeakPolarHBondContact OG-CD1 3.41Å; L60-Y178 HydrophobicContact CD1-CD2 3.82Å; L60-Y178 HydrophobicContact CD1-CE2 3.74Å; V174-Y178 VanDerWaalsContact O-CB 3.26Å; V174-Y178 WeakPolarHBondContact O-CB 3.41Å; V174-Y178 PolarHBondContact O-N 3Å; I175-Y178 WeakPolarHBondContact O-CB 3.32Å; I175-Y178 PolarHBondContact O-N 2.6Å; Y178-A181 PolarHBondContact O-N 3.44Å; Y178-W182 HydrophobicContact CD1-CE3 4.24Å; Y178-W182 HydrophobicContact CE1-CD2 4.38Å; Y178-W182 AromaticContact CE1-CE3 3.58Å; Y178-W182 HydrophobicContact CE1-CE3 3.58Å; Y178-W182 HydrophobicContact CE1-CZ3 4.13Å; Y178-W182 WeakPolarHBondContact O-CB 3.45Å; Y178-W182 PolarHBondContact O-N 3.4Å; Y178-W188 WeakPolarHBondContact OH-CB 3.23Å; Y178-W188 PolarHBondContact OH-O 3.23Å; Y178-G191 WeakPolarHBondContact CD2-O 3.46Å; Y178-L192 HydrophobicContact CE2-CB 4.34Å
179	L	97.1	Very high	95.2	Very high	24 Å²	24	14.4 Å²	14.4	13%	0.126	8%	0.079	C	C	.	.	H	α-helix	trans	-64.8	-40.3	179.9	-69.8	174.7	0	0	0	111.1	W54 I175 A176 L177 W182 L183 T228	W54-L179 HydrophobicContact CE3-CD2 4.35Å; W54-L179 HydrophobicContact CH2-CD1 3.81Å; W54-L179 HydrophobicContact CH2-CD2 3.69Å; W54-L179 HydrophobicContact CH2-CG 4.41Å; W54-L179 HydrophobicContact CZ2-CD2 4.16Å; W54-L179 HydrophobicContact CZ3-CD1 3.89Å; W54-L179 HydrophobicContact CZ3-CD2 3.8Å; W54-L179 HydrophobicContact CZ3-CG 4.4Å; I175-L179 HydrophobicContact CG2-CD1 3.88Å; I175-L179 HydrophobicContact CG2-CG 4.29Å; I175-L179 WeakPolarHBondContact O-CB 3.23Å; I175-L179 VanDerWaalsContact O-CG 3.22Å; I175-L179 WeakPolarHBondContact O-CG 3.3Å; I175-L179 PolarHBondContact O-N 3.01Å; A176-L179 PolarHBondContact O-N 3.41Å; L177-L179 PolarHBondContact O-N 3.1Å; L179-W182 HydrophobicContact CD2-CE3 4.16Å; L179-W182 PolarHBondContact O-N 2.92Å; L179-L183 VanDerWaalsContact O-CB 3.3Å; L179-L183 WeakPolarHBondContact O-CB 3.33Å; L179-L183 WeakPolarHBondContact O-CG 3.44Å; L179-L183 PolarHBondContact O-N 2.72Å; L179-T228 HydrophobicContact CB-CG2 3.75Å
180	T	96.7	Very high	95.1	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.012	7%	0.073	C	C	.	.	H	α-helix	trans	-59	-48.6	174.5	-61	0	0	0	0	111.1	A176 L177 W182 L183 L184 T228	A176-T180 WeakPolarHBondContact O-CB 3.44Å; A176-T180 PolarHBondContact O-N 2.89Å; A176-T180 PolarHBondContact O-OG1 3.49Å; L177-T180 PolarHBondContact O-N 3.44Å; T180-W182 PolarHBondContact O-N 3.42Å; T180-L183 PolarHBondContact O-N 3.1Å; T180-L184 HydrophobicContact CG2-CD1 4.12Å; T180-L184 VanDerWaalsContact O-CG 3.3Å; T180-L184 WeakPolarHBondContact O-CG 3.42Å; T180-L184 PolarHBondContact O-N 2.83Å; T180-T228 PolarHBondContact OG1-OG1 3.03Å
181	A	96.8	Very high	95.2	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.8	-40.7	178.3	0	0	0	0	0	112.7	L177 Y178 L184 A185 A190 T194 A498 A501	L177-A181 PolarHBondContact O-N 3.41Å; Y178-A181 PolarHBondContact O-N 3.44Å; A181-L184 PolarHBondContact O-N 3.49Å; A181-A185 WeakPolarHBondContact O-CB 3.27Å; A181-A185 PolarHBondContact O-N 3.25Å; A181-A190 HydrophobicContact CB-CB 4.35Å; A181-T194 HydrophobicContact CB-CG2 4.45Å; A181-T194 WeakPolarHBondContact CB-OG1 3.35Å; A181-A498 HydrophobicContact CB-CB 4.14Å; A181-A501 HydrophobicContact CB-CB 4.41Å
182	W	95.3	Very high	95.2	Very high	20 Å²	20	14.4 Å²	14.4	8%	0.076	8%	0.078	C	C	.	.	H	α-helix	trans	-63	-45.4	175.1	-174.9	3.4	0	0	0	110.9	Y178 L179 T180 L184 A185 G186 W188	Y178-W182 HydrophobicContact CD1-CE3 4.24Å; Y178-W182 HydrophobicContact CE1-CD2 4.38Å; Y178-W182 AromaticContact CE1-CE3 3.58Å; Y178-W182 HydrophobicContact CE1-CE3 3.58Å; Y178-W182 HydrophobicContact CE1-CZ3 4.13Å; Y178-W182 WeakPolarHBondContact O-CB 3.45Å; Y178-W182 PolarHBondContact O-N 3.4Å; L179-W182 HydrophobicContact CD2-CE3 4.16Å; L179-W182 PolarHBondContact O-N 2.92Å; T180-W182 PolarHBondContact O-N 3.42Å; W182-L184 VanDerWaalsContact C-N 3.3Å; W182-L184 PolarHBondContact O-N 2.88Å; W182-A185 PolarHBondContact O-N 3.32Å; W182-G186 WeakPolarHBondContact O-CA 3.37Å; W182-G186 PolarHBondContact O-N 2.93Å; W182-W188 HydrophobicContact CD2-CB 3.9Å; W182-W188 HydrophobicContact CE3-CB 4.22Å; W182-W188 HydrophobicContact CG-CB 4.38Å; W182-W188 HydrophobicContact CH2-CB 4.28Å; W182-W188 HydrophobicContact CZ2-CB 3.99Å; W182-W188 HydrophobicContact CZ3-CB 4.38Å
183	L	93.2	Very high	95.2	Very high	40 Å²	40	12.2 Å²	12.2	21%	0.209	6%	0.064	C	C	.	.	H	α-helix	trans	-60.3	-38.5	175.2	-73.6	171.7	0	0	0	111.5	L179 T180 T228 T231 C232 R235	L179-L183 VanDerWaalsContact O-CB 3.3Å; L179-L183 WeakPolarHBondContact O-CB 3.33Å; L179-L183 WeakPolarHBondContact O-CG 3.44Å; L179-L183 PolarHBondContact O-N 2.72Å; T180-L183 PolarHBondContact O-N 3.1Å; L183-T228 HydrophobicContact CD1-CG2 3.81Å; L183-T231 HydrophobicContact CB-CG2 4.4Å; L183-C232 HydrophobicContact CD1-CB 4.18Å; L183-R235 PolarHBondContact O-NH2 2.86Å
184	L	92.1	Very high	95.2	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.021	6%	0.062	C	C	.	.	H	α-helix	trans	-71.9	-48.9	179.3	-68.7	171.5	0	0	0	112.1	T180 A181 W182 T231 R465 V468 N471 Y502	T180-L184 HydrophobicContact CG2-CD1 4.12Å; T180-L184 VanDerWaalsContact O-CG 3.3Å; T180-L184 WeakPolarHBondContact O-CG 3.42Å; T180-L184 PolarHBondContact O-N 2.83Å; A181-L184 PolarHBondContact O-N 3.49Å; W182-L184 VanDerWaalsContact C-N 3.3Å; W182-L184 PolarHBondContact O-N 2.88Å; L184-T231 HydrophobicContact CD2-CG2 3.92Å; L184-T231 HydrophobicContact CG-CG2 4.28Å; L184-R465 PolarHBondContact O-NH1 3.25Å; L184-R465 PolarHBondContact O-NH2 3.18Å; L184-V468 HydrophobicContact CD2-CG2 4.1Å; L184-N471 HydrophobicContact CD1-CB 3.99Å; L184-N471 HydrophobicContact CD2-CB 4.47Å; L184-Y502 VanDerWaalsContact C-CD2 3.46Å; L184-Y502 HydrophobicContact CB-CD2 3.55Å; L184-Y502 HydrophobicContact CB-CE2 4.19Å; L184-Y502 HydrophobicContact CB-CG 3.94Å; L184-Y502 VanDerWaalsContact O-CE2 3.29Å; L184-Y502 WeakPolarHBondContact O-CE2 3.32Å
185	A	91.6	Very high	95.2	Very high	6 Å²	6	11.7 Å²	11.7	5%	0.05	6%	0.062	C	C	.	.	H	α-helix	trans	-86.8	-19.7	-171.3	0	0	0	0	0	114.8	A181 W182 S187 A190 Y502 C505 R529	A181-A185 WeakPolarHBondContact O-CB 3.27Å; A181-A185 PolarHBondContact O-N 3.25Å; W182-A185 PolarHBondContact O-N 3.32Å; A185-S187 VanDerWaalsContact C-N 3.27Å; A185-S187 PolarHBondContact O-N 2.74Å; A185-A190 HydrophobicContact CB-CB 3.51Å; A185-Y502 HydrophobicContact CB-CD2 4.15Å; A185-C505 HydrophobicContact CB-CB 3.91Å; A185-R529 PolarHBondContact O-NH2 3.32Å
186	G	87.6	Confident	95.1	Very high	17 Å²	17	11.5 Å²	11.5	18%	0.175	6%	0.063	C	C	.	.	S	Bend	trans	71.6	17.2	-173.9	0	0	0	0	0	114.4	W182	W182-G186 WeakPolarHBondContact O-CA 3.37Å; W182-G186 PolarHBondContact O-N 2.93Å
187	S	89.8	Confident	95.1	Very high	3 Å²	3	11.5 Å²	11.5	2%	0.021	6%	0.063	C	C	.	.			trans	-138.8	133.4	177.7	-179.4	0	0	0	0	110.8	A185 L189 A190	A185-S187 VanDerWaalsContact C-N 3.27Å; A185-S187 PolarHBondContact O-N 2.74Å; S187-L189 PolarHBondContact O-N 3.02Å; S187-L189 WeakPolarHBondContact OG-CB 3.48Å; S187-L189 PolarHBondContact OG-N 3.32Å; S187-A190 WeakPolarHBondContact O-CB 3.43Å; S187-A190 PolarHBondContact O-N 3.17Å; S187-A190 VanDerWaalsContact O-N 3.14Å
188	W	93.5	Very high	95	Very high	43 Å²	43	11.2 Å²	11.2	16%	0.163	6%	0.061	C	C	.	.	H	α-helix	trans	-66.8	-19.9	177.2	67.9	-109.6	0	0	0	111.9	W49 I52 V56 Y178 W182 A190 G191 L192	W49-W188 AromaticContact CD2-CD1 3.86Å; W49-W188 AromaticContact CD2-NE1 3.52Å; W49-W188 AromaticContact CE2-CD1 3.31Å; W49-W188 AromaticContact CE2-NE1 3.18Å; W49-W188 AromaticContact CE3-NE1 3.65Å; W49-W188 AromaticContact CH2-CE2 3.89Å; W49-W188 HydrophobicContact CH2-CZ2 4.15Å; W49-W188 AromaticContact CH2-NE1 3.2Å; W49-W188 AromaticContact CZ2-CD1 3.46Å; W49-W188 VanDerWaalsContact CZ2-CD1 3.46Å; W49-W188 AromaticContact CZ2-NE1 3.04Å; W49-W188 HydrophobicContact CZ3-CZ2 4.35Å; W49-W188 AromaticContact CZ3-NE1 3.49Å; W49-W188 AromaticContact NE1-CD1 3.48Å; W49-W188 AromaticContact NE1-NE1 3.87Å; I52-W188 HydrophobicContact CG2-CZ2 4.28Å; V56-W188 HydrophobicContact CG1-CE3 4.42Å; V56-W188 HydrophobicContact CG1-CZ3 4.5Å; V56-W188 HydrophobicContact CG2-CZ3 4.38Å; Y178-W188 WeakPolarHBondContact OH-CB 3.23Å; Y178-W188 PolarHBondContact OH-O 3.23Å; W182-W188 HydrophobicContact CD2-CB 3.9Å; W182-W188 HydrophobicContact CE3-CB 4.22Å; W182-W188 HydrophobicContact CG-CB 4.38Å; W182-W188 HydrophobicContact CH2-CB 4.28Å; W182-W188 HydrophobicContact CZ2-CB 3.99Å; W182-W188 HydrophobicContact CZ3-CB 4.38Å; W188-A190 PolarHBondContact O-N 3.2Å; W188-G191 WeakPolarHBondContact O-CA 3.2Å; W188-G191 PolarHBondContact O-N 3.38Å; W188-L192 HydrophobicContact CE3-CB 4.43Å; W188-L192 HydrophobicContact CZ3-CB 4.41Å; W188-L192 HydrophobicContact CZ3-CD2 3.94Å; W188-L192 PolarHBondContact O-N 2.95Å
189	L	93.6	Very high	94.9	Very high	10 Å²	10	12 Å²	12	5%	0.052	7%	0.065	C	C	.	.	H	α-helix	trans	-62.1	-31.6	173.1	-172.2	58.8	0	0	0	112.3	S187 G191 L192 L193 Y530 P533 V534 I537	S187-L189 PolarHBondContact O-N 3.02Å; S187-L189 WeakPolarHBondContact OG-CB 3.48Å; S187-L189 PolarHBondContact OG-N 3.32Å; L189-G191 VanDerWaalsContact C-N 3.34Å; L189-L192 HydrophobicContact CD1-CD2 4.11Å; L189-L192 PolarHBondContact O-N 3.01Å; L189-L193 WeakPolarHBondContact O-CB 3.3Å; L189-L193 PolarHBondContact O-N 2.94Å; L189-Y530 HydrophobicContact CD2-CD1 3.86Å; L189-P533 HydrophobicContact CD1-CB 4.39Å; L189-P533 HydrophobicContact CD2-CB 3.7Å; L189-P533 HydrophobicContact CD2-CG 3.9Å; L189-P533 HydrophobicContact CG-CB 3.76Å; L189-P533 HydrophobicContact CG-CG 4.29Å; L189-V534 HydrophobicContact CD1-CG2 4.42Å; L189-V534 HydrophobicContact CD2-CG2 4.18Å; L189-I537 HydrophobicContact CD1-CD1 3.85Å
190	A	95.5	Very high	94.8	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65.8	-40.5	172.6	0	0	0	0	0	111.2	A181 A185 S187 W188 T194 A501 C505	A181-A190 HydrophobicContact CB-CB 4.35Å; A185-A190 HydrophobicContact CB-CB 3.51Å; S187-A190 WeakPolarHBondContact O-CB 3.43Å; S187-A190 PolarHBondContact O-N 3.17Å; S187-A190 VanDerWaalsContact O-N 3.14Å; W188-A190 PolarHBondContact O-N 3.2Å; A190-T194 WeakPolarHBondContact O-CB 3.42Å; A190-T194 PolarHBondContact O-N 3.4Å; A190-T194 PolarHBondContact O-OG1 2.86Å; A190-A501 HydrophobicContact CB-CB 4.33Å; A190-A501 VanDerWaalsContact O-CB 3.26Å; A190-A501 WeakPolarHBondContact O-CB 3.46Å; A190-C505 VanDerWaalsContact CA-SG 3.59Å; A190-C505 HydrophobicContact CB-CB 3.61Å
191	G	96.4	Very high	94.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.7	-46.6	172.6	0	0	0	0	0	111.6	Y178 W188 L189 L193 T194 G195	Y178-G191 WeakPolarHBondContact CD2-O 3.46Å; W188-G191 WeakPolarHBondContact O-CA 3.2Å; W188-G191 PolarHBondContact O-N 3.38Å; L189-G191 VanDerWaalsContact C-N 3.34Å; G191-L193 PolarHBondContact O-N 2.88Å; G191-T194 WeakPolarHBondContact O-CB 3.11Å; G191-T194 PolarHBondContact O-N 3.41Å; G191-T194 VanDerWaalsContact O-N 3.17Å; G191-G195 PolarHBondContact O-N 3.34Å
192	L	97	Very high	94.4	Very high	35 Å²	35	13.3 Å²	13.3	18%	0.183	7%	0.071	C	C	.	.	H	α-helix	trans	-58.6	-48.6	178.6	171.6	60.2	0	0	0	110.9	V56 L60 Y178 W188 L189 T194 G195 V196 I537	V56-L192 HydrophobicContact CG1-CB 4.38Å; V56-L192 HydrophobicContact CG1-CD1 4.27Å; L60-L192 HydrophobicContact CD1-CB 4.38Å; L60-L192 HydrophobicContact CD1-CD1 3.57Å; L60-L192 HydrophobicContact CD2-CD1 3.95Å; L60-L192 HydrophobicContact CG-CD1 4.19Å; Y178-L192 HydrophobicContact CE2-CB 4.34Å; W188-L192 HydrophobicContact CE3-CB 4.43Å; W188-L192 HydrophobicContact CZ3-CB 4.41Å; W188-L192 HydrophobicContact CZ3-CD2 3.94Å; W188-L192 PolarHBondContact O-N 2.95Å; L189-L192 HydrophobicContact CD1-CD2 4.11Å; L189-L192 PolarHBondContact O-N 3.01Å; L192-T194 VanDerWaalsContact C-N 3.3Å; L192-T194 PolarHBondContact O-N 2.94Å; L192-G195 PolarHBondContact O-N 3.12Å; L192-V196 HydrophobicContact CD1-CG2 4.03Å; L192-V196 WeakPolarHBondContact O-CG2 3.37Å; L192-V196 PolarHBondContact O-N 3.49Å; L192-I537 HydrophobicContact CD2-CD1 3.9Å; L192-I537 HydrophobicContact CG-CD1 3.95Å
193	L	97.1	Very high	94.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-39.3	177.5	-174.6	63.2	0	0	0	111.9	L189 G191 V196 W197 A501 V504 P533 I537 L540	L189-L193 WeakPolarHBondContact O-CB 3.3Å; L189-L193 PolarHBondContact O-N 2.94Å; G191-L193 PolarHBondContact O-N 2.88Å; L193-V196 PolarHBondContact O-N 2.88Å; L193-W197 HydrophobicContact CD1-CD2 4.12Å; L193-W197 HydrophobicContact CD1-CE3 4.29Å; L193-W197 HydrophobicContact CD1-CH2 4.2Å; L193-W197 HydrophobicContact CD1-CZ2 4.03Å; L193-W197 HydrophobicContact CD1-CZ3 4.32Å; L193-W197 HydrophobicContact CD2-CE3 4.23Å; L193-W197 HydrophobicContact CD2-CH2 3.46Å; L193-W197 VanDerWaalsContact CD2-CH2 3.46Å; L193-W197 HydrophobicContact CD2-CZ2 4.08Å; L193-W197 HydrophobicContact CD2-CZ3 3.55Å; L193-W197 HydrophobicContact CG-CD2 4.01Å; L193-W197 HydrophobicContact CG-CE3 3.67Å; L193-W197 HydrophobicContact CG-CH2 3.75Å; L193-W197 HydrophobicContact CG-CZ2 4.09Å; L193-W197 HydrophobicContact CG-CZ3 3.52Å; L193-W197 WeakPolarHBondContact O-CB 3.44Å; L193-W197 PolarHBondContact O-N 3.23Å; L193-A501 HydrophobicContact CB-CB 4.44Å; L193-A501 HydrophobicContact CD2-CB 4.39Å; L193-V504 HydrophobicContact CD2-CB 4.27Å; L193-V504 HydrophobicContact CD2-CG1 4.44Å; L193-V504 HydrophobicContact CD2-CG2 4.44Å; L193-P533 HydrophobicContact CD2-CB 4.34Å; L193-I537 HydrophobicContact CD1-CD1 4.44Å; L193-I537 HydrophobicContact CD1-CG1 3.82Å; L193-L540 HydrophobicContact CD1-CD1 4.35Å
194	T	97.6	Very high	94.3	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.8	-47.6	174.5	-58.2	0	0	0	0	111.7	L177 A181 A190 G191 L192 W197 Y198 C497 A498 A501	L177-T194 HydrophobicContact CB-CG2 3.95Å; A181-T194 HydrophobicContact CB-CG2 4.45Å; A181-T194 WeakPolarHBondContact CB-OG1 3.35Å; A190-T194 WeakPolarHBondContact O-CB 3.42Å; A190-T194 PolarHBondContact O-N 3.4Å; A190-T194 PolarHBondContact O-OG1 2.86Å; G191-T194 WeakPolarHBondContact O-CB 3.11Å; G191-T194 PolarHBondContact O-N 3.41Å; G191-T194 VanDerWaalsContact O-N 3.17Å; L192-T194 VanDerWaalsContact C-N 3.3Å; L192-T194 PolarHBondContact O-N 2.94Å; T194-W197 PolarHBondContact O-N 3.09Å; T194-Y198 WeakPolarHBondContact O-CB 3.3Å; T194-Y198 PolarHBondContact O-N 3.43Å; T194-C497 HydrophobicContact CG2-CB 3.91Å; T194-A498 HydrophobicContact CG2-CB 4.04Å; T194-A501 WeakPolarHBondContact OG1-CB 3.34Å
195	G	96.9	Very high	94.3	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.01	8%	0.081	C	C	.	.	H	α-helix	trans	-64.2	-42.4	178.8	0	0	0	0	0	112.6	G191 L192 Y198 I199	G191-G195 PolarHBondContact O-N 3.34Å; L192-G195 PolarHBondContact O-N 3.12Å; G195-Y198 PolarHBondContact O-N 2.96Å; G195-I199 WeakPolarHBondContact O-CG1 3.47Å; G195-I199 PolarHBondContact O-N 3.46Å
196	V	96.6	Very high	94.3	Very high	29 Å²	29	14.4 Å²	14.4	18%	0.176	8%	0.081	C	C	.	.	H	α-helix	trans	-61.2	-48.6	175.4	171.3	0	0	0	0	110.7	L192 L193 Y198 I199 L200 L540	L192-V196 HydrophobicContact CD1-CG2 4.03Å; L192-V196 WeakPolarHBondContact O-CG2 3.37Å; L192-V196 PolarHBondContact O-N 3.49Å; L193-V196 PolarHBondContact O-N 2.88Å; V196-Y198 VanDerWaalsContact C-N 3.31Å; V196-Y198 PolarHBondContact O-N 3.28Å; V196-I199 PolarHBondContact O-N 3.36Å; V196-L200 HydrophobicContact CG1-CD1 3.79Å; V196-L200 HydrophobicContact CG1-CG 4.26Å; V196-L200 WeakPolarHBondContact O-CG 3.48Å; V196-L200 PolarHBondContact O-N 3.42Å; V196-L540 HydrophobicContact CG1-CD1 4.18Å
197	W	97.3	Very high	94.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.5	-36.6	177.1	-81.4	-38.3	0	0	0	113.5	L193 T194 I199 L200 N201 T418 L420 P423 C497 A500 A501 V504 M536	L193-W197 HydrophobicContact CD1-CD2 4.12Å; L193-W197 HydrophobicContact CD1-CE3 4.29Å; L193-W197 HydrophobicContact CD1-CH2 4.2Å; L193-W197 HydrophobicContact CD1-CZ2 4.03Å; L193-W197 HydrophobicContact CD1-CZ3 4.32Å; L193-W197 HydrophobicContact CD2-CE3 4.23Å; L193-W197 HydrophobicContact CD2-CH2 3.46Å; L193-W197 VanDerWaalsContact CD2-CH2 3.46Å; L193-W197 HydrophobicContact CD2-CZ2 4.08Å; L193-W197 HydrophobicContact CD2-CZ3 3.55Å; L193-W197 HydrophobicContact CG-CD2 4.01Å; L193-W197 HydrophobicContact CG-CE3 3.67Å; L193-W197 HydrophobicContact CG-CH2 3.75Å; L193-W197 HydrophobicContact CG-CZ2 4.09Å; L193-W197 HydrophobicContact CG-CZ3 3.52Å; L193-W197 WeakPolarHBondContact O-CB 3.44Å; L193-W197 PolarHBondContact O-N 3.23Å; T194-W197 PolarHBondContact O-N 3.09Å; W197-I199 VanDerWaalsContact C-N 3.34Å; W197-L200 PolarHBondContact O-N 3.23Å; W197-N201 WeakPolarHBondContact O-CB 3.42Å; W197-N201 PolarHBondContact O-N 2.72Å; W197-N201 PolarHBondContact O-ND2 2.93Å; W197-T418 PolarHBondContact NE1-O 3.45Å; W197-L420 HydrophobicContact CB-CD1 4.44Å; W197-L420 HydrophobicContact CB-CD2 4.44Å; W197-L420 HydrophobicContact CD2-CB 4.33Å; W197-L420 HydrophobicContact CD2-CD1 3.63Å; W197-L420 HydrophobicContact CD2-CG 4.46Å; W197-L420 HydrophobicContact CE3-CD1 3.59Å; W197-L420 HydrophobicContact CG-CB 4.29Å; W197-L420 HydrophobicContact CG-CD1 4.05Å; W197-L420 HydrophobicContact CH2-CD1 4.28Å; W197-L420 HydrophobicContact CZ2-CD1 4.3Å; W197-L420 HydrophobicContact CZ3-CD1 3.94Å; W197-P423 HydrophobicContact CH2-CG 3.86Å; W197-P423 HydrophobicContact CZ2-CG 4.05Å; W197-C497 HydrophobicContact CB-CB 4.18Å; W197-A500 HydrophobicContact CE3-CB 4.42Å; W197-A500 HydrophobicContact CH2-CB 4.06Å; W197-A500 HydrophobicContact CZ3-CB 3.7Å; W197-A501 HydrophobicContact CE3-CB 4.46Å; W197-A501 HydrophobicContact CZ3-CB 3.96Å; W197-V504 HydrophobicContact CH2-CG2 4.2Å; W197-M536 HydrophobicContact CH2-CE 4.18Å; W197-M536 HydrophobicContact CZ2-CE 3.53Å
198	Y	96.4	Very high	94.5	Very high	1 Å²	1	15.1 Å²	15.1	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-60.7	-45.5	176	-177.6	-84.6	0	0	0	111.4	Y173 V174 L177 T194 G195 V196 T205	Y173-Y198 AromaticContact CD1-CE2 4Å; Y173-Y198 HydrophobicContact CD1-CE2 4Å; Y173-Y198 AromaticContact CD1-CZ 3.88Å; Y173-Y198 WeakPolarHBondContact CD1-OH 3.49Å; Y173-Y198 AromaticContact CE1-CE2 3.71Å; Y173-Y198 HydrophobicContact CE1-CE2 3.71Å; Y173-Y198 AromaticContact CE1-CZ 3.97Å; Y173-Y198 WeakPolarHBondContact CE1-OH 3.45Å; V174-Y198 HydrophobicContact CG2-CD1 3.42Å; V174-Y198 VanDerWaalsContact CG2-CD1 3.42Å; V174-Y198 HydrophobicContact CG2-CE1 3.53Å; V174-Y198 HydrophobicContact CG2-CG 4.04Å; L177-Y198 HydrophobicContact CD1-CD2 3.59Å; L177-Y198 HydrophobicContact CD1-CE2 3.87Å; T194-Y198 WeakPolarHBondContact O-CB 3.3Å; T194-Y198 PolarHBondContact O-N 3.43Å; G195-Y198 PolarHBondContact O-N 2.96Å; V196-Y198 VanDerWaalsContact C-N 3.31Å; V196-Y198 PolarHBondContact O-N 3.28Å; Y198-T205 HydrophobicContact CD2-CG2 3.99Å; Y198-T205 HydrophobicContact CE2-CG2 4.31Å; Y198-T205 HydrophobicContact CG-CG2 4.49Å; Y198-T205 PolarHBondContact O-OG1 2.81Å; Y198-T205 VanDerWaalsContact O-OG1 3.11Å
199	I	94.7	Very high	94	Very high	16 Å²	16	14.5 Å²	14.5	8%	0.082	8%	0.077	C	C	.	.	H	α-helix	trans	-67.4	-45.5	178.6	-66	167.7	0	0	0	110.6	L63 C64 G195 V196 W197 N201 R202	L63-I199 HydrophobicContact CD2-CD1 4.26Å; C64-I199 HydrophobicContact CB-CD1 4.2Å; C64-I199 HydrophobicContact CB-CG1 4.11Å; G195-I199 WeakPolarHBondContact O-CG1 3.47Å; G195-I199 PolarHBondContact O-N 3.46Å; V196-I199 PolarHBondContact O-N 3.36Å; W197-I199 VanDerWaalsContact C-N 3.34Å; I199-N201 VanDerWaalsContact C-N 3.35Å; I199-N201 PolarHBondContact O-N 2.99Å; I199-R202 PolarHBondContact O-N 3.38Å; I199-R202 PolarHBondContact O-NH1 3.2Å
200	L	94.3	Very high	93.5	Very high	41 Å²	41	20 Å²	20	22%	0.215	10%	0.1	C	C	.	.	H	α-helix	trans	-70.2	-28.5	-176.8	-67.7	-179.1	0	0	0	113.7	V196 W197 T418 L540 F544	V196-L200 HydrophobicContact CG1-CD1 3.79Å; V196-L200 HydrophobicContact CG1-CG 4.26Å; V196-L200 WeakPolarHBondContact O-CG 3.48Å; V196-L200 PolarHBondContact O-N 3.42Å; W197-L200 PolarHBondContact O-N 3.23Å; L200-T418 HydrophobicContact CB-CG2 4.31Å; L200-L540 HydrophobicContact CD1-CB 3.87Å; L200-L540 HydrophobicContact CD1-CD1 4.33Å; L200-L540 HydrophobicContact CD1-CD2 3.91Å; L200-L540 HydrophobicContact CD1-CG 4.25Å; L200-F544 HydrophobicContact CD1-CB 4.34Å; L200-F544 HydrophobicContact CD1-CD2 4.33Å; L200-F544 HydrophobicContact CD1-CG 4.37Å; L200-F544 HydrophobicContact CD2-CB 3.67Å; L200-F544 HydrophobicContact CD2-CG 4.2Å
201	N	94.7	Very high	93.2	Very high	6 Å²	6	21 Å²	21	3%	0.032	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	29.9	179.1	-63.6	-81.3	0	0	0	112.6	W197 I199 V203 D204 T205 L415 T418	W197-N201 WeakPolarHBondContact O-CB 3.42Å; W197-N201 PolarHBondContact O-N 2.72Å; W197-N201 PolarHBondContact O-ND2 2.93Å; I199-N201 VanDerWaalsContact C-N 3.35Å; I199-N201 PolarHBondContact O-N 2.99Å; N201-V203 VanDerWaalsContact C-N 3.29Å; N201-V203 PolarHBondContact O-N 2.95Å; N201-V203 VanDerWaalsContact O-N 3.17Å; N201-D204 WeakPolarHBondContact O-CA 3.42Å; N201-D204 PolarHBondContact O-N 3.3Å; N201-T205 HydrophobicContact CB-CG2 4.26Å; N201-T205 WeakPolarHBondContact O-CG2 3.45Å; N201-T205 PolarHBondContact O-N 3.34Å; N201-T205 PolarHBondContact O-OG1 3.29Å; N201-L415 HydrophobicContact CB-CD2 4.18Å; N201-T418 VanDerWaalsContact CG-OG1 3.31Å; N201-T418 PolarHBondContact ND2-OG1 2.72Å; N201-T418 WeakPolarHBondContact OD1-CG2 3.24Å; N201-T418 PolarHBondContact OD1-OG1 3.07Å
202	R	92.3	Very high	93	Very high	8 Å²	8	21.3 Å²	21.3	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-48.1	-45.4	-174.8	144.9	179.1	-64.3	79.8	10.2	115.6	Y67 V68 I199 D204 T205 T206 E209	Y67-R202 VanDerWaalsContact CD1-NH1 3.34Å; Y67-R202 VanDerWaalsContact CE1-NE 3.34Å; V68-R202 VanDerWaalsContact CG2-NH2 3.31Å; I199-R202 PolarHBondContact O-N 3.38Å; I199-R202 PolarHBondContact O-NH1 3.2Å; R202-D204 PolarHBondContact O-N 2.85Å; R202-T205 VanDerWaalsContact CA-OG1 3.28Å; R202-T205 WeakPolarHBondContact CA-OG1 3.44Å; R202-T205 PolarHBondContact O-N 3.1Å; R202-T205 PolarHBondContact O-OG1 3.5Å; R202-T206 HydrophobicContact CG-CG2 4.36Å; R202-T206 PolarHBondContact O-N 2.89Å; R202-E209 WeakPolarHBondContact CD-OE2 3.3Å
203	V	91.2	Very high	92.8	Very high	81 Å²	81	19.6 Å²	19.6	49%	0.491	10%	0.1	S	C	.	.	H	α-helix	trans	-54.3	-25.1	179.7	-179.2	0	0	0	0	112.4	N201 K489	N201-V203 VanDerWaalsContact C-N 3.29Å; N201-V203 PolarHBondContact O-N 2.95Å; N201-V203 VanDerWaalsContact O-N 3.17Å; V203-K489 PolarHBondContact O-NZ 2.93Å
204	D	93.5	Very high	92.5	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.011	10%	0.101	C	C	.	.	H	α-helix	trans	-109.7	-11.3	180	-62.6	-54.2	0	0	0	114	N201 R202 R414 K489 T493	N201-D204 WeakPolarHBondContact O-CA 3.42Å; N201-D204 PolarHBondContact O-N 3.3Å; R202-D204 PolarHBondContact O-N 2.85Å; D204-R414 IonicContact OD1-CZ 3.84Å; D204-R414 IonicContact OD1-NE 3.93Å; D204-R414 IonicContact OD1-NH2 3.02Å; D204-R414 PolarHBondContact OD1-NH2 3.14Å; D204-R414 IonicContact OD2-CZ 2.74Å; D204-R414 IonicContact OD2-NE 3.22Å; D204-R414 PolarHBondContact OD2-NE 3.15Å; D204-R414 IonicContact OD2-NH2 3.58Å; D204-R414 PolarHBondContact OD2-NH2 3.14Å; D204-K489 IonicContact OD1-NZ 2.7Å; D204-K489 PolarHBondContact OD1-NZ 3.41Å; D204-T493 HydrophobicContact CB-CG2 4.07Å; D204-T493 VanDerWaalsContact O-CB 3.23Å; D204-T493 WeakPolarHBondContact O-CB 3.37Å; D204-T493 PolarHBondContact O-OG1 2.93Å
205	T	93.1	Very high	92.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-102.8	-30.1	179.1	61.2	0	0	0	0	113.7	Y198 N201 R202 T493	Y198-T205 HydrophobicContact CD2-CG2 3.99Å; Y198-T205 HydrophobicContact CE2-CG2 4.31Å; Y198-T205 HydrophobicContact CG-CG2 4.49Å; Y198-T205 PolarHBondContact O-OG1 2.81Å; Y198-T205 VanDerWaalsContact O-OG1 3.11Å; N201-T205 HydrophobicContact CB-CG2 4.26Å; N201-T205 WeakPolarHBondContact O-CG2 3.45Å; N201-T205 PolarHBondContact O-N 3.34Å; N201-T205 PolarHBondContact O-OG1 3.29Å; R202-T205 VanDerWaalsContact CA-OG1 3.28Å; R202-T205 WeakPolarHBondContact CA-OG1 3.44Å; R202-T205 PolarHBondContact O-N 3.1Å; R202-T205 PolarHBondContact O-OG1 3.5Å; T205-T493 HydrophobicContact CG2-CG2 3.57Å
206	T	91.9	Very high	91.9	Very high	8 Å²	8	20.7 Å²	20.7	5%	0.049	10%	0.104	C	C	.	.			trans	-154.4	162.1	179.9	-171.5	0	0	0	0	112.1	R202 V208	R202-T206 HydrophobicContact CG-CG2 4.36Å; R202-T206 PolarHBondContact O-N 2.89Å; T206-V208 HydrophobicContact CG2-CG1 3.98Å; T206-V208 WeakPolarHBondContact OG1-CG1 3.44Å; T206-V208 PolarHBondContact OG1-N 3.18Å
207	R	89.8	Confident	91.8	Very high	36 Å²	36	19.6 Å²	19.6	14%	0.136	10%	0.097	C	C	.	.			trans	-134	19.7	174.6	55.8	171.3	178.7	164	3.3	112.7	E209 F210 T211 E216 Y490	R207-E209 PolarHBondContact O-N 3.41Å; R207-F210 HydrophobicContact CB-CE1 3.83Å; R207-F210 HydrophobicContact CB-CE2 4.17Å; R207-F210 HydrophobicContact CB-CZ 3.51Å; R207-F210 PolarHBondContact O-N 3.35Å; R207-T211 WeakPolarHBondContact CD-OG1 3.36Å; R207-T211 WeakPolarHBondContact CG-OG1 3.38Å; R207-T211 PolarHBondContact O-N 3.48Å; R207-T211 VanDerWaalsContact O-N 3.11Å; R207-T211 PolarHBondContact O-OG1 3.39Å; R207-E216 IonicContact CZ-OE1 3.72Å; R207-E216 IonicContact NE-OE1 2.84Å; R207-E216 PolarHBondContact NE-OE1 3.49Å; R207-E216 IonicContact NH2-OE1 2.99Å; R207-E216 PolarHBondContact NH2-OE1 2.95Å; R207-E216 IonicContact NH2-OE2 2.91Å; R207-E216 PolarHBondContact NH2-OE2 3.42Å; R207-Y490 HydrophobicContact CB-CE1 4.17Å; R207-Y490 HydrophobicContact CG-CE1 4.28Å; R207-Y490 HydrophobicContact CG-CE2 4.23Å
208	V	91.3	Very high	91.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26	-175.4	63	0	0	0	0	113.1	V68 V166 F167 Q170 T206 F210 I212 N217	V68-V208 HydrophobicContact CB-CG1 4.46Å; V68-V208 HydrophobicContact CG1-CG1 3.48Å; V68-V208 VanDerWaalsContact CG1-CG1 3.48Å; V68-V208 HydrophobicContact CG2-CG1 4.12Å; V166-V208 HydrophobicContact CG1-CG2 3.72Å; F167-V208 HydrophobicContact CD1-CG2 3.94Å; F167-V208 HydrophobicContact CE1-CG2 4.05Å; Q170-V208 HydrophobicContact CG-CB 4.38Å; Q170-V208 HydrophobicContact CG-CG1 4.06Å; Q170-V208 HydrophobicContact CG-CG2 4.05Å; T206-V208 HydrophobicContact CG2-CG1 3.98Å; T206-V208 WeakPolarHBondContact OG1-CG1 3.44Å; T206-V208 PolarHBondContact OG1-N 3.18Å; V208-F210 PolarHBondContact O-N 2.89Å; V208-I212 WeakPolarHBondContact O-CA 3.21Å; V208-I212 WeakPolarHBondContact O-CG1 3.44Å; V208-I212 PolarHBondContact O-N 2.98Å; V208-N217 HydrophobicContact CG2-CB 4.3Å
209	E	83.5	Confident	91.6	Very high	29 Å²	29	20 Å²	20	14%	0.136	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-35.8	-176.8	73.5	-158.9	165.3	0	0	113.1	V68 L71 H72 R202 R207	V68-E209 HydrophobicContact CG1-CB 4.44Å; L71-E209 WeakPolarHBondContact CD1-OE2 3.48Å; H72-E209 PolarHBondContact ND1-O 3.32Å; R202-E209 WeakPolarHBondContact CD-OE2 3.3Å; R207-E209 PolarHBondContact O-N 3.41Å
210	F	81.7	Confident	91.6	Very high	125 Å²	125	19.8 Å²	19.8	55%	0.548	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-10.9	-178.3	62.1	-96.8	0	0	0	113.5	R207 V208	R207-F210 HydrophobicContact CB-CE1 3.83Å; R207-F210 HydrophobicContact CB-CE2 4.17Å; R207-F210 HydrophobicContact CB-CZ 3.51Å; R207-F210 PolarHBondContact O-N 3.35Å; V208-F210 PolarHBondContact O-N 2.89Å
211	T	89.1	Confident	91.8	Very high	21 Å²	21	17.9 Å²	17.9	13%	0.129	9%	0.088	C	C	.	.			trans	-129.8	50.5	178.5	49.6	0	0	0	0	112.3	R207 S213 L214 N217	R207-T211 WeakPolarHBondContact CD-OG1 3.36Å; R207-T211 WeakPolarHBondContact CG-OG1 3.38Å; R207-T211 PolarHBondContact O-N 3.48Å; R207-T211 VanDerWaalsContact O-N 3.11Å; R207-T211 PolarHBondContact O-OG1 3.39Å; T211-S213 PolarHBondContact O-N 3.4Å; T211-L214 VanDerWaalsContact CB-CD1 3.44Å; T211-L214 HydrophobicContact CG2-CD1 3.97Å; T211-L214 HydrophobicContact CG2-CG 4.5Å; T211-L214 WeakPolarHBondContact O-CG 3.5Å; T211-L214 PolarHBondContact O-N 3.33Å; T211-N217 PolarHBondContact O-ND2 3.01Å
212	I	93	Very high	91.9	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.036	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-56.1	-168.7	-58.3	159.5	0	0	0	112.7	H72 I163 V166 F167 V208 L214 N217	H72-I212 WeakPolarHBondContact CE1-CD1 3.27Å; I163-I212 HydrophobicContact CB-CD1 4.13Å; I163-I212 HydrophobicContact CB-CG2 4.23Å; I163-I212 HydrophobicContact CG2-CD1 3.73Å; I163-I212 HydrophobicContact CG2-CG2 4.2Å; V166-I212 HydrophobicContact CB-CG2 3.68Å; V166-I212 HydrophobicContact CG1-CG2 3.82Å; V166-I212 WeakPolarHBondContact CG1-O 3.41Å; V166-I212 HydrophobicContact CG2-CG2 3.86Å; F167-I212 HydrophobicContact CE1-CD1 4.45Å; F167-I212 HydrophobicContact CE1-CG1 4Å; F167-I212 HydrophobicContact CE1-CG2 4.45Å; F167-I212 HydrophobicContact CZ-CD1 4.07Å; F167-I212 HydrophobicContact CZ-CG1 4.11Å; V208-I212 WeakPolarHBondContact O-CA 3.21Å; V208-I212 WeakPolarHBondContact O-CG1 3.44Å; V208-I212 PolarHBondContact O-N 2.98Å; I212-L214 PolarHBondContact O-N 3.09Å; I212-L214 VanDerWaalsContact O-N 3.09Å; I212-N217 PolarHBondContact O-ND2 3Å
213	S	92.1	Very high	92.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-2.8	-171	-55.6	0	0	0	0	115.7	Y97 Y162 T211 R215	Y97-S213 WeakPolarHBondContact CD2-O 3.46Å; Y162-S213 WeakPolarHBondContact CE1-OG 3.19Å; Y162-S213 WeakPolarHBondContact OH-CB 3.33Å; Y162-S213 PolarHBondContact OH-OG 3.34Å; T211-S213 PolarHBondContact O-N 3.4Å; S213-R215 PolarHBondContact O-N 3.25Å
214	L	91.9	Very high	92.4	Very high	6 Å²	6	16.2 Å²	16.2	3%	0.031	8%	0.075	C	C	.	.			trans	-61.7	140.1	-177.6	-70.2	-177.3	0	0	0	111.9	E93 T211 I212 E216 N217	E93-L214 HydrophobicContact CB-CD2 4.34Å; T211-L214 VanDerWaalsContact CB-CD1 3.44Å; T211-L214 HydrophobicContact CG2-CD1 3.97Å; T211-L214 HydrophobicContact CG2-CG 4.5Å; T211-L214 WeakPolarHBondContact O-CG 3.5Å; T211-L214 PolarHBondContact O-N 3.33Å; I212-L214 PolarHBondContact O-N 3.09Å; I212-L214 VanDerWaalsContact O-N 3.09Å; L214-E216 HydrophobicContact CB-CG 3.99Å; L214-E216 PolarHBondContact O-N 3.12Å; L214-E216 VanDerWaalsContact O-N 3.15Å; L214-N217 WeakPolarHBondContact O-CB 3.13Å; L214-N217 PolarHBondContact O-N 3.36Å
215	R	92.2	Very high	92.6	Very high	6 Å²	6	18.1 Å²	18.1	2%	0.023	9%	0.085	C	C	.	.	H	α-helix	trans	-58	-31.1	-175.3	-58.5	-49.1	-172	-167.5	13.1	114.2	Y97 M135 N136 I137 Q139 E140 S213 W218 S219 T260 W261	Y97-R215 VanDerWaalsContact CD1-CZ 3.44Å; Y97-R215 HydrophobicContact CE2-CG 4.14Å; M135-R215 PolarHBondContact O-NH2 3.31Å; N136-R215 PolarHBondContact O-NH2 3.48Å; I137-R215 VanDerWaalsContact CA-NH2 3.33Å; Q139-R215 VanDerWaalsContact CD-NH1 3.35Å; E140-R215 IonicContact OE1-CZ 3.46Å; E140-R215 IonicContact OE1-NH1 3.45Å; E140-R215 PolarHBondContact OE1-NH1 3.31Å; E140-R215 IonicContact OE2-CZ 3.89Å; E140-R215 IonicContact OE2-NH1 3.14Å; E140-R215 PolarHBondContact OE2-NH1 3.43Å; E140-R215 IonicContact OE2-NH2 2.63Å; E140-R215 PolarHBondContact OE2-NH2 3.02Å; S213-R215 PolarHBondContact O-N 3.25Å; R215-W218 PolarHBondContact O-N 3Å; R215-S219 VanDerWaalsContact O-CB 3.3Å; R215-S219 WeakPolarHBondContact O-CB 3.43Å; R215-S219 PolarHBondContact O-N 3.02Å; R215-S219 PolarHBondContact O-OG 2.85Å; R215-T260 WeakPolarHBondContact CD-O 3.41Å; R215-W261 HydrophobicContact CB-CB 4.12Å; R215-W261 HydrophobicContact CB-CG 3.93Å
216	E	90.3	Very high	92.8	Very high	12 Å²	12	18.3 Å²	18.3	6%	0.056	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-37.7	174.1	58.3	-153.6	-120.3	0	0	112.8	R207 L214 W218 S219 L220 W261 R487	R207-E216 IonicContact CZ-OE1 3.72Å; R207-E216 IonicContact NE-OE1 2.84Å; R207-E216 PolarHBondContact NE-OE1 3.49Å; R207-E216 IonicContact NH2-OE1 2.99Å; R207-E216 PolarHBondContact NH2-OE1 2.95Å; R207-E216 IonicContact NH2-OE2 2.91Å; R207-E216 PolarHBondContact NH2-OE2 3.42Å; L214-E216 HydrophobicContact CB-CG 3.99Å; L214-E216 PolarHBondContact O-N 3.12Å; L214-E216 VanDerWaalsContact O-N 3.15Å; E216-W218 VanDerWaalsContact C-N 3.26Å; E216-W218 PolarHBondContact O-N 3.21Å; E216-S219 WeakPolarHBondContact CA-OG 3.38Å; E216-S219 PolarHBondContact O-N 3.02Å; E216-L220 HydrophobicContact CB-CD1 4.27Å; E216-L220 HydrophobicContact CB-CG 4.47Å; E216-L220 WeakPolarHBondContact O-CB 3.48Å; E216-L220 WeakPolarHBondContact O-CG 3.26Å; E216-L220 PolarHBondContact O-N 3.34Å; E216-W261 HydrophobicContact CB-CZ2 4.42Å; E216-R487 IonicContact OE2-CZ 3.72Å; E216-R487 IonicContact OE2-NE 2.83Å; E216-R487 IonicContact OE2-NH2 2.84Å; E216-R487 PolarHBondContact OE2-NH2 3.31Å
217	N	93.9	Very high	93.1	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.032	9%	0.085	C	C	.	.	H	α-helix	trans	-67.8	-29	178.3	-61.5	-26.3	0	0	0	112.3	V166 Q170 V208 T211 I212 L214 P221	V166-N217 HydrophobicContact CG1-CB 4.01Å; Q170-N217 PolarHBondContact NE2-O 3.49Å; Q170-N217 VanDerWaalsContact NE2-O 3.15Å; V208-N217 HydrophobicContact CG2-CB 4.3Å; T211-N217 PolarHBondContact O-ND2 3.01Å; I212-N217 PolarHBondContact O-ND2 3Å; L214-N217 WeakPolarHBondContact O-CB 3.13Å; L214-N217 PolarHBondContact O-N 3.36Å; N217-P221 WeakPolarHBondContact O-CD 3.35Å; N217-P221 WeakPolarHBondContact O-CG 3.38Å
218	W	95	Very high	93.4	Very high	9 Å²	9	17.1 Å²	17.1	3%	0.034	8%	0.083	C	C	.	.	H	α-helix	trans	-77.7	-42.7	173.7	-66.8	92.4	0	0	0	112.4	Q139 L143 Y162 T165 V166 L169 R215 E216 F222 T260	Q139-W218 HydrophobicContact CB-CD2 4.06Å; Q139-W218 HydrophobicContact CB-CE3 3.78Å; Q139-W218 HydrophobicContact CB-CH2 4.46Å; Q139-W218 HydrophobicContact CB-CZ3 4.03Å; Q139-W218 HydrophobicContact CG-CD2 3.78Å; Q139-W218 HydrophobicContact CG-CE3 4.06Å; Q139-W218 HydrophobicContact CG-CG 4.15Å; Q139-W218 HydrophobicContact CG-CZ2 4.32Å; L143-W218 HydrophobicContact CD1-CH2 3.35Å; L143-W218 HydrophobicContact CD1-CZ2 4.31Å; L143-W218 HydrophobicContact CD1-CZ3 3.96Å; L143-W218 HydrophobicContact CG-CH2 4.44Å; Y162-W218 AromaticContact CE2-CZ2 3.95Å; Y162-W218 HydrophobicContact CE2-CZ2 3.95Å; Y162-W218 AromaticContact CZ-CZ2 3.91Å; T165-W218 HydrophobicContact CG2-CH2 4.22Å; T165-W218 HydrophobicContact CG2-CZ3 4.09Å; V166-W218 HydrophobicContact CG2-CD2 4.32Å; V166-W218 HydrophobicContact CG2-CH2 3.5Å; V166-W218 VanDerWaalsContact CG2-CH2 3.5Å; V166-W218 HydrophobicContact CG2-CZ2 3.15Å; V166-W218 HydrophobicContact CG2-CZ3 4.3Å; L169-W218 HydrophobicContact CD1-CD2 4.15Å; L169-W218 HydrophobicContact CD1-CE3 3.31Å; L169-W218 HydrophobicContact CD1-CZ3 3.63Å; R215-W218 PolarHBondContact O-N 3Å; E216-W218 VanDerWaalsContact C-N 3.26Å; E216-W218 PolarHBondContact O-N 3.21Å; W218-F222 WeakPolarHBondContact O-CD2 3.26Å; W218-F222 WeakPolarHBondContact O-CE2 3.32Å; W218-T260 HydrophobicContact CB-CG2 4.43Å
219	S	95.2	Very high	93.7	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-88.5	-37.6	-165.6	58.9	0	0	0	0	114.2	R215 E216 P221 F222 F223 F257 T260 W261	R215-S219 VanDerWaalsContact O-CB 3.3Å; R215-S219 WeakPolarHBondContact O-CB 3.43Å; R215-S219 PolarHBondContact O-N 3.02Å; R215-S219 PolarHBondContact O-OG 2.85Å; E216-S219 WeakPolarHBondContact CA-OG 3.38Å; E216-S219 PolarHBondContact O-N 3.02Å; S219-P221 VanDerWaalsContact C-CD 3.46Å; S219-F222 PolarHBondContact O-N 3.4Å; S219-F222 VanDerWaalsContact O-N 3.09Å; S219-F223 PolarHBondContact O-N 2.84Å; S219-F257 WeakPolarHBondContact O-CD2 3.3Å; S219-T260 WeakPolarHBondContact CA-OG1 3.16Å; S219-T260 VanDerWaalsContact CB-OG1 3.28Å; S219-T260 WeakPolarHBondContact CB-OG1 3.42Å; S219-W261 WeakPolarHBondContact OG-CB 3.5Å; S219-W261 VanDerWaalsContact OG-CE3 3.27Å
220	L	94.7	Very high	94.3	Very high	11 Å²	11	15.9 Å²	15.9	6%	0.058	8%	0.078	C	C	.	.	H	α-helix	trans	-58.5	-37.1	-179.5	-66.5	177	0	0	0	114.5	Y173 E216 F222 F223 A224 W261 I491	Y173-L220 HydrophobicContact CE1-CB 4.38Å; E216-L220 HydrophobicContact CB-CD1 4.27Å; E216-L220 HydrophobicContact CB-CG 4.47Å; E216-L220 WeakPolarHBondContact O-CB 3.48Å; E216-L220 WeakPolarHBondContact O-CG 3.26Å; E216-L220 PolarHBondContact O-N 3.34Å; L220-F222 VanDerWaalsContact C-N 3.35Å; L220-F222 PolarHBondContact O-N 2.98Å; L220-F223 PolarHBondContact O-N 3.03Å; L220-A224 WeakPolarHBondContact O-CB 3.44Å; L220-A224 PolarHBondContact O-N 3.03Å; L220-W261 HydrophobicContact CD2-CZ3 4.34Å; L220-I491 HydrophobicContact CD2-CG1 4.04Å
221	P	96.6	Very high	95	Very high	1 Å²	1	10 Å²	10	1%	0.006	5%	0.052	C	C	.	.	H	α-helix	trans	-56.1	-45.4	171.4	-22.2	28.4	0	0	0	113.1	L169 V172 N217 S219 A224 L225	L169-P221 HydrophobicContact CB-CG 4.05Å; L169-P221 WeakPolarHBondContact O-CB 3.49Å; L169-P221 WeakPolarHBondContact O-CG 3.35Å; V172-P221 HydrophobicContact CB-CB 4.42Å; V172-P221 HydrophobicContact CG1-CB 4.39Å; N217-P221 WeakPolarHBondContact O-CD 3.35Å; N217-P221 WeakPolarHBondContact O-CG 3.38Å; S219-P221 VanDerWaalsContact C-CD 3.46Å; P221-A224 PolarHBondContact O-N 3.47Å; P221-L225 WeakPolarHBondContact O-CG 3.15Å; P221-L225 PolarHBondContact O-N 2.92Å
222	F	97.6	Very high	95.3	Very high	43 Å²	43	9.8 Å²	9.8	19%	0.189	5%	0.051	C	C	.	.	H	α-helix	trans	-66.9	-38.6	177.2	-60.3	-63.1	0	0	0	111.7	L169 W218 S219 L220 L225 Q226 C256 F257 T260	L169-F222 HydrophobicContact CD2-CZ 4.14Å; W218-F222 WeakPolarHBondContact O-CD2 3.26Å; W218-F222 WeakPolarHBondContact O-CE2 3.32Å; S219-F222 PolarHBondContact O-N 3.4Å; S219-F222 VanDerWaalsContact O-N 3.09Å; L220-F222 VanDerWaalsContact C-N 3.35Å; L220-F222 PolarHBondContact O-N 2.98Å; F222-L225 PolarHBondContact O-N 3.39Å; F222-Q226 WeakPolarHBondContact O-CB 3.14Å; F222-Q226 PolarHBondContact O-N 3.21Å; F222-C256 HydrophobicContact CB-CB 4.12Å; F222-C256 HydrophobicContact CD1-CB 3.66Å; F222-C256 HydrophobicContact CD2-CB 3.9Å; F222-C256 HydrophobicContact CE1-CB 4Å; F222-C256 HydrophobicContact CE2-CB 4.23Å; F222-C256 HydrophobicContact CG-CB 3.61Å; F222-C256 HydrophobicContact CZ-CB 4.28Å; F222-F257 HydrophobicContact CB-CB 4.25Å; F222-T260 HydrophobicContact CE2-CG2 4.14Å
223	F	97.1	Very high	95.4	Very high	11 Å²	11	10.4 Å²	10.4	5%	0.048	5%	0.053	C	C	.	.	H	α-helix	trans	-63.9	-41.6	175.2	-174.7	-109.7	0	0	0	112.4	S219 L220 L225 Q226 V227 F257 I267 Y478	S219-F223 PolarHBondContact O-N 2.84Å; L220-F223 PolarHBondContact O-N 3.03Å; F223-L225 PolarHBondContact O-N 3.19Å; F223-Q226 CarbonylContact O-C 3.25Å; F223-Q226 WeakPolarHBondContact O-CA 3.22Å; F223-Q226 VanDerWaalsContact O-CB 3.3Å; F223-Q226 WeakPolarHBondContact O-CB 3.2Å; F223-Q226 PolarHBondContact O-N 3.22Å; F223-Q226 VanDerWaalsContact O-N 3.12Å; F223-V227 HydrophobicContact CD1-CG2 4.19Å; F223-V227 HydrophobicContact CE1-CG2 3.67Å; F223-V227 HydrophobicContact CE2-CG2 4.26Å; F223-V227 HydrophobicContact CZ-CG2 3.68Å; F223-V227 WeakPolarHBondContact O-CG2 3.24Å; F223-V227 PolarHBondContact O-N 3.45Å; F223-F257 HydrophobicContact CB-CD2 3.64Å; F223-F257 HydrophobicContact CB-CE2 3.71Å; F223-F257 HydrophobicContact CB-CG 4.16Å; F223-F257 HydrophobicContact CB-CZ 4.27Å; F223-F257 HydrophobicContact CD2-CD1 4.05Å; F223-F257 HydrophobicContact CD2-CD2 4.41Å; F223-F257 AromaticContact CD2-CE1 3.83Å; F223-F257 HydrophobicContact CD2-CE1 3.83Å; F223-F257 HydrophobicContact CD2-CE2 4.23Å; F223-F257 HydrophobicContact CD2-CG 4.33Å; F223-F257 AromaticContact CD2-CZ 3.94Å; F223-F257 HydrophobicContact CD2-CZ 3.94Å; F223-F257 HydrophobicContact CE2-CE1 4.46Å; F223-F257 HydrophobicContact CG-CD2 4.37Å; F223-F257 HydrophobicContact CG-CE2 4.11Å; F223-F257 HydrophobicContact CG-CZ 4.18Å; F223-I267 HydrophobicContact CD1-CG2 4.44Å; F223-I267 HydrophobicContact CD2-CG2 4.36Å; F223-I267 HydrophobicContact CE1-CG2 3.98Å; F223-I267 HydrophobicContact CE2-CG2 3.91Å; F223-I267 HydrophobicContact CZ-CG2 3.71Å; F223-Y478 HydrophobicContact CE1-CE2 4.27Å; F223-Y478 WeakPolarHBondContact CE1-OH 3.32Å; F223-Y478 WeakPolarHBondContact CZ-OH 3.46Å
224	A	97.2	Very high	95.4	Very high	7 Å²	7	10.5 Å²	10.5	6%	0.058	5%	0.054	C	C	.	.	H	α-helix	trans	-65.3	-39.6	177.1	0	0	0	0	0	112.2	Y173 A176 L220 P221 Q226 V227 T228	Y173-A224 HydrophobicContact CD2-CB 3.36Å; Y173-A224 HydrophobicContact CE2-CB 3.48Å; Y173-A224 VanDerWaalsContact CE2-CB 3.48Å; A176-A224 HydrophobicContact CB-CB 3.62Å; L220-A224 WeakPolarHBondContact O-CB 3.44Å; L220-A224 PolarHBondContact O-N 3.03Å; P221-A224 PolarHBondContact O-N 3.47Å; A224-Q226 VanDerWaalsContact C-N 3.28Å; A224-Q226 PolarHBondContact O-N 2.92Å; A224-V227 PolarHBondContact O-N 3.17Å; A224-T228 PolarHBondContact O-N 2.75Å; A224-T228 PolarHBondContact O-OG1 3.48Å
225	L	97.6	Very high	95	Very high	42 Å²	42	11.3 Å²	11.3	22%	0.22	6%	0.057	C	C	.	.	H	α-helix	trans	-61.3	-39.5	171.2	-73.9	174.2	0	0	0	111.3	V172 A176 P221 F222 F223 T228 A229 T253	V172-L225 HydrophobicContact CG1-CD1 3.54Å; V172-L225 HydrophobicContact CG1-CD2 4.35Å; V172-L225 HydrophobicContact CG1-CG 4.02Å; A176-L225 HydrophobicContact CB-CD2 3.8Å; A176-L225 HydrophobicContact CB-CG 4.01Å; P221-L225 WeakPolarHBondContact O-CG 3.15Å; P221-L225 PolarHBondContact O-N 2.92Å; F222-L225 PolarHBondContact O-N 3.39Å; F223-L225 PolarHBondContact O-N 3.19Å; L225-T228 WeakPolarHBondContact O-CB 3.36Å; L225-T228 PolarHBondContact O-N 2.98Å; L225-A229 WeakPolarHBondContact O-CB 3.15Å; L225-A229 PolarHBondContact O-N 3.44Å; L225-T253 HydrophobicContact CB-CG2 3.75Å; L225-T253 HydrophobicContact CD1-CG2 4.41Å
226	Q	97.8	Very high	93.8	Very high	4 Å²	4	16.7 Å²	16.7	2%	0.019	9%	0.092	C	C	.	.	H	α-helix	trans	-63.6	-45.7	175.9	-169.9	-105.9	37.6	0	0	111.7	F222 F223 A224 T228 A229 V230 T253 T254 Q271	F222-Q226 WeakPolarHBondContact O-CB 3.14Å; F222-Q226 PolarHBondContact O-N 3.21Å; F223-Q226 CarbonylContact O-C 3.25Å; F223-Q226 WeakPolarHBondContact O-CA 3.22Å; F223-Q226 VanDerWaalsContact O-CB 3.3Å; F223-Q226 WeakPolarHBondContact O-CB 3.2Å; F223-Q226 PolarHBondContact O-N 3.22Å; F223-Q226 VanDerWaalsContact O-N 3.12Å; A224-Q226 VanDerWaalsContact C-N 3.28Å; A224-Q226 PolarHBondContact O-N 2.92Å; Q226-T228 VanDerWaalsContact C-N 3.29Å; Q226-T228 PolarHBondContact O-N 3.39Å; Q226-A229 PolarHBondContact O-N 2.89Å; Q226-V230 WeakPolarHBondContact O-CG2 3.35Å; Q226-V230 PolarHBondContact O-N 3.43Å; Q226-T253 WeakPolarHBondContact CA-OG1 3.49Å; Q226-T253 WeakPolarHBondContact CB-OG1 3.43Å; Q226-T254 WeakPolarHBondContact CG-OG1 3.3Å; Q226-T254 PolarHBondContact NE2-OG1 2.9Å; Q226-Q271 VanDerWaalsContact CD-NE2 3.35Å; Q226-Q271 VanDerWaalsContact NE2-NE2 3.18Å
227	V	97.4	Very high	92.9	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.03	11%	0.108	C	C	.	.	H	α-helix	trans	-60	-40.3	174.2	169.4	0	0	0	0	111.2	F223 A224 V230 T231 Y470	F223-V227 HydrophobicContact CD1-CG2 4.19Å; F223-V227 HydrophobicContact CE1-CG2 3.67Å; F223-V227 HydrophobicContact CE2-CG2 4.26Å; F223-V227 HydrophobicContact CZ-CG2 3.68Å; F223-V227 WeakPolarHBondContact O-CG2 3.24Å; F223-V227 PolarHBondContact O-N 3.45Å; A224-V227 PolarHBondContact O-N 3.17Å; V227-V230 PolarHBondContact O-N 3.36Å; V227-T231 VanDerWaalsContact O-CB 3.32Å; V227-T231 WeakPolarHBondContact O-CB 3.37Å; V227-T231 PolarHBondContact O-N 2.75Å; V227-T231 PolarHBondContact O-OG1 3.08Å; V227-Y470 HydrophobicContact CG1-CE1 4.17Å
228	T	97	Very high	92.3	Very high	14 Å²	14	20.7 Å²	20.7	9%	0.086	11%	0.111	C	C	.	.	H	α-helix	trans	-61.7	-47.3	175.2	-52.2	0	0	0	0	110.9	A176 L179 T180 L183 A224 L225 Q226 T231 C232	A176-T228 PolarHBondContact O-OG1 3.47Å; L179-T228 HydrophobicContact CB-CG2 3.75Å; T180-T228 PolarHBondContact OG1-OG1 3.03Å; L183-T228 HydrophobicContact CD1-CG2 3.81Å; A224-T228 PolarHBondContact O-N 2.75Å; A224-T228 PolarHBondContact O-OG1 3.48Å; L225-T228 WeakPolarHBondContact O-CB 3.36Å; L225-T228 PolarHBondContact O-N 2.98Å; Q226-T228 VanDerWaalsContact C-N 3.29Å; Q226-T228 PolarHBondContact O-N 3.39Å; T228-T231 WeakPolarHBondContact O-CB 3.5Å; T228-T231 PolarHBondContact O-N 3.47Å; T228-C232 PolarHBondContact O-N 3.27Å
229	A	97	Very high	91.9	Very high	3 Å²	3	23 Å²	23	3%	0.025	13%	0.128	C	C	.	.	H	α-helix	trans	-65.4	-40.8	-179.9	0	0	0	0	0	112.1	L225 Q226 C232 Y233 L249 M250	L225-A229 WeakPolarHBondContact O-CB 3.15Å; L225-A229 PolarHBondContact O-N 3.44Å; Q226-A229 PolarHBondContact O-N 2.89Å; A229-C232 WeakPolarHBondContact O-CB 3.41Å; A229-C232 PolarHBondContact O-N 3.46Å; A229-Y233 WeakPolarHBondContact O-CB 3.23Å; A229-Y233 PolarHBondContact O-N 2.97Å; A229-L249 HydrophobicContact CB-CB 4.47Å; A229-L249 HydrophobicContact CB-CD2 3.89Å; A229-L249 HydrophobicContact CB-CG 4.06Å; A229-M250 HydrophobicContact CB-CG 3.63Å
230	V	96.9	Very high	91.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-44.9	173.3	173.9	0	0	0	0	110.8	Q226 V227 C232 Y233 L234 M250 L292 Y470	Q226-V230 WeakPolarHBondContact O-CG2 3.35Å; Q226-V230 PolarHBondContact O-N 3.43Å; V227-V230 PolarHBondContact O-N 3.36Å; V230-C232 VanDerWaalsContact C-N 3.27Å; V230-C232 PolarHBondContact O-N 2.82Å; V230-Y233 PolarHBondContact O-N 3.4Å; V230-L234 HydrophobicContact CG1-CD1 3.99Å; V230-L234 HydrophobicContact CG1-CG 4.24Å; V230-L234 WeakPolarHBondContact O-CG 3.35Å; V230-L234 PolarHBondContact O-N 3.09Å; V230-M250 HydrophobicContact CG2-CE 3.97Å; V230-M250 HydrophobicContact CG2-CG 4.04Å; V230-M250 HydrophobicContact CG2-SD 4.1Å; V230-L292 HydrophobicContact CG1-CD2 3.9Å; V230-L292 HydrophobicContact CG2-CD2 3.99Å; V230-Y470 HydrophobicContact CB-CE1 4.1Å; V230-Y470 HydrophobicContact CG1-CD1 4.12Å; V230-Y470 HydrophobicContact CG1-CD2 4.37Å; V230-Y470 HydrophobicContact CG1-CE1 3.67Å; V230-Y470 HydrophobicContact CG1-CE2 3.96Å; V230-Y470 HydrophobicContact CG1-CG 4.44Å
231	T	95.8	Very high	91.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.5	-40.4	177.1	-59.3	0	0	0	0	111.2	L183 L184 V227 T228 D467 N471	L183-T231 HydrophobicContact CB-CG2 4.4Å; L184-T231 HydrophobicContact CD2-CG2 3.92Å; L184-T231 HydrophobicContact CG-CG2 4.28Å; V227-T231 VanDerWaalsContact O-CB 3.32Å; V227-T231 WeakPolarHBondContact O-CB 3.37Å; V227-T231 PolarHBondContact O-N 2.75Å; V227-T231 PolarHBondContact O-OG1 3.08Å; T228-T231 WeakPolarHBondContact O-CB 3.5Å; T228-T231 PolarHBondContact O-N 3.47Å; T231-D467 HydrophobicContact CG2-CB 4.17Å; T231-N471 WeakPolarHBondContact CG2-ND2 3.49Å; T231-N471 PolarHBondContact OG1-ND2 2.97Å
232	C	94.5	Very high	90.8	Very high	18 Å²	18	34.3 Å²	34.3	12%	0.122	20%	0.196	C	C	.	.	H	α-helix	trans	-64.4	-51.1	173.2	-169	0	0	0	0	111.2	L183 T228 A229 V230 L234 R235 L238 M246	L183-C232 HydrophobicContact CD1-CB 4.18Å; T228-C232 PolarHBondContact O-N 3.27Å; A229-C232 WeakPolarHBondContact O-CB 3.41Å; A229-C232 PolarHBondContact O-N 3.46Å; V230-C232 VanDerWaalsContact C-N 3.27Å; V230-C232 PolarHBondContact O-N 2.82Å; C232-L234 VanDerWaalsContact C-N 3.26Å; C232-L234 PolarHBondContact O-N 3.42Å; C232-R235 VanDerWaalsContact O-CB 3.31Å; C232-R235 WeakPolarHBondContact O-CB 3.47Å; C232-R235 PolarHBondContact O-N 3.47Å; C232-L238 WeakPolarHBondContact O-CD1 3.27Å; C232-M246 HydrophobicContact CB-CG 4.44Å; C232-M246 HydrophobicContact CB-SD 3.79Å; C232-M246 VanDerWaalsContact SG-SD 3.66Å
233	Y	95	Very high	90.5	Very high	20 Å²	20	36.2 Å²	36.2	8%	0.078	21%	0.205	C	C	.	.	H	α-helix	trans	-57	-34.8	-179.1	176.2	-103.4	0	0	0	113.9	A229 V230 R235 M246 V247 M250 Q288	A229-Y233 WeakPolarHBondContact O-CB 3.23Å; A229-Y233 PolarHBondContact O-N 2.97Å; V230-Y233 PolarHBondContact O-N 3.4Å; Y233-R235 PolarHBondContact O-N 3.38Å; Y233-M246 HydrophobicContact CD2-CB 4.47Å; Y233-V247 HydrophobicContact CD2-CG2 4.08Å; Y233-V247 HydrophobicContact CE2-CG2 3.78Å; Y233-M250 HydrophobicContact CD1-SD 4.48Å; Y233-M250 HydrophobicContact CG-SD 4.13Å; Y233-Q288 HydrophobicContact CE1-CB 4.17Å; Y233-Q288 HydrophobicContact CE1-CG 3.87Å
234	L	91.9	Very high	90.3	Very high	2 Å²	2	43 Å²	43	1%	0.01	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-5.6	179.3	-68.9	-178.1	0	0	0	113.9	V230 C232 L284 L292 P466 D467 Y470	V230-L234 HydrophobicContact CG1-CD1 3.99Å; V230-L234 HydrophobicContact CG1-CG 4.24Å; V230-L234 WeakPolarHBondContact O-CG 3.35Å; V230-L234 PolarHBondContact O-N 3.09Å; C232-L234 VanDerWaalsContact C-N 3.26Å; C232-L234 PolarHBondContact O-N 3.42Å; L234-L284 HydrophobicContact CD1-CD2 4.35Å; L234-L284 HydrophobicContact CD2-CD2 3.41Å; L234-L284 VanDerWaalsContact CD2-CD2 3.41Å; L234-L284 HydrophobicContact CG-CD2 4.46Å; L234-L292 HydrophobicContact CD2-CD1 4.39Å; L234-P466 WeakPolarHBondContact O-CG 3.18Å; L234-D467 HydrophobicContact CB-CB 4.01Å; L234-Y470 HydrophobicContact CD1-CD1 4.42Å; L234-Y470 HydrophobicContact CD1-CD2 4.41Å; L234-Y470 HydrophobicContact CD1-CG 3.96Å
235	R	84.6	Confident	90.2	Very high	23 Å²	23	46 Å²	46	9%	0.087	25%	0.253	C	S	.	.	S	Bend	trans	-73.8	143	176.5	-75.2	173.5	148.9	-110.1	-4.4	112	D35 L183 C232 Y233 Q237	D35-R235 IonicContact OD1-NH1 3.65Å; D35-R235 PolarHBondContact OD1-NH1 3.02Å; L183-R235 PolarHBondContact O-NH2 2.86Å; C232-R235 VanDerWaalsContact O-CB 3.31Å; C232-R235 WeakPolarHBondContact O-CB 3.47Å; C232-R235 PolarHBondContact O-N 3.47Å; Y233-R235 PolarHBondContact O-N 3.38Å; R235-Q237 VanDerWaalsContact C-N 3.3Å; R235-Q237 PolarHBondContact O-N 2.82Å
236	P	67.3	Low	90	Very high	118 Å²	118	45.6 Å²	45.6	77%	0.766	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.2	-172.5	24.5	-32.2	0	0	0	115.6
237	Q	71.5	Confident	89.9	Confident	85 Å²	85	47.3 Å²	47.3	40%	0.397	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	42.4	-167.9	-60.5	-175	9.7	0	0	114.4	R235	R235-Q237 VanDerWaalsContact C-N 3.3Å; R235-Q237 PolarHBondContact O-N 2.82Å
238	L	81.4	Confident	89.9	Confident	18 Å²	18	55 Å²	55	9%	0.094	29%	0.289	C	S	.	.			trans	-93.8	134.3	176.1	-79.7	152.1	0	0	0	112.1	L38 C232 Q242 Q243 M246	L38-L238 HydrophobicContact CD2-CB 4.3Å; L38-L238 HydrophobicContact CD2-CD2 3.24Å; L38-L238 HydrophobicContact CD2-CG 3.6Å; C232-L238 WeakPolarHBondContact O-CD1 3.27Å; L238-Q242 HydrophobicContact CD2-CB 3.52Å; L238-Q243 HydrophobicContact CB-CG 3.61Å; L238-Q243 HydrophobicContact CD1-CG 4.39Å; L238-M246 HydrophobicContact CD2-CG 4.39Å
239	S	85.8	Confident	89.9	Confident	56 Å²	56	57.1 Å²	57.1	39%	0.392	30%	0.299	S	S	.	.			trans	-66.4	156.3	166.6	68.3	0	0	0	0	111.4	L241 Q242 Q243	S239-L241 PolarHBondContact O-N 2.94Å; S239-Q242 PolarHBondContact O-N 3.47Å; S239-Q242 VanDerWaalsContact O-N 3.09Å; S239-Q242 WeakPolarHBondContact OG-CB 3.5Å; S239-Q242 VanDerWaalsContact OG-CG 3.23Å; S239-Q242 WeakPolarHBondContact OG-CG 3.25Å; S239-Q242 PolarHBondContact OG-N 3.12Å; S239-Q242 PolarHBondContact OG-OE1 3.39Å; S239-Q243 WeakPolarHBondContact O-CG 3.38Å; S239-Q243 PolarHBondContact O-N 2.77Å
240	A	86.9	Confident	89.9	Confident	68 Å²	68	57 Å²	57	56%	0.562	30%	0.299	S	S	*	.	H	α-helix	trans	-58.3	-34.2	-179.5	0	0	0	0	0	113.3	K244	A240-K244 WeakPolarHBondContact O-CG 3.29Å; A240-K244 PolarHBondContact O-N 3.47Å
241	L	88.8	Confident	89.9	Confident	125 Å²	125	60.8 Å²	60.8	65%	0.654	31%	0.313	S	S	*	.	H	α-helix	trans	-67.7	-47.8	175.2	-179.1	63.7	0	0	0	111	S239 Q243 K244 V245	S239-L241 PolarHBondContact O-N 2.94Å; L241-Q243 VanDerWaalsContact C-N 3.29Å; L241-Q243 PolarHBondContact O-N 2.98Å; L241-K244 PolarHBondContact O-N 3.17Å; L241-K244 VanDerWaalsContact O-N 3.16Å; L241-V245 WeakPolarHBondContact O-CG2 3.18Å; L241-V245 PolarHBondContact O-N 3.31Å
242	Q	88.6	Confident	90	Very high	57 Å²	57	63 Å²	63	27%	0.266	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-38.7	178	-69.5	158.9	-28	0	0	111.4	L38 L238 S239 K244 V245 M246	L38-Q242 PolarHBondContact O-NE2 2.97Å; L38-Q242 VanDerWaalsContact O-NE2 3.15Å; L238-Q242 HydrophobicContact CD2-CB 3.52Å; S239-Q242 PolarHBondContact O-N 3.47Å; S239-Q242 VanDerWaalsContact O-N 3.09Å; S239-Q242 WeakPolarHBondContact OG-CB 3.5Å; S239-Q242 VanDerWaalsContact OG-CG 3.23Å; S239-Q242 WeakPolarHBondContact OG-CG 3.25Å; S239-Q242 PolarHBondContact OG-N 3.12Å; S239-Q242 PolarHBondContact OG-OE1 3.39Å; Q242-K244 PolarHBondContact O-N 3.14Å; Q242-V245 PolarHBondContact O-N 3.48Å; Q242-M246 VanDerWaalsContact O-CG 3.31Å; Q242-M246 WeakPolarHBondContact O-CG 3.39Å; Q242-M246 PolarHBondContact O-N 3.05Å
243	Q	90.5	Very high	90.2	Very high	83 Å²	83	62.3 Å²	62.3	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-58.7	-46.6	173.6	-70.1	-178.3	-9.8	0	0	111.8	L238 S239 L241 V245 M246 V247	L238-Q243 HydrophobicContact CB-CG 3.61Å; L238-Q243 HydrophobicContact CD1-CG 4.39Å; S239-Q243 WeakPolarHBondContact O-CG 3.38Å; S239-Q243 PolarHBondContact O-N 2.77Å; L241-Q243 VanDerWaalsContact C-N 3.29Å; L241-Q243 PolarHBondContact O-N 2.98Å; Q243-V245 PolarHBondContact O-N 2.87Å; Q243-M246 PolarHBondContact O-N 3.37Å; Q243-V247 WeakPolarHBondContact O-CG2 3.47Å; Q243-V247 PolarHBondContact O-N 3.5Å
244	K	92.6	Very high	90.3	Very high	153 Å²	153	61.4 Å²	61.4	67%	0.665	32%	0.318	S	S	*	.	H	α-helix	trans	-60.9	-43.3	176.7	-71.9	176.1	-178.3	-177.9	0	112	A240 L241 Q242 V247 W248	A240-K244 WeakPolarHBondContact O-CG 3.29Å; A240-K244 PolarHBondContact O-N 3.47Å; L241-K244 PolarHBondContact O-N 3.17Å; L241-K244 VanDerWaalsContact O-N 3.16Å; Q242-K244 PolarHBondContact O-N 3.14Å; K244-V247 PolarHBondContact O-N 3.43Å; K244-W248 WeakPolarHBondContact O-CB 3.37Å; K244-W248 PolarHBondContact O-N 3.47Å
245	V	94.5	Very high	90.5	Very high	72 Å²	72	62.2 Å²	62.2	44%	0.436	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-43.1	177.1	175.8	0	0	0	0	111	L241 Q242 Q243 W248 L249	L241-V245 WeakPolarHBondContact O-CG2 3.18Å; L241-V245 PolarHBondContact O-N 3.31Å; Q242-V245 PolarHBondContact O-N 3.48Å; Q243-V245 PolarHBondContact O-N 2.87Å; V245-W248 PolarHBondContact O-N 3.34Å; V245-L249 WeakPolarHBondContact O-CB 3.14Å; V245-L249 PolarHBondContact O-N 2.98Å
246	M	94.8	Very high	91	Very high	32 Å²	32	63 Å²	63	16%	0.158	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-43.4	177.1	-68.4	-57.5	97.4	0	0	111.9	C232 Y233 L238 Q242 Q243 W248 L249 M250	C232-M246 HydrophobicContact CB-CG 4.44Å; C232-M246 HydrophobicContact CB-SD 3.79Å; C232-M246 VanDerWaalsContact SG-SD 3.66Å; Y233-M246 HydrophobicContact CD2-CB 4.47Å; L238-M246 HydrophobicContact CD2-CG 4.39Å; Q242-M246 VanDerWaalsContact O-CG 3.31Å; Q242-M246 WeakPolarHBondContact O-CG 3.39Å; Q242-M246 PolarHBondContact O-N 3.05Å; Q243-M246 PolarHBondContact O-N 3.37Å; M246-W248 VanDerWaalsContact C-N 3.34Å; M246-W248 PolarHBondContact O-N 2.91Å; M246-L249 HydrophobicContact CE-CD2 4.34Å; M246-L249 PolarHBondContact O-N 3.39Å; M246-M250 WeakPolarHBondContact O-CB 3.26Å; M246-M250 WeakPolarHBondContact O-CG 3.45Å; M246-M250 PolarHBondContact O-N 2.86Å
247	V	95.9	Very high	92.4	Very high	40 Å²	40	57.4 Å²	57.4	24%	0.242	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-42	176.5	171.8	0	0	0	0	111.3	Y233 Q243 K244 M250 Y251 T291 V295	Y233-V247 HydrophobicContact CD2-CG2 4.08Å; Y233-V247 HydrophobicContact CE2-CG2 3.78Å; Q243-V247 WeakPolarHBondContact O-CG2 3.47Å; Q243-V247 PolarHBondContact O-N 3.5Å; K244-V247 PolarHBondContact O-N 3.43Å; V247-M250 PolarHBondContact O-N 3.36Å; V247-Y251 PolarHBondContact O-N 2.94Å; V247-T291 HydrophobicContact CG1-CG2 4.14Å; V247-T291 HydrophobicContact CG2-CG2 3.71Å; V247-V295 HydrophobicContact CG1-CG2 3.96Å
248	W	96.5	Very high	93.5	Very high	166 Å²	166	53.4 Å²	53.4	63%	0.629	28%	0.278	S	S	*	.	H	α-helix	trans	-62.9	-44.7	174.9	-180	86.3	0	0	0	111.8	K244 V245 M246 M250 Y251 V252	K244-W248 WeakPolarHBondContact O-CB 3.37Å; K244-W248 PolarHBondContact O-N 3.47Å; V245-W248 PolarHBondContact O-N 3.34Å; M246-W248 VanDerWaalsContact C-N 3.34Å; M246-W248 PolarHBondContact O-N 2.91Å; W248-M250 VanDerWaalsContact C-N 3.34Å; W248-M250 PolarHBondContact O-N 2.88Å; W248-Y251 WeakPolarHBondContact O-CB 3.43Å; W248-Y251 PolarHBondContact O-N 3.37Å; W248-Y251 VanDerWaalsContact O-N 3.16Å; W248-V252 HydrophobicContact CD2-CG2 3.99Å; W248-V252 HydrophobicContact CE3-CG2 4.3Å; W248-V252 HydrophobicContact CH2-CG2 4Å; W248-V252 HydrophobicContact CZ2-CG2 3.65Å; W248-V252 HydrophobicContact CZ3-CG2 4.31Å; W248-V252 WeakPolarHBondContact O-CG2 3.22Å; W248-V252 PolarHBondContact O-N 3.37Å
249	L	96.6	Very high	94.1	Very high	59 Å²	59	54.2 Å²	54.2	31%	0.309	28%	0.282	S	S	.	.	H	α-helix	trans	-61.9	-42.4	176.9	-178.2	62.4	0	0	0	111.5	A229 V245 M246 Y251 V252 T253	A229-L249 HydrophobicContact CB-CB 4.47Å; A229-L249 HydrophobicContact CB-CD2 3.89Å; A229-L249 HydrophobicContact CB-CG 4.06Å; V245-L249 WeakPolarHBondContact O-CB 3.14Å; V245-L249 PolarHBondContact O-N 2.98Å; M246-L249 HydrophobicContact CE-CD2 4.34Å; M246-L249 PolarHBondContact O-N 3.39Å; L249-Y251 VanDerWaalsContact C-N 3.31Å; L249-Y251 PolarHBondContact O-N 3.1Å; L249-V252 PolarHBondContact O-N 3.34Å; L249-T253 HydrophobicContact CD1-CG2 4.02Å; L249-T253 HydrophobicContact CG-CG2 4.39Å; L249-T253 WeakPolarHBondContact O-CB 3.48Å; L249-T253 VanDerWaalsContact O-CG2 3.31Å; L249-T253 WeakPolarHBondContact O-CG2 3.49Å; L249-T253 PolarHBondContact O-N 3.33Å; L249-T253 PolarHBondContact O-OG1 3.04Å
250	M	97.3	Very high	94.4	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-60	-41.5	174.3	-69.3	161.4	45.5	0	0	111.4	A229 V230 Y233 M246 V247 W248 T253 T254 L292 V295	A229-M250 HydrophobicContact CB-CG 3.63Å; V230-M250 HydrophobicContact CG2-CE 3.97Å; V230-M250 HydrophobicContact CG2-CG 4.04Å; V230-M250 HydrophobicContact CG2-SD 4.1Å; Y233-M250 HydrophobicContact CD1-SD 4.48Å; Y233-M250 HydrophobicContact CG-SD 4.13Å; M246-M250 WeakPolarHBondContact O-CB 3.26Å; M246-M250 WeakPolarHBondContact O-CG 3.45Å; M246-M250 PolarHBondContact O-N 2.86Å; V247-M250 PolarHBondContact O-N 3.36Å; W248-M250 VanDerWaalsContact C-N 3.34Å; W248-M250 PolarHBondContact O-N 2.88Å; M250-T253 WeakPolarHBondContact CA-OG1 3.48Å; M250-T253 PolarHBondContact O-OG1 3.21Å; M250-T254 WeakPolarHBondContact O-CB 3.03Å; M250-T254 PolarHBondContact O-N 2.94Å; M250-T254 PolarHBondContact O-OG1 3.37Å; M250-L292 HydrophobicContact CE-CD2 3.44Å; M250-L292 VanDerWaalsContact CE-CD2 3.44Å; M250-V295 HydrophobicContact CB-CG1 3.96Å; M250-V295 HydrophobicContact CE-CB 4.49Å; M250-V295 HydrophobicContact CE-CG1 4.44Å; M250-V295 HydrophobicContact CE-CG2 4.24Å
251	Y	97.8	Very high	94.7	Very high	79 Å²	79	49.6 Å²	49.6	31%	0.31	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-51.2	176.8	169.6	-98.7	0	0	0	112.3	V247 W248 L249 T253 T254 C255 S298 S302	V247-Y251 PolarHBondContact O-N 2.94Å; W248-Y251 WeakPolarHBondContact O-CB 3.43Å; W248-Y251 PolarHBondContact O-N 3.37Å; W248-Y251 VanDerWaalsContact O-N 3.16Å; L249-Y251 VanDerWaalsContact C-N 3.31Å; L249-Y251 PolarHBondContact O-N 3.1Å; Y251-T253 PolarHBondContact O-N 3.35Å; Y251-T254 PolarHBondContact O-N 3.04Å; Y251-C255 VanDerWaalsContact CE2-SG 3.56Å; Y251-C255 VanDerWaalsContact CZ-SG 3.52Å; Y251-C255 PolarHBondContact O-N 2.87Å; Y251-C255 PolarHBondContact O-SG 3.03Å; Y251-S298 WeakPolarHBondContact CD2-OG 3Å; Y251-S302 PolarHBondContact OH-OG 3.26Å
252	V	97.4	Very high	94.5	Very high	46 Å²	46	44.6 Å²	44.6	28%	0.279	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-48.1	-179.7	173.6	0	0	0	0	110.9	W248 L249 T254 C255 C256	W248-V252 HydrophobicContact CD2-CG2 3.99Å; W248-V252 HydrophobicContact CE3-CG2 4.3Å; W248-V252 HydrophobicContact CH2-CG2 4Å; W248-V252 HydrophobicContact CZ2-CG2 3.65Å; W248-V252 HydrophobicContact CZ3-CG2 4.31Å; W248-V252 WeakPolarHBondContact O-CG2 3.22Å; W248-V252 PolarHBondContact O-N 3.37Å; L249-V252 PolarHBondContact O-N 3.34Å; V252-T254 VanDerWaalsContact C-N 3.35Å; V252-T254 PolarHBondContact O-N 3.22Å; V252-C255 WeakPolarHBondContact O-CB 3.33Å; V252-C255 PolarHBondContact O-N 3.47Å; V252-C256 PolarHBondContact O-N 3.23Å; V252-C256 PolarHBondContact O-SG 2.93Å; V252-C256 VanDerWaalsContact O-SG 3.37Å
253	T	97.6	Very high	94.2	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-64.7	-37.7	179.1	52.4	0	0	0	0	112.2	L225 Q226 L249 M250 Y251 C256 F257	L225-T253 HydrophobicContact CB-CG2 3.75Å; L225-T253 HydrophobicContact CD1-CG2 4.41Å; Q226-T253 WeakPolarHBondContact CA-OG1 3.49Å; Q226-T253 WeakPolarHBondContact CB-OG1 3.43Å; L249-T253 HydrophobicContact CD1-CG2 4.02Å; L249-T253 HydrophobicContact CG-CG2 4.39Å; L249-T253 WeakPolarHBondContact O-CB 3.48Å; L249-T253 VanDerWaalsContact O-CG2 3.31Å; L249-T253 WeakPolarHBondContact O-CG2 3.49Å; L249-T253 PolarHBondContact O-N 3.33Å; L249-T253 PolarHBondContact O-OG1 3.04Å; M250-T253 WeakPolarHBondContact CA-OG1 3.48Å; M250-T253 PolarHBondContact O-OG1 3.21Å; Y251-T253 PolarHBondContact O-N 3.35Å; T253-C256 PolarHBondContact O-N 3.29Å; T253-F257 VanDerWaalsContact O-CB 3.27Å; T253-F257 WeakPolarHBondContact O-CB 3.36Å; T253-F257 PolarHBondContact O-N 3.04Å
254	T	97.3	Very high	94.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-41.8	172.7	-57.8	0	0	0	0	111.5	Q226 M250 Y251 V252 F257 C258 L268	Q226-T254 WeakPolarHBondContact CG-OG1 3.3Å; Q226-T254 PolarHBondContact NE2-OG1 2.9Å; M250-T254 WeakPolarHBondContact O-CB 3.03Å; M250-T254 PolarHBondContact O-N 2.94Å; M250-T254 PolarHBondContact O-OG1 3.37Å; Y251-T254 PolarHBondContact O-N 3.04Å; V252-T254 VanDerWaalsContact C-N 3.35Å; V252-T254 PolarHBondContact O-N 3.22Å; T254-F257 PolarHBondContact O-N 3.47Å; T254-C258 WeakPolarHBondContact O-CB 3.25Å; T254-C258 PolarHBondContact O-N 3.24Å; T254-C258 PolarHBondContact O-SG 3.35Å; T254-L268 HydrophobicContact CG2-CD1 4.41Å
255	C	96.2	Very high	94.1	Very high	20 Å²	20	34.4 Å²	34.4	14%	0.135	17%	0.17	C	C	.	.	H	α-helix	trans	-61.8	-49	176.1	-68.5	0	0	0	0	111.5	Y251 V252 F257 C258 L259	Y251-C255 VanDerWaalsContact CE2-SG 3.56Å; Y251-C255 VanDerWaalsContact CZ-SG 3.52Å; Y251-C255 PolarHBondContact O-N 2.87Å; Y251-C255 PolarHBondContact O-SG 3.03Å; V252-C255 WeakPolarHBondContact O-CB 3.33Å; V252-C255 PolarHBondContact O-N 3.47Å; C255-F257 VanDerWaalsContact C-N 3.33Å; C255-F257 PolarHBondContact O-N 3.06Å; C255-C258 PolarHBondContact O-N 3.47Å; C255-L259 VanDerWaalsContact O-CB 3.3Å; C255-L259 WeakPolarHBondContact O-CB 3.33Å; C255-L259 PolarHBondContact O-N 3.44Å
256	C	96.1	Very high	93.9	Very high	39 Å²	39	33.6 Å²	33.6	26%	0.264	16%	0.161	S	C	.	.	H	α-helix	trans	-60.8	-42.1	177.4	-66.7	0	0	0	0	111.8	F222 V252 T253 L259 T260	F222-C256 HydrophobicContact CB-CB 4.12Å; F222-C256 HydrophobicContact CD1-CB 3.66Å; F222-C256 HydrophobicContact CD2-CB 3.9Å; F222-C256 HydrophobicContact CE1-CB 4Å; F222-C256 HydrophobicContact CE2-CB 4.23Å; F222-C256 HydrophobicContact CG-CB 3.61Å; F222-C256 HydrophobicContact CZ-CB 4.28Å; V252-C256 PolarHBondContact O-N 3.23Å; V252-C256 PolarHBondContact O-SG 2.93Å; V252-C256 VanDerWaalsContact O-SG 3.37Å; T253-C256 PolarHBondContact O-N 3.29Å; C256-L259 PolarHBondContact O-N 2.83Å; C256-T260 WeakPolarHBondContact O-CB 3.32Å; C256-T260 WeakPolarHBondContact O-CG2 3.48Å; C256-T260 PolarHBondContact O-N 2.99Å; C256-T260 VanDerWaalsContact O-N 3.1Å; C256-T260 PolarHBondContact O-OG1 3.44Å
257	F	96.4	Very high	93.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-47	174.9	176.3	-120.5	0	0	0	112	S219 F222 F223 T253 T254 C255 T260 W261 N264 I267 L268	S219-F257 WeakPolarHBondContact O-CD2 3.3Å; F222-F257 HydrophobicContact CB-CB 4.25Å; F223-F257 HydrophobicContact CB-CD2 3.64Å; F223-F257 HydrophobicContact CB-CE2 3.71Å; F223-F257 HydrophobicContact CB-CG 4.16Å; F223-F257 HydrophobicContact CB-CZ 4.27Å; F223-F257 HydrophobicContact CD2-CD1 4.05Å; F223-F257 HydrophobicContact CD2-CD2 4.41Å; F223-F257 AromaticContact CD2-CE1 3.83Å; F223-F257 HydrophobicContact CD2-CE1 3.83Å; F223-F257 HydrophobicContact CD2-CE2 4.23Å; F223-F257 HydrophobicContact CD2-CG 4.33Å; F223-F257 AromaticContact CD2-CZ 3.94Å; F223-F257 HydrophobicContact CD2-CZ 3.94Å; F223-F257 HydrophobicContact CE2-CE1 4.46Å; F223-F257 HydrophobicContact CG-CD2 4.37Å; F223-F257 HydrophobicContact CG-CE2 4.11Å; F223-F257 HydrophobicContact CG-CZ 4.18Å; T253-F257 VanDerWaalsContact O-CB 3.27Å; T253-F257 WeakPolarHBondContact O-CB 3.36Å; T253-F257 PolarHBondContact O-N 3.04Å; T254-F257 PolarHBondContact O-N 3.47Å; C255-F257 VanDerWaalsContact C-N 3.33Å; C255-F257 PolarHBondContact O-N 3.06Å; F257-T260 PolarHBondContact O-OG1 2.93Å; F257-W261 AromaticContact CE2-CE3 3.63Å; F257-W261 HydrophobicContact CE2-CE3 3.63Å; F257-W261 HydrophobicContact CE2-CZ3 4.01Å; F257-W261 AromaticContact CZ-CE3 3.93Å; F257-W261 HydrophobicContact CZ-CE3 3.93Å; F257-W261 HydrophobicContact CZ-CZ3 4.1Å; F257-W261 PolarHBondContact O-N 2.8Å; F257-N264 HydrophobicContact CD1-CB 3.91Å; F257-N264 HydrophobicContact CE1-CB 3.55Å; F257-N264 HydrophobicContact CE2-CB 4.46Å; F257-N264 HydrophobicContact CZ-CB 3.85Å; F257-I267 HydrophobicContact CE1-CB 4.35Å; F257-I267 HydrophobicContact CZ-CB 3.96Å; F257-I267 HydrophobicContact CZ-CG1 4.36Å; F257-I267 HydrophobicContact CZ-CG2 4.12Å; F257-L268 HydrophobicContact CD1-CD2 4.11Å; F257-L268 HydrophobicContact CD1-CG 4.29Å; F257-L268 HydrophobicContact CE1-CD2 4Å; F257-L268 HydrophobicContact CE1-CG 3.96Å
258	C	94.4	Very high	93.9	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-68.4	-37.5	179.9	-65.4	0	0	0	0	112.7	T254 C255 N264 L268 V303	T254-C258 WeakPolarHBondContact O-CB 3.25Å; T254-C258 PolarHBondContact O-N 3.24Å; T254-C258 PolarHBondContact O-SG 3.35Å; C255-C258 PolarHBondContact O-N 3.47Å; C258-N264 PolarHBondContact O-ND2 3.37Å; C258-N264 PolarHBondContact SG-OD1 3.05Å; C258-N264 VanDerWaalsContact SG-OD1 3.37Å; C258-L268 VanDerWaalsContact SG-CD1 3.57Å; C258-V303 HydrophobicContact CB-CB 4.18Å; C258-V303 HydrophobicContact CB-CG1 4.38Å; C258-V303 HydrophobicContact CB-CG2 3.66Å
259	L	93.6	Very high	93.8	Very high	36 Å²	36	24.1 Å²	24.1	19%	0.188	12%	0.121	C	C	.	.	H	α-helix	trans	-68.6	-42	-177.7	-169.4	67.9	0	0	0	111.6	N136 Y138 C255 C256 V303 L306	N136-L259 PolarHBondContact ND2-O 3.3Å; Y138-L259 HydrophobicContact CD1-CD1 3.86Å; Y138-L259 HydrophobicContact CD1-CD2 4.36Å; Y138-L259 HydrophobicContact CD1-CG 4.35Å; Y138-L259 HydrophobicContact CD2-CD1 3.6Å; Y138-L259 HydrophobicContact CD2-CG 3.99Å; Y138-L259 HydrophobicContact CE1-CD1 4.18Å; Y138-L259 HydrophobicContact CE2-CD1 3.99Å; Y138-L259 HydrophobicContact CG-CD1 3.57Å; Y138-L259 HydrophobicContact CG-CD2 4.09Å; Y138-L259 HydrophobicContact CG-CG 3.76Å; C255-L259 VanDerWaalsContact O-CB 3.3Å; C255-L259 WeakPolarHBondContact O-CB 3.33Å; C255-L259 PolarHBondContact O-N 3.44Å; C256-L259 PolarHBondContact O-N 2.83Å; L259-V303 HydrophobicContact CB-CG2 4.13Å; L259-V303 HydrophobicContact CD1-CG1 4.21Å; L259-V303 HydrophobicContact CD1-CG2 4.39Å; L259-L306 HydrophobicContact CD1-CB 4.38Å; L259-L306 HydrophobicContact CD1-CD1 4.27Å
260	T	93.8	Very high	93.8	Very high	10 Å²	10	22.5 Å²	22.5	6%	0.061	11%	0.114	C	C	.	.	H	α-helix	trans	-81.9	-13.1	-172.2	52.3	0	0	0	0	114.4	Q139 R215 W218 S219 F222 C256 F257	Q139-T260 PolarHBondContact NE2-O 3.02Å; R215-T260 WeakPolarHBondContact CD-O 3.41Å; W218-T260 HydrophobicContact CB-CG2 4.43Å; S219-T260 WeakPolarHBondContact CA-OG1 3.16Å; S219-T260 VanDerWaalsContact CB-OG1 3.28Å; S219-T260 WeakPolarHBondContact CB-OG1 3.42Å; F222-T260 HydrophobicContact CE2-CG2 4.14Å; C256-T260 WeakPolarHBondContact O-CB 3.32Å; C256-T260 WeakPolarHBondContact O-CG2 3.48Å; C256-T260 PolarHBondContact O-N 2.99Å; C256-T260 VanDerWaalsContact O-N 3.1Å; C256-T260 PolarHBondContact O-OG1 3.44Å; F257-T260 PolarHBondContact O-OG1 2.93Å
261	W	92	Very high	93.8	Very high	17 Å²	17	22.5 Å²	22.5	6%	0.064	11%	0.114	C	C	.	.			trans	-146.3	126.8	-177.4	-172.3	28.2	0	0	0	114.2	R215 E216 S219 L220 F257 F263 N264 I267 I491	R215-W261 HydrophobicContact CB-CB 4.12Å; R215-W261 HydrophobicContact CB-CG 3.93Å; E216-W261 HydrophobicContact CB-CZ2 4.42Å; S219-W261 WeakPolarHBondContact OG-CB 3.5Å; S219-W261 VanDerWaalsContact OG-CE3 3.27Å; L220-W261 HydrophobicContact CD2-CZ3 4.34Å; F257-W261 AromaticContact CE2-CE3 3.63Å; F257-W261 HydrophobicContact CE2-CE3 3.63Å; F257-W261 HydrophobicContact CE2-CZ3 4.01Å; F257-W261 AromaticContact CZ-CE3 3.93Å; F257-W261 HydrophobicContact CZ-CE3 3.93Å; F257-W261 HydrophobicContact CZ-CZ3 4.1Å; F257-W261 PolarHBondContact O-N 2.8Å; W261-F263 HydrophobicContact CD2-CB 4.39Å; W261-F263 HydrophobicContact CZ2-CB 3.98Å; W261-F263 AromaticContact NE1-CD2 3.65Å; W261-F263 PolarHBondContact O-N 3.46Å; W261-N264 WeakPolarHBondContact O-CB 3.37Å; W261-N264 PolarHBondContact O-N 3.17Å; W261-N264 PolarHBondContact O-ND2 3.05Å; W261-I267 HydrophobicContact CH2-CG1 4.16Å; W261-I267 HydrophobicContact CZ3-CG1 3.87Å; W261-I491 HydrophobicContact CH2-CD1 4.15Å
262	Q	83.8	Confident	93.7	Very high	19 Å²	19	18.8 Å²	18.8	9%	0.089	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-32.7	179.9	64.5	-176.1	-7.9	0	0	115	N136 N264 H603 E605	N136-Q262 WeakPolarHBondContact OD1-CB 3.43Å; Q262-N264 VanDerWaalsContact C-N 3.27Å; Q262-N264 PolarHBondContact O-N 3.17Å; Q262-H603 PolarHBondContact OE1-CE1 2.98Å; Q262-E605 VanDerWaalsContact NE2-CD 3.32Å; Q262-E605 PolarHBondContact NE2-OE1 2.6Å
263	F	83.9	Confident	93.7	Very high	56 Å²	56	19.4 Å²	19.4	25%	0.246	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	7.3	-175.8	-62	-55.7	0	0	0	113.5	W261 Q265 F266 E605	W261-F263 HydrophobicContact CD2-CB 4.39Å; W261-F263 HydrophobicContact CZ2-CB 3.98Å; W261-F263 AromaticContact NE1-CD2 3.65Å; W261-F263 PolarHBondContact O-N 3.46Å; F263-Q265 PolarHBondContact O-N 3.11Å; F263-F266 HydrophobicContact CB-CD2 4.23Å; F263-F266 HydrophobicContact CD1-CD2 4.18Å; F263-F266 AromaticContact CD1-CE2 3.9Å; F263-F266 HydrophobicContact CD1-CE2 3.9Å; F263-F266 PolarHBondContact O-N 3.43Å; F263-F266 VanDerWaalsContact O-N 3.14Å; F263-E605 HydrophobicContact CE1-CG 4.43Å; F263-E605 HydrophobicContact CZ-CG 4.02Å; F263-E605 WeakPolarHBondContact CZ-OE1 3.16Å
264	N	90.9	Very high	93.7	Very high	11 Å²	11	19.1 Å²	19.1	6%	0.059	10%	0.099	C	C	.	.	H	α-helix	trans	-49.8	-35.2	178	74.3	76.8	0	0	0	112.6	F257 C258 W261 Q262 F266 I267 L268	F257-N264 HydrophobicContact CD1-CB 3.91Å; F257-N264 HydrophobicContact CE1-CB 3.55Å; F257-N264 HydrophobicContact CE2-CB 4.46Å; F257-N264 HydrophobicContact CZ-CB 3.85Å; C258-N264 PolarHBondContact O-ND2 3.37Å; C258-N264 PolarHBondContact SG-OD1 3.05Å; C258-N264 VanDerWaalsContact SG-OD1 3.37Å; W261-N264 WeakPolarHBondContact O-CB 3.37Å; W261-N264 PolarHBondContact O-N 3.17Å; W261-N264 PolarHBondContact O-ND2 3.05Å; Q262-N264 VanDerWaalsContact C-N 3.27Å; Q262-N264 PolarHBondContact O-N 3.17Å; N264-F266 PolarHBondContact O-N 2.81Å; N264-I267 PolarHBondContact O-N 3.26Å; N264-I267 VanDerWaalsContact O-N 3.08Å; N264-L268 PolarHBondContact O-N 2.94Å
265	Q	90	Very high	93.6	Very high	12 Å²	12	19.2 Å²	19.2	6%	0.056	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-31.1	-176	56	172.3	-32.6	0	0	113.5	F263 L269 S316 V318	F263-Q265 PolarHBondContact O-N 3.11Å; Q265-L269 WeakPolarHBondContact O-CB 3.31Å; Q265-L269 PolarHBondContact O-N 3.02Å; Q265-S316 VanDerWaalsContact OE1-CA 3.26Å; Q265-V318 HydrophobicContact CB-CG1 3.98Å
266	F	90.3	Very high	93.6	Very high	56 Å²	56	19.2 Å²	19.2	25%	0.246	10%	0.097	C	C	.	.	H	α-helix	trans	-75.8	-37.6	178.2	-62.9	-65.9	0	0	0	111.6	F263 N264 L269 V270 L317 I377	F263-F266 HydrophobicContact CB-CD2 4.23Å; F263-F266 HydrophobicContact CD1-CD2 4.18Å; F263-F266 AromaticContact CD1-CE2 3.9Å; F263-F266 HydrophobicContact CD1-CE2 3.9Å; F263-F266 PolarHBondContact O-N 3.43Å; F263-F266 VanDerWaalsContact O-N 3.14Å; N264-F266 PolarHBondContact O-N 2.81Å; F266-L269 WeakPolarHBondContact O-CB 3.42Å; F266-L269 PolarHBondContact O-N 3.06Å; F266-V270 WeakPolarHBondContact O-CG2 3.11Å; F266-V270 PolarHBondContact O-N 2.82Å; F266-V270 VanDerWaalsContact O-N 3.08Å; F266-L317 HydrophobicContact CE1-CD1 4.2Å; F266-I377 HydrophobicContact CE2-CD1 3.89Å; F266-I377 HydrophobicContact CZ-CD1 3.58Å; F266-I377 HydrophobicContact CZ-CG2 4.23Å
267	I	93.8	Very high	93.5	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-71.4	-39.9	177	-53.1	-50.9	0	0	0	110.4	F223 F257 W261 N264 L269 V270 Q271 Y478 I491	F223-I267 HydrophobicContact CD1-CG2 4.44Å; F223-I267 HydrophobicContact CD2-CG2 4.36Å; F223-I267 HydrophobicContact CE1-CG2 3.98Å; F223-I267 HydrophobicContact CE2-CG2 3.91Å; F223-I267 HydrophobicContact CZ-CG2 3.71Å; F257-I267 HydrophobicContact CE1-CB 4.35Å; F257-I267 HydrophobicContact CZ-CB 3.96Å; F257-I267 HydrophobicContact CZ-CG1 4.36Å; F257-I267 HydrophobicContact CZ-CG2 4.12Å; W261-I267 HydrophobicContact CH2-CG1 4.16Å; W261-I267 HydrophobicContact CZ3-CG1 3.87Å; N264-I267 PolarHBondContact O-N 3.26Å; N264-I267 VanDerWaalsContact O-N 3.08Å; I267-L269 VanDerWaalsContact C-N 3.32Å; I267-L269 PolarHBondContact O-N 3.49Å; I267-V270 PolarHBondContact O-N 2.9Å; I267-Q271 PolarHBondContact O-N 3.43Å; I267-Y478 HydrophobicContact CG2-CE1 4.38Å; I267-Y478 WeakPolarHBondContact CG2-OH 3.26Å; I267-I491 HydrophobicContact CD1-CD1 3.4Å; I267-I491 VanDerWaalsContact CD1-CD1 3.4Å; I267-I491 HydrophobicContact CG1-CD1 4.07Å
268	L	96	Very high	93.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-34	172.1	-67	-176.9	0	0	0	112.3	T254 F257 C258 N264 Q271 A272 Q296 L300 V318	T254-L268 HydrophobicContact CG2-CD1 4.41Å; F257-L268 HydrophobicContact CD1-CD2 4.11Å; F257-L268 HydrophobicContact CD1-CG 4.29Å; F257-L268 HydrophobicContact CE1-CD2 4Å; F257-L268 HydrophobicContact CE1-CG 3.96Å; C258-L268 VanDerWaalsContact SG-CD1 3.57Å; N264-L268 PolarHBondContact O-N 2.94Å; L268-Q271 PolarHBondContact O-N 2.99Å; L268-A272 VanDerWaalsContact O-CB 3.31Å; L268-A272 WeakPolarHBondContact O-CB 3.44Å; L268-A272 PolarHBondContact O-N 3.32Å; L268-Q296 HydrophobicContact CD2-CG 4.44Å; L268-L300 HydrophobicContact CD1-CD1 4.37Å; L268-L300 HydrophobicContact CD1-CD2 4.15Å; L268-L300 HydrophobicContact CD1-CG 4.23Å; L268-V318 HydrophobicContact CB-CG2 3.97Å
269	L	95.8	Very high	93.2	Very high	34 Å²	34	20.8 Å²	20.8	18%	0.178	10%	0.102	C	C	.	.	H	α-helix	trans	-61.8	-45.3	172.1	178.7	64.5	0	0	0	111.2	Q265 F266 I267 Q271 A272 L273 L317 V318 F321	Q265-L269 WeakPolarHBondContact O-CB 3.31Å; Q265-L269 PolarHBondContact O-N 3.02Å; F266-L269 WeakPolarHBondContact O-CB 3.42Å; F266-L269 PolarHBondContact O-N 3.06Å; I267-L269 VanDerWaalsContact C-N 3.32Å; I267-L269 PolarHBondContact O-N 3.49Å; L269-Q271 VanDerWaalsContact C-N 3.32Å; L269-Q271 PolarHBondContact O-N 3.37Å; L269-A272 PolarHBondContact O-N 3.32Å; L269-L273 HydrophobicContact CG-CD1 4.33Å; L269-L273 VanDerWaalsContact O-CG 3.31Å; L269-L273 WeakPolarHBondContact O-CG 3.46Å; L269-L273 PolarHBondContact O-N 3.29Å; L269-L317 HydrophobicContact CD2-CB 4.01Å; L269-L317 HydrophobicContact CD2-CD1 4.31Å; L269-V318 HydrophobicContact CB-CB 4.1Å; L269-F321 HydrophobicContact CD1-CB 3.94Å; L269-F321 HydrophobicContact CD1-CD1 4.31Å; L269-F321 HydrophobicContact CD1-CG 4.09Å
270	V	95.4	Very high	92.9	Very high	25 Å²	25	20.4 Å²	20.4	15%	0.152	10%	0.1	C	C	.	.	H	α-helix	trans	-59.5	-45.2	174.2	174.8	0	0	0	0	110.5	F266 I267 A272 L273 I274 L477 Y478	F266-V270 WeakPolarHBondContact O-CG2 3.11Å; F266-V270 PolarHBondContact O-N 2.82Å; F266-V270 VanDerWaalsContact O-N 3.08Å; I267-V270 PolarHBondContact O-N 2.9Å; V270-A272 PolarHBondContact O-N 3.06Å; V270-L273 WeakPolarHBondContact O-CB 3.44Å; V270-L273 PolarHBondContact O-N 2.76Å; V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.45Å; V270-I274 PolarHBondContact O-N 3.49Å; V270-L477 HydrophobicContact CG1-CB 3.82Å; V270-L477 HydrophobicContact CG1-CD1 3.89Å; V270-Y478 HydrophobicContact CB-CE1 4.31Å; V270-Y478 HydrophobicContact CG1-CD1 4.17Å; V270-Y478 HydrophobicContact CG1-CE1 3.78Å
271	Q	96.8	Very high	92.6	Very high	3 Å²	3	20.8 Å²	20.8	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-61.6	-41.3	175.8	-171.1	-178.4	30.9	0	0	112.5	Q226 I267 L268 L269 I274 V275 Q296 Y470	Q226-Q271 VanDerWaalsContact CD-NE2 3.35Å; Q226-Q271 VanDerWaalsContact NE2-NE2 3.18Å; I267-Q271 PolarHBondContact O-N 3.43Å; L268-Q271 PolarHBondContact O-N 2.99Å; L269-Q271 VanDerWaalsContact C-N 3.32Å; L269-Q271 PolarHBondContact O-N 3.37Å; Q271-I274 WeakPolarHBondContact O-CB 3.37Å; Q271-I274 PolarHBondContact O-N 3.02Å; Q271-V275 WeakPolarHBondContact O-CG2 3.12Å; Q271-V275 PolarHBondContact O-N 2.74Å; Q271-Q296 VanDerWaalsContact CD-NE2 3.29Å; Q271-Y470 HydrophobicContact CG-CE2 4.26Å; Q271-Y470 PolarHBondContact NE2-OH 3.46Å
272	A	97.2	Very high	92.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-40.3	176.5	0	0	0	0	0	111.5	L268 L269 V270 I274 V275 Y276 Y293 V318 F321 I322	L268-A272 VanDerWaalsContact O-CB 3.31Å; L268-A272 WeakPolarHBondContact O-CB 3.44Å; L268-A272 PolarHBondContact O-N 3.32Å; L269-A272 PolarHBondContact O-N 3.32Å; V270-A272 PolarHBondContact O-N 3.06Å; A272-I274 VanDerWaalsContact C-N 3.31Å; A272-I274 PolarHBondContact O-N 2.7Å; A272-V275 PolarHBondContact O-N 3.26Å; A272-Y276 WeakPolarHBondContact O-CB 3.37Å; A272-Y276 PolarHBondContact O-N 3.37Å; A272-Y293 HydrophobicContact CB-CE1 3.94Å; A272-Y293 PolarHBondContact O-OH 3.13Å; A272-V318 HydrophobicContact CB-CG2 4.32Å; A272-F321 HydrophobicContact CB-CD1 3.9Å; A272-F321 HydrophobicContact CB-CE1 4.01Å; A272-I322 HydrophobicContact CB-CD1 4.44Å; A272-I322 HydrophobicContact CB-CG1 4.14Å
273	L	96.7	Very high	92.6	Very high	59 Å²	59	22.1 Å²	22.1	31%	0.309	11%	0.111	S	C	.	.	H	α-helix	trans	-62.5	-37.3	172.9	-70.9	169	0	0	0	111.9	L269 V270 Y276 I277 F321	L269-L273 HydrophobicContact CG-CD1 4.33Å; L269-L273 VanDerWaalsContact O-CG 3.31Å; L269-L273 WeakPolarHBondContact O-CG 3.46Å; L269-L273 PolarHBondContact O-N 3.29Å; V270-L273 WeakPolarHBondContact O-CB 3.44Å; V270-L273 PolarHBondContact O-N 2.76Å; L273-Y276 WeakPolarHBondContact O-CB 3.4Å; L273-Y276 PolarHBondContact O-N 2.89Å; L273-I277 VanDerWaalsContact O-CG1 3.25Å; L273-I277 WeakPolarHBondContact O-CG1 3.33Å; L273-I277 PolarHBondContact O-N 3.28Å; L273-F321 HydrophobicContact CD2-CD2 4.5Å; L273-F321 HydrophobicContact CD2-CE1 4.23Å; L273-F321 HydrophobicContact CD2-CE2 3.79Å; L273-F321 HydrophobicContact CD2-CZ 3.64Å; L273-F321 HydrophobicContact CG-CZ 4.48Å
274	I	97.1	Very high	92.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.3	-47.9	174.4	-67.4	166.4	0	0	0	110.5	V270 Q271 A272 Y276 I277 L278 Y470 L473 H474 L477	V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.45Å; V270-I274 PolarHBondContact O-N 3.49Å; Q271-I274 WeakPolarHBondContact O-CB 3.37Å; Q271-I274 PolarHBondContact O-N 3.02Å; A272-I274 VanDerWaalsContact C-N 3.31Å; A272-I274 PolarHBondContact O-N 2.7Å; I274-Y276 VanDerWaalsContact C-N 3.27Å; I274-Y276 PolarHBondContact O-N 3.23Å; I274-I277 PolarHBondContact O-N 2.87Å; I274-L278 HydrophobicContact CG2-CD1 4Å; I274-L278 HydrophobicContact CG2-CG 4.39Å; I274-L278 WeakPolarHBondContact O-CB 3.35Å; I274-L278 VanDerWaalsContact O-CG 3.28Å; I274-L278 WeakPolarHBondContact O-CG 3.46Å; I274-L278 PolarHBondContact O-N 3.46Å; I274-Y470 HydrophobicContact CG2-CD2 3.68Å; I274-Y470 HydrophobicContact CG2-CE2 4.16Å; I274-L473 HydrophobicContact CB-CB 4.45Å; I274-L473 HydrophobicContact CD1-CB 4.4Å; I274-L473 HydrophobicContact CG1-CB 3.98Å; I274-L473 HydrophobicContact CG2-CB 3.8Å; I274-L473 HydrophobicContact CG2-CD1 3.97Å; I274-H474 HydrophobicContact CD1-CB 4.06Å; I274-H474 VanDerWaalsContact CD1-CE1 3.44Å; I274-H474 WeakPolarHBondContact CD1-CE1 3.48Å; I274-H474 WeakPolarHBondContact CD1-ND1 3.23Å; I274-L477 HydrophobicContact CD1-CD1 4.04Å; I274-L477 HydrophobicContact CG1-CD1 3.49Å; I274-L477 VanDerWaalsContact CG1-CD1 3.49Å
275	V	96.6	Very high	92.8	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-41.2	176.5	175.3	0	0	0	0	110.8	Q271 A272 L278 D279 L284 V289 L292 Y293	Q271-V275 WeakPolarHBondContact O-CG2 3.12Å; Q271-V275 PolarHBondContact O-N 2.74Å; A272-V275 PolarHBondContact O-N 3.26Å; V275-L278 PolarHBondContact O-N 3.29Å; V275-D279 WeakPolarHBondContact O-CB 3.48Å; V275-D279 PolarHBondContact O-N 3.19Å; V275-L284 HydrophobicContact CG1-CD1 4.36Å; V275-V289 HydrophobicContact CG1-CB 4.43Å; V275-V289 HydrophobicContact CG1-CG1 4.04Å; V275-V289 HydrophobicContact CG1-CG2 4.37Å; V275-L292 HydrophobicContact CG1-CB 4.36Å; V275-L292 HydrophobicContact CG1-CD1 4.14Å; V275-L292 HydrophobicContact CG2-CB 4.3Å; V275-L292 HydrophobicContact CG2-CD1 3.83Å; V275-Y293 HydrophobicContact CB-CE1 4.13Å; V275-Y293 HydrophobicContact CG1-CE1 4.03Å; V275-Y293 HydrophobicContact CG1-CE2 4.18Å
276	Y	95.2	Very high	92.7	Very high	20 Å²	20	25.4 Å²	25.4	8%	0.078	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-45.9	175.4	-176.9	-108.2	0	0	0	113	A272 L273 I274 L278 D279 I280 Y293 F321 A325 H350 S351 V354	A272-Y276 WeakPolarHBondContact O-CB 3.37Å; A272-Y276 PolarHBondContact O-N 3.37Å; L273-Y276 WeakPolarHBondContact O-CB 3.4Å; L273-Y276 PolarHBondContact O-N 2.89Å; I274-Y276 VanDerWaalsContact C-N 3.27Å; I274-Y276 PolarHBondContact O-N 3.23Å; Y276-L278 VanDerWaalsContact C-N 3.34Å; Y276-L278 PolarHBondContact O-N 3.45Å; Y276-D279 PolarHBondContact O-N 3.39Å; Y276-I280 HydrophobicContact CD1-CD1 3.72Å; Y276-I280 HydrophobicContact CE1-CD1 3.17Å; Y276-I280 HydrophobicContact CE1-CG1 4.32Å; Y276-I280 HydrophobicContact CE2-CD1 4.06Å; Y276-I280 HydrophobicContact CE2-CG1 4.47Å; Y276-I280 HydrophobicContact CG-CD1 4.36Å; Y276-I280 PolarHBondContact O-N 3.16Å; Y276-Y293 WeakPolarHBondContact CA-OH 3.45Å; Y276-Y293 WeakPolarHBondContact CB-OH 3.47Å; Y276-Y293 PolarHBondContact N-OH 2.95Å; Y276-F321 HydrophobicContact CD1-CZ 4.17Å; Y276-F321 HydrophobicContact CD2-CZ 4.19Å; Y276-F321 AromaticContact CG-CZ 3.81Å; Y276-F321 HydrophobicContact CG-CZ 3.81Å; Y276-A325 HydrophobicContact CD2-CB 4.46Å; Y276-H350 PolarHBondContact OH-CD2 3.32Å; Y276-S351 WeakPolarHBondContact OH-CA 3.37Å; Y276-S351 WeakPolarHBondContact OH-CB 3.4Å; Y276-S351 PolarHBondContact OH-OG 2.97Å; Y276-V354 HydrophobicContact CE2-CG1 4.34Å; Y276-V354 HydrophobicContact CE2-CG2 4.18Å
277	I	93.8	Very high	92.7	Very high	64 Å²	64	27.3 Å²	27.3	33%	0.328	15%	0.153	S	C	.	.	H	α-helix	trans	-59.9	-47.5	176.3	-70.1	163.3	0	0	0	109.9	L273 I274 D279 I280 V281 L473	L273-I277 VanDerWaalsContact O-CG1 3.25Å; L273-I277 WeakPolarHBondContact O-CG1 3.33Å; L273-I277 PolarHBondContact O-N 3.28Å; I274-I277 PolarHBondContact O-N 2.87Å; I277-D279 VanDerWaalsContact C-N 3.27Å; I277-D279 PolarHBondContact O-N 2.98Å; I277-I280 PolarHBondContact O-N 3.32Å; I277-V281 WeakPolarHBondContact O-CG1 3.28Å; I277-V281 WeakPolarHBondContact O-CG2 3.5Å; I277-V281 PolarHBondContact O-N 3.24Å; I277-V281 VanDerWaalsContact O-N 3.15Å; I277-L473 HydrophobicContact CB-CD1 4.21Å; I277-L473 HydrophobicContact CG2-CD1 3.77Å; I277-L473 HydrophobicContact CG2-CD2 4.35Å
278	L	92.8	Very high	92.7	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63.8	-31.3	-179.6	-69	175.7	0	0	0	113.5	I274 V275 Y276 V281 L283 L284 A469 Y470 L473	I274-L278 HydrophobicContact CG2-CD1 4Å; I274-L278 HydrophobicContact CG2-CG 4.39Å; I274-L278 WeakPolarHBondContact O-CB 3.35Å; I274-L278 VanDerWaalsContact O-CG 3.28Å; I274-L278 WeakPolarHBondContact O-CG 3.46Å; I274-L278 PolarHBondContact O-N 3.46Å; V275-L278 PolarHBondContact O-N 3.29Å; Y276-L278 VanDerWaalsContact C-N 3.34Å; Y276-L278 PolarHBondContact O-N 3.45Å; L278-V281 WeakPolarHBondContact O-CG2 3.07Å; L278-L283 HydrophobicContact CD2-CB 4.35Å; L278-L283 HydrophobicContact CD2-CD1 3.96Å; L278-L283 PolarHBondContact O-N 3.34Å; L278-L284 HydrophobicContact CB-CD1 3.58Å; L278-L284 HydrophobicContact CB-CG 3.77Å; L278-L284 HydrophobicContact CD1-CD1 3.88Å; L278-L284 HydrophobicContact CD1-CG 4.32Å; L278-L284 HydrophobicContact CG-CD1 4.4Å; L278-L284 PolarHBondContact O-N 3.38Å; L278-A469 HydrophobicContact CD2-CB 3.52Å; L278-Y470 HydrophobicContact CD1-CD2 4.23Å; L278-L473 HydrophobicContact CD2-CD1 3.61Å; L278-L473 HydrophobicContact CG-CD1 3.77Å
279	D	91	Very high	92.6	Very high	9 Å²	9	28.6 Å²	28.6	5%	0.048	16%	0.159	C	C	.	.	H	α-helix	trans	-70.5	-46.5	174.6	-178.7	39	0	0	0	112	V275 Y276 I277 V281 D282 V289 R329	V275-D279 WeakPolarHBondContact O-CB 3.48Å; V275-D279 PolarHBondContact O-N 3.19Å; Y276-D279 PolarHBondContact O-N 3.39Å; I277-D279 VanDerWaalsContact C-N 3.27Å; I277-D279 PolarHBondContact O-N 2.98Å; D279-V281 VanDerWaalsContact C-N 3.27Å; D279-V281 PolarHBondContact O-N 3.29Å; D279-D282 PolarHBondContact O-N 3.05Å; D279-D282 VanDerWaalsContact O-N 3.16Å; D279-V289 HydrophobicContact CB-CG1 4.34Å; D279-V289 HydrophobicContact CB-CG2 3.75Å; D279-R329 IonicContact OD1-CZ 3.33Å; D279-R329 IonicContact OD1-NH1 3.54Å; D279-R329 PolarHBondContact OD1-NH1 3.41Å; D279-R329 IonicContact OD1-NH2 3.83Å; D279-R329 PolarHBondContact OD1-NH2 2.99Å; D279-R329 IonicContact OD2-CZ 3.98Å; D279-R329 IonicContact OD2-NH1 2.7Å; D279-R329 PolarHBondContact OD2-NH1 3.32Å; D279-R329 IonicContact OD2-NH2 3.32Å
280	I	88.7	Confident	92.5	Very high	28 Å²	28	29.2 Å²	29.2	14%	0.144	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-39.1	177.2	-76	168	0	0	0	112.1	Y276 I277 D282 V347	Y276-I280 HydrophobicContact CD1-CD1 3.72Å; Y276-I280 HydrophobicContact CE1-CD1 3.17Å; Y276-I280 HydrophobicContact CE1-CG1 4.32Å; Y276-I280 HydrophobicContact CE2-CD1 4.06Å; Y276-I280 HydrophobicContact CE2-CG1 4.47Å; Y276-I280 HydrophobicContact CG-CD1 4.36Å; Y276-I280 PolarHBondContact O-N 3.16Å; I277-I280 PolarHBondContact O-N 3.32Å; I280-D282 PolarHBondContact O-N 3.36Å; I280-V347 HydrophobicContact CD1-CG1 4.25Å; I280-V347 HydrophobicContact CG1-CG1 4.39Å; I280-V347 HydrophobicContact CG2-CB 4.32Å; I280-V347 HydrophobicContact CG2-CG1 3.34Å; I280-V347 HydrophobicContact CG2-CG2 3.94Å
281	V	87.4	Confident	92.5	Very high	18 Å²	18	29.7 Å²	29.7	11%	0.109	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	8.4	-177.2	-57	0	0	0	0	113.8	I277 L278 D279 L283 V439 N442	I277-V281 WeakPolarHBondContact O-CG1 3.28Å; I277-V281 WeakPolarHBondContact O-CG2 3.5Å; I277-V281 PolarHBondContact O-N 3.24Å; I277-V281 VanDerWaalsContact O-N 3.15Å; L278-V281 WeakPolarHBondContact O-CG2 3.07Å; D279-V281 VanDerWaalsContact C-N 3.27Å; D279-V281 PolarHBondContact O-N 3.29Å; V281-L283 VanDerWaalsContact C-N 3.27Å; V281-L283 HydrophobicContact CG2-CB 4.11Å; V281-L283 HydrophobicContact CG2-CD1 3.71Å; V281-L283 HydrophobicContact CG2-CG 3.78Å; V281-L283 PolarHBondContact O-N 3.39Å; V281-V439 HydrophobicContact CB-CG1 4.37Å; V281-V439 HydrophobicContact CB-CG2 3.87Å; V281-V439 HydrophobicContact CG1-CG1 3.97Å; V281-V439 HydrophobicContact CG1-CG2 3.8Å; V281-V439 HydrophobicContact CG2-CG2 4.44Å; V281-N442 PolarHBondContact O-ND2 3.49Å
282	D	87.4	Confident	92.5	Very high	43 Å²	43	29.9 Å²	29.9	23%	0.23	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	29.8	179.6	-75.1	-17.5	0	0	0	115	D279 I280 K336 R343	D279-D282 PolarHBondContact O-N 3.05Å; D279-D282 VanDerWaalsContact O-N 3.16Å; I280-D282 PolarHBondContact O-N 3.36Å; D282-K336 WeakPolarHBondContact OD1-CD 3.36Å; D282-K336 WeakPolarHBondContact OD1-CE 3.21Å; D282-K336 IonicContact OD1-NZ 3.62Å; D282-K336 PolarHBondContact OD1-NZ 3.29Å; D282-K336 IonicContact OD2-NZ 3.63Å; D282-R343 IonicContact OD1-NH2 3.87Å; D282-R343 IonicContact OD2-CZ 3.05Å; D282-R343 IonicContact OD2-NH1 3.17Å; D282-R343 IonicContact OD2-NH2 3.93Å; D282-R343 PolarHBondContact OD2-NH2 3.3Å
283	L	87.8	Confident	92.5	Very high	21 Å²	21	30 Å²	30	11%	0.11	17%	0.169	C	C	.	.			trans	-89.1	-23.1	174.3	-73.4	174.9	0	0	0	113.1	L278 V281 L435 F464 A469	L278-L283 HydrophobicContact CD2-CB 4.35Å; L278-L283 HydrophobicContact CD2-CD1 3.96Å; L278-L283 PolarHBondContact O-N 3.34Å; V281-L283 VanDerWaalsContact C-N 3.27Å; V281-L283 HydrophobicContact CG2-CB 4.11Å; V281-L283 HydrophobicContact CG2-CD1 3.71Å; V281-L283 HydrophobicContact CG2-CG 3.78Å; V281-L283 PolarHBondContact O-N 3.39Å; L283-L435 HydrophobicContact CD1-CD1 3.44Å; L283-L435 VanDerWaalsContact CD1-CD1 3.44Å; L283-F464 HydrophobicContact CD2-CB 4.31Å; L283-A469 HydrophobicContact CD1-CB 3.84Å
284	L	90.2	Very high	92.5	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.026	18%	0.178	C	C	.	.	S	Bend	trans	-109.5	148.3	176.1	-64.9	179.3	0	0	0	112.4	L234 V275 L278 V289 L292 P466	L234-L284 HydrophobicContact CD1-CD2 4.35Å; L234-L284 HydrophobicContact CD2-CD2 3.41Å; L234-L284 VanDerWaalsContact CD2-CD2 3.41Å; L234-L284 HydrophobicContact CG-CD2 4.46Å; V275-L284 HydrophobicContact CG1-CD1 4.36Å; L278-L284 HydrophobicContact CB-CD1 3.58Å; L278-L284 HydrophobicContact CB-CG 3.77Å; L278-L284 HydrophobicContact CD1-CD1 3.88Å; L278-L284 HydrophobicContact CD1-CG 4.32Å; L278-L284 HydrophobicContact CG-CD1 4.4Å; L278-L284 PolarHBondContact O-N 3.38Å; L284-V289 HydrophobicContact CB-CG2 3.63Å; L284-V289 HydrophobicContact CD1-CG2 4.08Å; L284-L292 HydrophobicContact CD1-CD1 4.26Å; L284-P466 HydrophobicContact CD2-CB 3.93Å
285	T	88.8	Confident	92.4	Very high	70 Å²	70	32.1 Å²	32.1	43%	0.429	18%	0.181	S	C	.	.			trans	-79.3	154.7	170.8	63	0	0	0	0	110.9	T287 Q288 V289	T285-T287 PolarHBondContact O-N 3.48Å; T285-T287 PolarHBondContact OG1-OG1 2.88Å; T285-Q288 PolarHBondContact O-N 3.31Å; T285-Q288 VanDerWaalsContact O-N 3.14Å; T285-Q288 WeakPolarHBondContact OG1-CB 3.39Å; T285-Q288 WeakPolarHBondContact OG1-CG 3.45Å; T285-Q288 PolarHBondContact OG1-N 2.69Å; T285-Q288 PolarHBondContact OG1-OE1 3.16Å; T285-V289 WeakPolarHBondContact O-CG2 3.43Å; T285-V289 PolarHBondContact O-N 3.29Å
286	T	88.7	Confident	92.4	Very high	72 Å²	72	32.3 Å²	32.3	44%	0.442	18%	0.181	S	C	.	.	H	α-helix	trans	-57	-36.5	178	-58	0	0	0	0	112.9	T290 R329	T286-T290 WeakPolarHBondContact O-CB 3.31Å; T286-T290 PolarHBondContact O-N 3.03Å; T286-T290 PolarHBondContact O-OG1 3.38Å; T286-R329 PolarHBondContact OG1-NH2 3.15Å
287	T	89.9	Confident	92.5	Very high	96 Å²	96	32.4 Å²	32.4	59%	0.589	18%	0.184	S	C	*	.	H	α-helix	trans	-67.5	-43.3	178.1	49.1	0	0	0	0	111.4	T285 T291	T285-T287 PolarHBondContact O-N 3.48Å; T285-T287 PolarHBondContact OG1-OG1 2.88Å; T287-T291 VanDerWaalsContact O-CB 3.3Å; T287-T291 WeakPolarHBondContact O-CB 3.4Å; T287-T291 PolarHBondContact O-N 3.27Å; T287-T291 PolarHBondContact O-OG1 3.37Å
288	Q	92.8	Very high	92.6	Very high	32 Å²	32	31.4 Å²	31.4	15%	0.15	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-48.6	175.7	-73.2	166.9	-40.7	0	0	111.5	Y233 T285 T290 T291 L292	Y233-Q288 HydrophobicContact CE1-CB 4.17Å; Y233-Q288 HydrophobicContact CE1-CG 3.87Å; T285-Q288 PolarHBondContact O-N 3.31Å; T285-Q288 VanDerWaalsContact O-N 3.14Å; T285-Q288 WeakPolarHBondContact OG1-CB 3.39Å; T285-Q288 WeakPolarHBondContact OG1-CG 3.45Å; T285-Q288 PolarHBondContact OG1-N 2.69Å; T285-Q288 PolarHBondContact OG1-OE1 3.16Å; Q288-T290 PolarHBondContact O-N 3.36Å; Q288-T291 PolarHBondContact O-N 3.22Å; Q288-L292 VanDerWaalsContact O-CG 3.26Å; Q288-L292 WeakPolarHBondContact O-CG 3.5Å; Q288-L292 PolarHBondContact O-N 3.01Å
289	V	93.9	Very high	92.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.2	-49.4	179.2	173.6	0	0	0	0	111.1	V275 D279 L284 T285 T291 L292 Y293	V275-V289 HydrophobicContact CG1-CB 4.43Å; V275-V289 HydrophobicContact CG1-CG1 4.04Å; V275-V289 HydrophobicContact CG1-CG2 4.37Å; D279-V289 HydrophobicContact CB-CG1 4.34Å; D279-V289 HydrophobicContact CB-CG2 3.75Å; L284-V289 HydrophobicContact CB-CG2 3.63Å; L284-V289 HydrophobicContact CD1-CG2 4.08Å; T285-V289 WeakPolarHBondContact O-CG2 3.43Å; T285-V289 PolarHBondContact O-N 3.29Å; V289-T291 VanDerWaalsContact C-N 3.33Å; V289-T291 PolarHBondContact O-N 3Å; V289-L292 PolarHBondContact O-N 3.49Å; V289-Y293 HydrophobicContact CG1-CD2 3.75Å; V289-Y293 HydrophobicContact CG1-CE2 3.49Å; V289-Y293 VanDerWaalsContact CG1-CE2 3.49Å; V289-Y293 WeakPolarHBondContact O-CD2 3.49Å; V289-Y293 PolarHBondContact O-N 3.42Å
290	T	94.3	Very high	92.9	Very high	46 Å²	46	31.1 Å²	31.1	28%	0.282	18%	0.181	S	C	.	.	H	α-helix	trans	-62.7	-42	179.7	-51.1	0	0	0	0	111	T286 Q288 Y293 L294 L326	T286-T290 WeakPolarHBondContact O-CB 3.31Å; T286-T290 PolarHBondContact O-N 3.03Å; T286-T290 PolarHBondContact O-OG1 3.38Å; Q288-T290 PolarHBondContact O-N 3.36Å; T290-Y293 PolarHBondContact O-N 3.25Å; T290-L294 HydrophobicContact CG2-CD1 3.91Å; T290-L294 HydrophobicContact CG2-CG 4.24Å; T290-L294 WeakPolarHBondContact O-CB 3.45Å; T290-L294 VanDerWaalsContact O-CG 3.23Å; T290-L294 WeakPolarHBondContact O-CG 3.28Å; T290-L294 PolarHBondContact O-N 3.34Å; T290-L326 HydrophobicContact CG2-CD2 4.42Å
291	T	95.5	Very high	93.1	Very high	35 Å²	35	33.1 Å²	33.1	22%	0.215	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-46.3	178.2	-57.1	0	0	0	0	111.5	V247 T287 Q288 V289 Y293 L294 V295	V247-T291 HydrophobicContact CG1-CG2 4.14Å; V247-T291 HydrophobicContact CG2-CG2 3.71Å; T287-T291 VanDerWaalsContact O-CB 3.3Å; T287-T291 WeakPolarHBondContact O-CB 3.4Å; T287-T291 PolarHBondContact O-N 3.27Å; T287-T291 PolarHBondContact O-OG1 3.37Å; Q288-T291 PolarHBondContact O-N 3.22Å; V289-T291 VanDerWaalsContact C-N 3.33Å; V289-T291 PolarHBondContact O-N 3Å; T291-Y293 PolarHBondContact O-N 3Å; T291-L294 PolarHBondContact O-N 3.19Å; T291-V295 VanDerWaalsContact O-CG2 3.31Å; T291-V295 WeakPolarHBondContact O-CG2 3.44Å; T291-V295 PolarHBondContact O-N 2.84Å
292	L	96.4	Very high	93.5	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-44.6	178.8	-70	169.5	0	0	0	111.7	V230 L234 M250 V275 L284 Q288 V289 V295 Q296	V230-L292 HydrophobicContact CG1-CD2 3.9Å; V230-L292 HydrophobicContact CG2-CD2 3.99Å; L234-L292 HydrophobicContact CD2-CD1 4.39Å; M250-L292 HydrophobicContact CE-CD2 3.44Å; M250-L292 VanDerWaalsContact CE-CD2 3.44Å; V275-L292 HydrophobicContact CG1-CB 4.36Å; V275-L292 HydrophobicContact CG1-CD1 4.14Å; V275-L292 HydrophobicContact CG2-CB 4.3Å; V275-L292 HydrophobicContact CG2-CD1 3.83Å; L284-L292 HydrophobicContact CD1-CD1 4.26Å; Q288-L292 VanDerWaalsContact O-CG 3.26Å; Q288-L292 WeakPolarHBondContact O-CG 3.5Å; Q288-L292 PolarHBondContact O-N 3.01Å; V289-L292 PolarHBondContact O-N 3.49Å; L292-V295 PolarHBondContact O-N 3.34Å; L292-Q296 PolarHBondContact O-N 3.33Å
293	Y	97.1	Very high	93.8	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-66.5	-43.5	176.5	-76.3	-35.8	0	0	0	113.3	A272 V275 Y276 V289 T290 T291 V295 Q296 V297 I322 A325 L326	A272-Y293 HydrophobicContact CB-CE1 3.94Å; A272-Y293 PolarHBondContact O-OH 3.13Å; V275-Y293 HydrophobicContact CB-CE1 4.13Å; V275-Y293 HydrophobicContact CG1-CE1 4.03Å; V275-Y293 HydrophobicContact CG1-CE2 4.18Å; Y276-Y293 WeakPolarHBondContact CA-OH 3.45Å; Y276-Y293 WeakPolarHBondContact CB-OH 3.47Å; Y276-Y293 PolarHBondContact N-OH 2.95Å; V289-Y293 HydrophobicContact CG1-CD2 3.75Å; V289-Y293 HydrophobicContact CG1-CE2 3.49Å; V289-Y293 VanDerWaalsContact CG1-CE2 3.49Å; V289-Y293 WeakPolarHBondContact O-CD2 3.49Å; V289-Y293 PolarHBondContact O-N 3.42Å; T290-Y293 PolarHBondContact O-N 3.25Å; T291-Y293 PolarHBondContact O-N 3Å; Y293-V295 VanDerWaalsContact C-N 3.29Å; Y293-V295 PolarHBondContact O-N 3.19Å; Y293-Q296 PolarHBondContact O-N 3.01Å; Y293-V297 WeakPolarHBondContact O-CG2 3.3Å; Y293-V297 PolarHBondContact O-N 2.92Å; Y293-I322 HydrophobicContact CD1-CB 4.31Å; Y293-I322 HydrophobicContact CD1-CD1 4.08Å; Y293-I322 HydrophobicContact CD1-CG1 3.68Å; Y293-I322 HydrophobicContact CD1-CG2 3.84Å; Y293-I322 HydrophobicContact CD2-CG2 4.47Å; Y293-I322 HydrophobicContact CE1-CG1 4.02Å; Y293-I322 HydrophobicContact CG-CG1 4.45Å; Y293-I322 HydrophobicContact CG-CG2 3.73Å; Y293-A325 HydrophobicContact CE2-CB 4.38Å; Y293-L326 HydrophobicContact CD2-CD2 3.78Å; Y293-L326 HydrophobicContact CD2-CG 4.13Å
294	L	96.1	Very high	94	Very high	95 Å²	95	34.2 Å²	34.2	50%	0.497	19%	0.194	S	C	.	.	H	α-helix	trans	-63.5	-35.7	177.6	-73.2	177.5	0	0	0	112.1	T290 T291 S298	T290-L294 HydrophobicContact CG2-CD1 3.91Å; T290-L294 HydrophobicContact CG2-CG 4.24Å; T290-L294 WeakPolarHBondContact O-CB 3.45Å; T290-L294 VanDerWaalsContact O-CG 3.23Å; T290-L294 WeakPolarHBondContact O-CG 3.28Å; T290-L294 PolarHBondContact O-N 3.34Å; T291-L294 PolarHBondContact O-N 3.19Å; L294-S298 VanDerWaalsContact O-CB 3.22Å; L294-S298 WeakPolarHBondContact O-CB 3.39Å; L294-S298 PolarHBondContact O-N 3.47Å; L294-S298 PolarHBondContact O-OG 2.8Å
295	V	96.7	Very high	94.2	Very high	8 Å²	8	39.6 Å²	39.6	5%	0.048	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-44.8	174	168	0	0	0	0	111.3	V247 M250 T291 L292 Y293 S298 G299	V247-V295 HydrophobicContact CG1-CG2 3.96Å; M250-V295 HydrophobicContact CB-CG1 3.96Å; M250-V295 HydrophobicContact CE-CB 4.49Å; M250-V295 HydrophobicContact CE-CG1 4.44Å; M250-V295 HydrophobicContact CE-CG2 4.24Å; T291-V295 VanDerWaalsContact O-CG2 3.31Å; T291-V295 WeakPolarHBondContact O-CG2 3.44Å; T291-V295 PolarHBondContact O-N 2.84Å; L292-V295 PolarHBondContact O-N 3.34Å; Y293-V295 VanDerWaalsContact C-N 3.29Å; Y293-V295 PolarHBondContact O-N 3.19Å; V295-S298 WeakPolarHBondContact CA-OG 3.1Å; V295-S298 PolarHBondContact O-OG 3.44Å; V295-S298 VanDerWaalsContact O-OG 3.07Å; V295-G299 PolarHBondContact O-N 3.31Å
296	Q	96.4	Very high	94.3	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.019	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-46.4	176.6	-71.6	-176.3	-9	0	0	112.2	L268 Q271 L292 Y293 G299 L300 I322	L268-Q296 HydrophobicContact CD2-CG 4.44Å; Q271-Q296 VanDerWaalsContact CD-NE2 3.29Å; L292-Q296 PolarHBondContact O-N 3.33Å; Y293-Q296 PolarHBondContact O-N 3.01Å; Q296-G299 PolarHBondContact O-N 3.08Å; Q296-L300 WeakPolarHBondContact O-CG 3.42Å; Q296-L300 PolarHBondContact O-N 3.46Å; Q296-I322 HydrophobicContact CB-CD1 3.93Å; Q296-I322 VanDerWaalsContact OE1-CD1 3.24Å
297	V	96.3	Very high	94.4	Very high	23 Å²	23	37.7 Å²	37.7	14%	0.139	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-47.4	179.4	171.8	0	0	0	0	111.1	Y293 G299 L300 L301 L319 I322	Y293-V297 WeakPolarHBondContact O-CG2 3.3Å; Y293-V297 PolarHBondContact O-N 2.92Å; V297-G299 VanDerWaalsContact C-N 3.32Å; V297-G299 PolarHBondContact O-N 2.91Å; V297-L300 PolarHBondContact O-N 3.32Å; V297-L301 HydrophobicContact CG1-CD1 3.78Å; V297-L301 HydrophobicContact CG1-CG 4.24Å; V297-L301 WeakPolarHBondContact O-CB 3.42Å; V297-L301 VanDerWaalsContact O-CG 3.3Å; V297-L301 WeakPolarHBondContact O-CG 3.22Å; V297-L301 PolarHBondContact O-N 3.37Å; V297-L319 HydrophobicContact CB-CD1 4.45Å; V297-L319 HydrophobicContact CG1-CD1 3.95Å; V297-L319 HydrophobicContact CG2-CD1 4Å; V297-I322 HydrophobicContact CG2-CB 4.15Å; V297-I322 HydrophobicContact CG2-CD1 4.05Å; V297-I322 HydrophobicContact CG2-CG2 3.56Å
298	S	95.7	Very high	94.5	Very high	42 Å²	42	37.5 Å²	37.5	29%	0.294	20%	0.198	S	C	.	.	H	α-helix	trans	-63.3	-37.6	178.2	56.6	0	0	0	0	112.3	Y251 L294 V295 S302	Y251-S298 WeakPolarHBondContact CD2-OG 3Å; L294-S298 VanDerWaalsContact O-CB 3.22Å; L294-S298 WeakPolarHBondContact O-CB 3.39Å; L294-S298 PolarHBondContact O-N 3.47Å; L294-S298 PolarHBondContact O-OG 2.8Å; V295-S298 WeakPolarHBondContact CA-OG 3.1Å; V295-S298 PolarHBondContact O-OG 3.44Å; V295-S298 VanDerWaalsContact O-OG 3.07Å; S298-S302 VanDerWaalsContact O-CB 3.31Å; S298-S302 WeakPolarHBondContact O-CB 3.21Å; S298-S302 PolarHBondContact O-N 3.38Å; S298-S302 PolarHBondContact O-OG 3.38Å
299	G	95.6	Very high	94.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-47.2	173.8	0	0	0	0	0	112.8	V295 Q296 V297 S302 V303	V295-G299 PolarHBondContact O-N 3.31Å; Q296-G299 PolarHBondContact O-N 3.08Å; V297-G299 VanDerWaalsContact C-N 3.32Å; V297-G299 PolarHBondContact O-N 2.91Å; G299-S302 PolarHBondContact O-N 2.95Å; G299-V303 PolarHBondContact O-N 3.37Å
300	L	94.4	Very high	93.8	Very high	4 Å²	4	40 Å²	40	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-43.4	176.9	-73.6	166.8	0	0	0	112.3	L268 Q296 V297 S302 V303 W304 V313 V318	L268-L300 HydrophobicContact CD1-CD1 4.37Å; L268-L300 HydrophobicContact CD1-CD2 4.15Å; L268-L300 HydrophobicContact CD1-CG 4.23Å; Q296-L300 WeakPolarHBondContact O-CG 3.42Å; Q296-L300 PolarHBondContact O-N 3.46Å; V297-L300 PolarHBondContact O-N 3.32Å; L300-S302 VanDerWaalsContact C-N 3.34Å; L300-V303 PolarHBondContact O-N 2.83Å; L300-W304 WeakPolarHBondContact O-CB 3.41Å; L300-W304 PolarHBondContact O-N 2.7Å; L300-V313 HydrophobicContact CB-CG1 4.26Å; L300-V313 HydrophobicContact CD2-CG1 4.18Å; L300-V313 WeakPolarHBondContact O-CG1 3.35Å; L300-V318 HydrophobicContact CD1-CG1 3.59Å
301	L	94.3	Very high	93.3	Very high	70 Å²	70	39.9 Å²	39.9	37%	0.366	22%	0.217	S	C	.	.	H	α-helix	trans	-67.6	-34.6	178.2	-69.5	177.8	0	0	0	112.5	V297 W304 L305 L314	V297-L301 HydrophobicContact CG1-CD1 3.78Å; V297-L301 HydrophobicContact CG1-CG 4.24Å; V297-L301 WeakPolarHBondContact O-CB 3.42Å; V297-L301 VanDerWaalsContact O-CG 3.3Å; V297-L301 WeakPolarHBondContact O-CG 3.22Å; V297-L301 PolarHBondContact O-N 3.37Å; L301-W304 WeakPolarHBondContact O-CB 3.44Å; L301-W304 PolarHBondContact O-N 2.89Å; L301-L305 PolarHBondContact O-N 2.95Å; L301-L314 HydrophobicContact CD2-CD2 3.98Å
302	S	94.6	Very high	92.6	Very high	32 Å²	32	40.5 Å²	40.5	22%	0.224	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-43.6	175	-59.5	0	0	0	0	111.1	Y251 S298 G299 L300 L305 L306	Y251-S302 PolarHBondContact OH-OG 3.26Å; S298-S302 VanDerWaalsContact O-CB 3.31Å; S298-S302 WeakPolarHBondContact O-CB 3.21Å; S298-S302 PolarHBondContact O-N 3.38Å; S298-S302 PolarHBondContact O-OG 3.38Å; G299-S302 PolarHBondContact O-N 2.95Å; L300-S302 VanDerWaalsContact C-N 3.34Å; S302-L305 PolarHBondContact O-N 3.25Å; S302-L306 WeakPolarHBondContact O-CG 3.37Å; S302-L306 PolarHBondContact O-N 2.98Å
303	V	93.9	Very high	92.1	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-37.5	174.9	173	0	0	0	0	111.7	C258 L259 G299 L300 L305 L306 Q307	C258-V303 HydrophobicContact CB-CB 4.18Å; C258-V303 HydrophobicContact CB-CG1 4.38Å; C258-V303 HydrophobicContact CB-CG2 3.66Å; L259-V303 HydrophobicContact CB-CG2 4.13Å; L259-V303 HydrophobicContact CD1-CG1 4.21Å; L259-V303 HydrophobicContact CD1-CG2 4.39Å; G299-V303 PolarHBondContact O-N 3.37Å; L300-V303 PolarHBondContact O-N 2.83Å; V303-L305 VanDerWaalsContact C-N 3.28Å; V303-L305 PolarHBondContact O-N 3.07Å; V303-L306 PolarHBondContact O-N 3.31Å; V303-Q307 HydrophobicContact CG1-CG 3.91Å; V303-Q307 VanDerWaalsContact O-CB 3.3Å; V303-Q307 WeakPolarHBondContact O-CB 3.3Å; V303-Q307 VanDerWaalsContact O-CG 3.32Å; V303-Q307 WeakPolarHBondContact O-CG 3.3Å; V303-Q307 PolarHBondContact O-N 3.15Å
304	W	92.7	Very high	91.5	Very high	70 Å²	70	43 Å²	43	27%	0.265	23%	0.233	S	C	.	.	H	α-helix	trans	-54.2	-45.8	172.1	166.8	73.4	0	0	0	111.6	L300 L301 Q307 C309 N310 V313 L314	L300-W304 WeakPolarHBondContact O-CB 3.41Å; L300-W304 PolarHBondContact O-N 2.7Å; L301-W304 WeakPolarHBondContact O-CB 3.44Å; L301-W304 PolarHBondContact O-N 2.89Å; W304-Q307 PolarHBondContact O-N 3.46Å; W304-C309 VanDerWaalsContact CD1-C 3.47Å; W304-C309 HydrophobicContact CZ2-CB 3.7Å; W304-C309 VanDerWaalsContact NE1-CA 3.26Å; W304-C309 PolarHBondContact NE1-O 3.39Å; W304-C309 WeakPolarHBondContact O-CA 3.44Å; W304-C309 PolarHBondContact O-N 2.98Å; W304-N310 VanDerWaalsContact CD1-O 3.24Å; W304-V313 HydrophobicContact CB-CB 4.21Å; W304-V313 HydrophobicContact CB-CG1 4.01Å; W304-L314 HydrophobicContact CD2-CD1 4.45Å; W304-L314 HydrophobicContact CD2-CD2 4.46Å; W304-L314 HydrophobicContact CD2-CG 4.41Å; W304-L314 HydrophobicContact CG-CD2 4.46Å; W304-L314 HydrophobicContact CG-CG 4.21Å; W304-L314 HydrophobicContact CZ2-CD1 3.95Å; W304-L314 VanDerWaalsContact NE1-CD1 3.29Å
305	L	93.2	Very high	91	Very high	118 Å²	118	38.5 Å²	38.5	62%	0.618	21%	0.209	S	C	*	.	H	α-helix	trans	-64.8	-46.4	176.3	-176.7	66.2	0	0	0	111.9	L301 S302 V303 Q307 F308	L301-L305 PolarHBondContact O-N 2.95Å; S302-L305 PolarHBondContact O-N 3.25Å; V303-L305 VanDerWaalsContact C-N 3.28Å; V303-L305 PolarHBondContact O-N 3.07Å; L305-Q307 PolarHBondContact O-N 2.99Å; L305-F308 PolarHBondContact O-N 2.76Å
306	L	91.4	Very high	90.7	Very high	97 Å²	97	38.2 Å²	38.2	51%	0.508	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-33.4	178.6	-70	172.4	0	0	0	112.4	Y138 L259 S302 V303 F308	Y138-L306 PolarHBondContact OH-O 3.33Å; L259-L306 HydrophobicContact CD1-CB 4.38Å; L259-L306 HydrophobicContact CD1-CD1 4.27Å; S302-L306 WeakPolarHBondContact O-CG 3.37Å; S302-L306 PolarHBondContact O-N 2.98Å; V303-L306 PolarHBondContact O-N 3.31Å; L306-F308 PolarHBondContact O-N 3.18Å
307	Q	91.8	Very high	90.4	Very high	5 Å²	5	40.1 Å²	40.1	2%	0.023	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	33.8	179	-65.2	-172	-22.3	0	0	113.6	Q133 N136 Y138 V303 W304 L305 C309 N310	Q133-Q307 WeakPolarHBondContact CG-O 3.18Å; N136-Q307 PolarHBondContact ND2-NE2 3.12Å; Y138-Q307 HydrophobicContact CE2-CG 3.68Å; Y138-Q307 WeakPolarHBondContact OH-CA 3.25Å; V303-Q307 HydrophobicContact CG1-CG 3.91Å; V303-Q307 VanDerWaalsContact O-CB 3.3Å; V303-Q307 WeakPolarHBondContact O-CB 3.3Å; V303-Q307 VanDerWaalsContact O-CG 3.32Å; V303-Q307 WeakPolarHBondContact O-CG 3.3Å; V303-Q307 PolarHBondContact O-N 3.15Å; W304-Q307 PolarHBondContact O-N 3.46Å; L305-Q307 PolarHBondContact O-N 2.99Å; Q307-C309 VanDerWaalsContact C-N 3.25Å; Q307-C309 PolarHBondContact O-N 3.34Å; Q307-N310 HydrophobicContact CB-CB 4.01Å; Q307-N310 WeakPolarHBondContact O-CB 3.18Å; Q307-N310 PolarHBondContact O-N 3.18Å; Q307-N310 VanDerWaalsContact O-N 3.11Å
308	F	90.7	Very high	90.3	Very high	93 Å²	93	39 Å²	39	41%	0.408	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	45.3	177	-60.2	-89.8	0	0	0	112.4	I118 L132 Q133 L305 L306 N310	I118-F308 HydrophobicContact CD1-CZ 3.99Å; I118-F308 HydrophobicContact CG1-CZ 4.3Å; L132-F308 HydrophobicContact CB-CD2 4.32Å; L132-F308 HydrophobicContact CB-CE2 3.78Å; L132-F308 HydrophobicContact CD1-CE2 4.14Å; Q133-F308 HydrophobicContact CB-CB 4.39Å; Q133-F308 HydrophobicContact CB-CD2 4.45Å; Q133-F308 HydrophobicContact CG-CB 4.4Å; Q133-F308 PolarHBondContact NE2-O 3.42Å; L305-F308 PolarHBondContact O-N 2.76Å; L306-F308 PolarHBondContact O-N 3.18Å; F308-N310 VanDerWaalsContact C-N 3.31Å; F308-N310 PolarHBondContact O-N 3.47Å
309	C	88.4	Confident	90.2	Very high	61 Å²	61	38 Å²	38	41%	0.412	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	37.8	179.8	-57.9	0	0	0	0	113.9	W304 Q307 S311	W304-C309 VanDerWaalsContact CD1-C 3.47Å; W304-C309 HydrophobicContact CZ2-CB 3.7Å; W304-C309 VanDerWaalsContact NE1-CA 3.26Å; W304-C309 PolarHBondContact NE1-O 3.39Å; W304-C309 WeakPolarHBondContact O-CA 3.44Å; W304-C309 PolarHBondContact O-N 2.98Å; Q307-C309 VanDerWaalsContact C-N 3.25Å; Q307-C309 PolarHBondContact O-N 3.34Å; C309-S311 PolarHBondContact O-N 3.39Å
310	N	85.1	Confident	90.2	Very high	22 Å²	22	38.2 Å²	38.2	12%	0.118	20%	0.203	C	C	.	.			trans	-51.8	114.1	-179.6	-176.1	-22.2	0	0	0	111.8	Q133 W304 Q307 F308 M312 V313	Q133-N310 HydrophobicContact CG-CB 4.18Å; Q133-N310 PolarHBondContact O-ND2 2.92Å; W304-N310 VanDerWaalsContact CD1-O 3.24Å; Q307-N310 HydrophobicContact CB-CB 4.01Å; Q307-N310 WeakPolarHBondContact O-CB 3.18Å; Q307-N310 PolarHBondContact O-N 3.18Å; Q307-N310 VanDerWaalsContact O-N 3.11Å; F308-N310 VanDerWaalsContact C-N 3.31Å; F308-N310 PolarHBondContact O-N 3.47Å; N310-M312 PolarHBondContact O-N 2.97Å; N310-M312 VanDerWaalsContact O-N 3.16Å; N310-M312 VanDerWaalsContact OD1-CB 3.23Å; N310-M312 WeakPolarHBondContact OD1-CB 3.48Å; N310-M312 PolarHBondContact OD1-N 3.37Å; N310-V313 HydrophobicContact CB-CG2 4.48Å; N310-V313 PolarHBondContact O-N 3.15Å
311	S	82.6	Confident	90.3	Very high	45 Å²	45	38.3 Å²	38.3	32%	0.315	20%	0.203	S	C	.	.	H	α-helix	trans	-62.6	-24	-175.3	52	0	0	0	0	113.6	C309 V313 L314 G315 L371	C309-S311 PolarHBondContact O-N 3.39Å; S311-V313 VanDerWaalsContact C-N 3.27Å; S311-V313 PolarHBondContact O-N 3.45Å; S311-L314 PolarHBondContact O-N 2.97Å; S311-G315 PolarHBondContact O-N 3.09Å; S311-L371 WeakPolarHBondContact O-CD1 3.4Å; S311-L371 WeakPolarHBondContact OG-CD2 3.21Å
312	M	81.2	Confident	90.4	Very high	47 Å²	47	35 Å²	35	23%	0.232	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-36.2	177	-169.9	-173.1	-71.1	0	0	112	N310 G315 S316	N310-M312 PolarHBondContact O-N 2.97Å; N310-M312 VanDerWaalsContact O-N 3.16Å; N310-M312 VanDerWaalsContact OD1-CB 3.23Å; N310-M312 WeakPolarHBondContact OD1-CB 3.48Å; N310-M312 PolarHBondContact OD1-N 3.37Å; M312-G315 PolarHBondContact O-N 2.94Å; M312-S316 PolarHBondContact O-N 3.34Å
313	V	85.6	Confident	90.4	Very high	21 Å²	21	36.8 Å²	36.8	13%	0.127	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-41.3	-179.5	-177.2	0	0	0	0	111.2	L300 W304 N310 S311 S316	L300-V313 HydrophobicContact CB-CG1 4.26Å; L300-V313 HydrophobicContact CD2-CG1 4.18Å; L300-V313 WeakPolarHBondContact O-CG1 3.35Å; W304-V313 HydrophobicContact CB-CB 4.21Å; W304-V313 HydrophobicContact CB-CG1 4.01Å; N310-V313 HydrophobicContact CB-CG2 4.48Å; N310-V313 PolarHBondContact O-N 3.15Å; S311-V313 VanDerWaalsContact C-N 3.27Å; S311-V313 PolarHBondContact O-N 3.45Å; V313-S316 WeakPolarHBondContact O-CB 3.49Å; V313-S316 PolarHBondContact O-N 2.83Å; V313-S316 PolarHBondContact O-OG 2.88Å
314	L	85.4	Confident	90.5	Very high	44 Å²	44	36.7 Å²	36.7	23%	0.23	19%	0.194	C	C	.	.	H	α-helix	trans	-68.5	-35	175.4	-72.1	175.2	0	0	0	112.3	L301 W304 S311 S316 L319 L369	L301-L314 HydrophobicContact CD2-CD2 3.98Å; W304-L314 HydrophobicContact CD2-CD1 4.45Å; W304-L314 HydrophobicContact CD2-CD2 4.46Å; W304-L314 HydrophobicContact CD2-CG 4.41Å; W304-L314 HydrophobicContact CG-CD2 4.46Å; W304-L314 HydrophobicContact CG-CG 4.21Å; W304-L314 HydrophobicContact CZ2-CD1 3.95Å; W304-L314 VanDerWaalsContact NE1-CD1 3.29Å; S311-L314 PolarHBondContact O-N 2.97Å; L314-S316 PolarHBondContact O-N 2.96Å; L314-L319 HydrophobicContact CD2-CD2 4.07Å; L314-L369 HydrophobicContact CB-CD1 3.83Å; L314-L369 HydrophobicContact CD1-CD1 4.4Å
315	G	84.9	Confident	90.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.2	175.2	0	0	0	0	0	115	S311 M312 N362 K366	S311-G315 PolarHBondContact O-N 3.09Å; M312-G315 PolarHBondContact O-N 2.94Å; G315-N362 PolarHBondContact O-ND2 3.07Å; G315-K366 WeakPolarHBondContact O-CE 3.29Å
316	S	90	Very high	90.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	17%	0.166	C	C	.	.			trans	-64.1	145.7	-175	65.4	0	0	0	0	113.2	Q265 M312 V313 L314 V318 L319 S320 N362	Q265-S316 VanDerWaalsContact OE1-CA 3.26Å; M312-S316 PolarHBondContact O-N 3.34Å; V313-S316 WeakPolarHBondContact O-CB 3.49Å; V313-S316 PolarHBondContact O-N 2.83Å; V313-S316 PolarHBondContact O-OG 2.88Å; L314-S316 PolarHBondContact O-N 2.96Å; S316-V318 VanDerWaalsContact C-N 3.31Å; S316-V318 PolarHBondContact O-N 3.43Å; S316-L319 VanDerWaalsContact OG-CB 3.3Å; S316-L319 WeakPolarHBondContact OG-CB 3.34Å; S316-L319 PolarHBondContact OG-N 3.5Å; S316-S320 PolarHBondContact O-N 3.49Å; S316-S320 PolarHBondContact O-OG 3.12Å; S316-N362 PolarHBondContact O-ND2 3.39Å
317	L	90.9	Very high	90.6	Very high	45 Å²	45	30.9 Å²	30.9	24%	0.236	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-37.4	177.2	-70.6	173.4	0	0	0	111.9	F266 L269 S320 F321 F378	F266-L317 HydrophobicContact CE1-CD1 4.2Å; L269-L317 HydrophobicContact CD2-CB 4.01Å; L269-L317 HydrophobicContact CD2-CD1 4.31Å; L317-S320 PolarHBondContact O-N 3.03Å; L317-F321 VanDerWaalsContact O-CB 3.32Å; L317-F321 WeakPolarHBondContact O-CB 3.25Å; L317-F321 PolarHBondContact O-N 3.1Å; L317-F378 HydrophobicContact CD1-CZ 3.98Å; L317-F378 HydrophobicContact CD2-CZ 4.17Å; L317-F378 HydrophobicContact CG-CZ 4.46Å
318	V	94.6	Very high	90.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-45.2	179.9	59.9	0	0	0	0	111.8	Q265 L268 L269 A272 L300 S316 S320 F321 I322	Q265-V318 HydrophobicContact CB-CG1 3.98Å; L268-V318 HydrophobicContact CB-CG2 3.97Å; L269-V318 HydrophobicContact CB-CB 4.1Å; A272-V318 HydrophobicContact CB-CG2 4.32Å; L300-V318 HydrophobicContact CD1-CG1 3.59Å; S316-V318 VanDerWaalsContact C-N 3.31Å; S316-V318 PolarHBondContact O-N 3.43Å; V318-S320 VanDerWaalsContact C-N 3.33Å; V318-S320 PolarHBondContact O-N 3.49Å; V318-F321 PolarHBondContact O-N 2.87Å; V318-I322 HydrophobicContact CG2-CD1 3.64Å; V318-I322 HydrophobicContact CG2-CG1 4.23Å; V318-I322 VanDerWaalsContact O-CG1 3.25Å; V318-I322 WeakPolarHBondContact O-CG1 3.35Å; V318-I322 PolarHBondContact O-N 2.81Å
319	L	93.9	Very high	90.5	Very high	21 Å²	21	29.2 Å²	29.2	11%	0.11	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-43.4	178.8	-174.7	63.5	0	0	0	110.8	V297 L314 S316 F321 I322 V323	V297-L319 HydrophobicContact CB-CD1 4.45Å; V297-L319 HydrophobicContact CG1-CD1 3.95Å; V297-L319 HydrophobicContact CG2-CD1 4Å; L314-L319 HydrophobicContact CD2-CD2 4.07Å; S316-L319 VanDerWaalsContact OG-CB 3.3Å; S316-L319 WeakPolarHBondContact OG-CB 3.34Å; S316-L319 PolarHBondContact OG-N 3.5Å; L319-F321 PolarHBondContact O-N 3.11Å; L319-I322 PolarHBondContact O-N 3.36Å; L319-V323 HydrophobicContact CD1-CG2 4.4Å; L319-V323 WeakPolarHBondContact O-CB 3.42Å; L319-V323 VanDerWaalsContact O-CG2 3.26Å; L319-V323 WeakPolarHBondContact O-CG2 3.22Å; L319-V323 PolarHBondContact O-N 3.46Å
320	S	94.6	Very high	90.5	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-42.8	177.5	-52.2	0	0	0	0	111.7	S316 L317 V318 A324 N362	S316-S320 PolarHBondContact O-N 3.49Å; S316-S320 PolarHBondContact O-OG 3.12Å; L317-S320 PolarHBondContact O-N 3.03Å; V318-S320 VanDerWaalsContact C-N 3.33Å; V318-S320 PolarHBondContact O-N 3.49Å; S320-A324 WeakPolarHBondContact O-CB 3.42Å; S320-A324 PolarHBondContact O-N 3.32Å; S320-A324 VanDerWaalsContact O-N 3.11Å; S320-N362 WeakPolarHBondContact OG-CA 3.37Å; S320-N362 WeakPolarHBondContact OG-CB 3.46Å; S320-N362 PolarHBondContact OG-ND2 3.34Å
321	F	96.7	Very high	90.6	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-65.5	-47.3	177.6	176.9	-98.4	0	0	0	112.4	L269 A272 L273 Y276 L317 V318 L319 A324 A325 V354 L355	L269-F321 HydrophobicContact CD1-CB 3.94Å; L269-F321 HydrophobicContact CD1-CD1 4.31Å; L269-F321 HydrophobicContact CD1-CG 4.09Å; A272-F321 HydrophobicContact CB-CD1 3.9Å; A272-F321 HydrophobicContact CB-CE1 4.01Å; L273-F321 HydrophobicContact CD2-CD2 4.5Å; L273-F321 HydrophobicContact CD2-CE1 4.23Å; L273-F321 HydrophobicContact CD2-CE2 3.79Å; L273-F321 HydrophobicContact CD2-CZ 3.64Å; L273-F321 HydrophobicContact CG-CZ 4.48Å; Y276-F321 HydrophobicContact CD1-CZ 4.17Å; Y276-F321 HydrophobicContact CD2-CZ 4.19Å; Y276-F321 AromaticContact CG-CZ 3.81Å; Y276-F321 HydrophobicContact CG-CZ 3.81Å; L317-F321 VanDerWaalsContact O-CB 3.32Å; L317-F321 WeakPolarHBondContact O-CB 3.25Å; L317-F321 PolarHBondContact O-N 3.1Å; V318-F321 PolarHBondContact O-N 2.87Å; L319-F321 PolarHBondContact O-N 3.11Å; F321-A324 PolarHBondContact O-N 3.5Å; F321-A325 WeakPolarHBondContact O-CB 3.2Å; F321-A325 PolarHBondContact O-N 2.92Å; F321-V354 HydrophobicContact CD2-CG1 4.27Å; F321-V354 HydrophobicContact CE2-CG1 3.86Å; F321-L355 HydrophobicContact CE2-CD2 4.42Å
322	I	96.4	Very high	90.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.2	-45.4	-178.5	-66.6	170.2	0	0	0	111	A272 Y293 Q296 V297 V318 L319 A324 A325 L326	A272-I322 HydrophobicContact CB-CD1 4.44Å; A272-I322 HydrophobicContact CB-CG1 4.14Å; Y293-I322 HydrophobicContact CD1-CB 4.31Å; Y293-I322 HydrophobicContact CD1-CD1 4.08Å; Y293-I322 HydrophobicContact CD1-CG1 3.68Å; Y293-I322 HydrophobicContact CD1-CG2 3.84Å; Y293-I322 HydrophobicContact CD2-CG2 4.47Å; Y293-I322 HydrophobicContact CE1-CG1 4.02Å; Y293-I322 HydrophobicContact CG-CG1 4.45Å; Y293-I322 HydrophobicContact CG-CG2 3.73Å; Q296-I322 HydrophobicContact CB-CD1 3.93Å; Q296-I322 VanDerWaalsContact OE1-CD1 3.24Å; V297-I322 HydrophobicContact CG2-CB 4.15Å; V297-I322 HydrophobicContact CG2-CD1 4.05Å; V297-I322 HydrophobicContact CG2-CG2 3.56Å; V318-I322 HydrophobicContact CG2-CD1 3.64Å; V318-I322 HydrophobicContact CG2-CG1 4.23Å; V318-I322 VanDerWaalsContact O-CG1 3.25Å; V318-I322 WeakPolarHBondContact O-CG1 3.35Å; V318-I322 PolarHBondContact O-N 2.81Å; L319-I322 PolarHBondContact O-N 3.36Å; I322-A324 VanDerWaalsContact C-N 3.31Å; I322-A324 PolarHBondContact O-N 3.25Å; I322-A325 PolarHBondContact O-N 3.11Å; I322-L326 HydrophobicContact CG2-CD1 3.92Å; I322-L326 HydrophobicContact CG2-CG 4.32Å; I322-L326 WeakPolarHBondContact O-CB 3.47Å; I322-L326 WeakPolarHBondContact O-CG 3.15Å; I322-L326 PolarHBondContact O-N 3.45Å
323	V	94.6	Very high	90.2	Very high	70 Å²	70	40 Å²	40	42%	0.424	21%	0.212	S	C	.	.	H	α-helix	trans	-59.9	-44.9	177.3	170.9	0	0	0	0	110.4	L319 F327	L319-V323 HydrophobicContact CD1-CG2 4.4Å; L319-V323 WeakPolarHBondContact O-CB 3.42Å; L319-V323 VanDerWaalsContact O-CG2 3.26Å; L319-V323 WeakPolarHBondContact O-CG2 3.22Å; L319-V323 PolarHBondContact O-N 3.46Å; V323-F327 VanDerWaalsContact O-CB 3.29Å; V323-F327 WeakPolarHBondContact O-CB 3.41Å; V323-F327 PolarHBondContact O-N 2.99Å
324	A	95.5	Very high	89.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-45.2	176.7	0	0	0	0	0	112.4	S320 F321 I322 F327 I328 L357 A358	S320-A324 WeakPolarHBondContact O-CB 3.42Å; S320-A324 PolarHBondContact O-N 3.32Å; S320-A324 VanDerWaalsContact O-N 3.11Å; F321-A324 PolarHBondContact O-N 3.5Å; I322-A324 VanDerWaalsContact C-N 3.31Å; I322-A324 PolarHBondContact O-N 3.25Å; A324-F327 PolarHBondContact O-N 3.5Å; A324-I328 WeakPolarHBondContact O-CG1 3.2Å; A324-I328 PolarHBondContact O-N 2.81Å; A324-L357 HydrophobicContact CB-CB 3.99Å; A324-L357 HydrophobicContact CB-CD2 3.97Å; A324-L357 HydrophobicContact CB-CG 3.85Å; A324-A358 HydrophobicContact CB-CB 3.82Å
325	A	94.1	Very high	88.9	Confident	5 Å²	5	40.9 Å²	40.9	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-45.9	179.4	0	0	0	0	0	111.9	Y276 Y293 F321 I322 R329 V354	Y276-A325 HydrophobicContact CD2-CB 4.46Å; Y293-A325 HydrophobicContact CE2-CB 4.38Å; F321-A325 WeakPolarHBondContact O-CB 3.2Å; F321-A325 PolarHBondContact O-N 2.92Å; I322-A325 PolarHBondContact O-N 3.11Å; A325-R329 WeakPolarHBondContact O-CB 3.27Å; A325-R329 PolarHBondContact O-N 3.11Å; A325-V354 HydrophobicContact CB-CG1 4.15Å
326	L	93.4	Very high	88.2	Confident	45 Å²	45	45.6 Å²	45.6	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-42	177.1	-71.7	176	0	0	0	112	T290 Y293 I322 H330	T290-L326 HydrophobicContact CG2-CD2 4.42Å; Y293-L326 HydrophobicContact CD2-CD2 3.78Å; Y293-L326 HydrophobicContact CD2-CG 4.13Å; I322-L326 HydrophobicContact CG2-CD1 3.92Å; I322-L326 HydrophobicContact CG2-CG 4.32Å; I322-L326 WeakPolarHBondContact O-CB 3.47Å; I322-L326 WeakPolarHBondContact O-CG 3.15Å; I322-L326 PolarHBondContact O-N 3.45Å; L326-H330 PolarHBondContact O-N 2.63Å
327	F	93.3	Very high	87.2	Confident	114 Å²	114	49.3 Å²	49.3	50%	0.5	27%	0.267	S	S	.	.	H	α-helix	trans	-66.4	-52	-179.7	-178.3	-97.1	0	0	0	112.3	V323 A324 R329 H330 C331 L357	V323-F327 VanDerWaalsContact O-CB 3.29Å; V323-F327 WeakPolarHBondContact O-CB 3.41Å; V323-F327 PolarHBondContact O-N 2.99Å; A324-F327 PolarHBondContact O-N 3.5Å; F327-R329 VanDerWaalsContact C-N 3.26Å; F327-R329 PolarHBondContact O-N 3.26Å; F327-H330 WeakPolarHBondContact O-CB 3.22Å; F327-H330 PolarHBondContact O-N 2.82Å; F327-H330 VanDerWaalsContact O-N 3.1Å; F327-C331 PolarHBondContact O-N 3.21Å; F327-C331 PolarHBondContact O-SG 2.96Å; F327-C331 VanDerWaalsContact O-SG 3.37Å; F327-L357 HydrophobicContact CB-CD2 4.24Å; F327-L357 HydrophobicContact CD1-CD2 3.52Å; F327-L357 HydrophobicContact CE1-CD2 4.3Å; F327-L357 HydrophobicContact CG-CD2 4.23Å
328	I	91.6	Very high	86.3	Confident	17 Å²	17	49.2 Å²	49.2	9%	0.087	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-36.2	180	-59.8	-62.6	0	0	0	110.5	A324 H330 C331 Q332 H350 L353 V354 L357	A324-I328 WeakPolarHBondContact O-CG1 3.2Å; A324-I328 PolarHBondContact O-N 2.81Å; I328-H330 VanDerWaalsContact C-N 3.34Å; I328-H330 PolarHBondContact O-N 2.97Å; I328-C331 PolarHBondContact O-N 3.23Å; I328-Q332 WeakPolarHBondContact O-CB 3.47Å; I328-Q332 PolarHBondContact O-N 2.54Å; I328-H350 VanDerWaalsContact CG2-CE1 3.48Å; I328-H350 WeakPolarHBondContact CG2-CE1 3.39Å; I328-H350 WeakPolarHBondContact CG2-ND1 3.49Å; I328-L353 HydrophobicContact CD1-CB 4.21Å; I328-L353 HydrophobicContact CG1-CB 4.44Å; I328-L353 HydrophobicContact CG2-CB 4.15Å; I328-V354 HydrophobicContact CB-CG2 3.77Å; I328-V354 HydrophobicContact CG1-CG2 3.98Å; I328-V354 HydrophobicContact CG2-CG2 4.01Å; I328-L357 HydrophobicContact CD1-CB 4.48Å; I328-L357 HydrophobicContact CD1-CD2 3.73Å; I328-L357 HydrophobicContact CG1-CD2 3.84Å
329	R	87.2	Confident	85.5	Confident	45 Å²	45	50.8 Å²	50.8	17%	0.17	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-44	172.9	-178.9	-178.1	-173.9	83.1	-13.7	112.2	D279 T286 A325 F327 C331 Q332	D279-R329 IonicContact OD1-CZ 3.33Å; D279-R329 IonicContact OD1-NH1 3.54Å; D279-R329 PolarHBondContact OD1-NH1 3.41Å; D279-R329 IonicContact OD1-NH2 3.83Å; D279-R329 PolarHBondContact OD1-NH2 2.99Å; D279-R329 IonicContact OD2-CZ 3.98Å; D279-R329 IonicContact OD2-NH1 2.7Å; D279-R329 PolarHBondContact OD2-NH1 3.32Å; D279-R329 IonicContact OD2-NH2 3.32Å; T286-R329 PolarHBondContact OG1-NH2 3.15Å; A325-R329 WeakPolarHBondContact O-CB 3.27Å; A325-R329 PolarHBondContact O-N 3.11Å; F327-R329 VanDerWaalsContact C-N 3.26Å; F327-R329 PolarHBondContact O-N 3.26Å; R329-C331 VanDerWaalsContact C-N 3.3Å; R329-C331 PolarHBondContact O-N 3.43Å; R329-Q332 CarbonylContact O-C 3.41Å; R329-Q332 PolarHBondContact O-N 3.09Å
330	H	88.3	Confident	84.9	Confident	156 Å²	156	52.9 Å²	52.9	72%	0.722	30%	0.304	S	S	*	.	H	α-helix	trans	-61.9	-40.3	176.4	-173.7	72.8	0	0	0	111.7	L326 F327 I328	L326-H330 PolarHBondContact O-N 2.63Å; F327-H330 WeakPolarHBondContact O-CB 3.22Å; F327-H330 PolarHBondContact O-N 2.82Å; F327-H330 VanDerWaalsContact O-N 3.1Å; I328-H330 VanDerWaalsContact C-N 3.34Å; I328-H330 PolarHBondContact O-N 2.97Å
331	C	87.4	Confident	84.3	Confident	73 Å²	73	59.5 Å²	59.5	49%	0.493	34%	0.339	S	S	.	.	H	α-helix	trans	-73	-26.3	178.3	-64.6	0	0	0	0	113.9	F327 I328 R329 P333	F327-C331 PolarHBondContact O-N 3.21Å; F327-C331 PolarHBondContact O-SG 2.96Å; F327-C331 VanDerWaalsContact O-SG 3.37Å; I328-C331 PolarHBondContact O-N 3.23Å; R329-C331 VanDerWaalsContact C-N 3.3Å; R329-C331 PolarHBondContact O-N 3.43Å; C331-P333 VanDerWaalsContact C-CD 3.48Å; C331-P333 WeakPolarHBondContact O-CD 3.45Å
332	Q	83.7	Confident	83.8	Confident	57 Å²	57	63 Å²	63	27%	0.266	36%	0.36	S	S	.	.			trans	-123	73.1	-177.2	-65.3	-174.2	-31.2	0	0	112	I328 R329 A334 L335 H350	I328-Q332 WeakPolarHBondContact O-CB 3.47Å; I328-Q332 PolarHBondContact O-N 2.54Å; R329-Q332 CarbonylContact O-C 3.41Å; R329-Q332 PolarHBondContact O-N 3.09Å; Q332-A334 VanDerWaalsContact C-N 3.26Å; Q332-A334 PolarHBondContact O-N 3.1Å; Q332-L335 HydrophobicContact CB-CD1 3.79Å; Q332-L335 WeakPolarHBondContact O-CD1 3.48Å; Q332-H350 PolarHBondContact OE1-ND1 3Å
333	P	73	Confident	83.2	Confident	115 Å²	115	63.6 Å²	63.6	75%	0.747	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.6	-179.6	26.9	-33.8	0	0	0	113.8	C331 L335	C331-P333 VanDerWaalsContact C-CD 3.48Å; C331-P333 WeakPolarHBondContact O-CD 3.45Å; P333-L335 PolarHBondContact O-N 2.94Å
334	A	70.8	Confident	82.8	Confident	55 Å²	55	64.1 Å²	64.1	46%	0.455	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	38.1	-170.1	0	0	0	0	0	115.1	Q332 K336 T337 K346	Q332-A334 VanDerWaalsContact C-N 3.26Å; Q332-A334 PolarHBondContact O-N 3.1Å; A334-K336 VanDerWaalsContact C-N 3.29Å; A334-K336 PolarHBondContact O-N 3.42Å; A334-T337 PolarHBondContact O-OG1 3.37Å; A334-K346 PolarHBondContact O-NZ 2.92Å
335	L	71.1	Confident	82.4	Confident	29 Å²	29	66.9 Å²	66.9	15%	0.152	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-27.1	176.6	-96	87.1	0	0	0	113.5	Q332 P333 T337 V347 H350	Q332-L335 HydrophobicContact CB-CD1 3.79Å; Q332-L335 WeakPolarHBondContact O-CD1 3.48Å; P333-L335 PolarHBondContact O-N 2.94Å; L335-T337 VanDerWaalsContact C-N 3.33Å; L335-T337 PolarHBondContact O-N 3.01Å; L335-V347 HydrophobicContact CD2-CG2 4.27Å; L335-H350 HydrophobicContact CD1-CB 4.47Å; L335-H350 HydrophobicContact CD2-CB 3.87Å; L335-H350 HydrophobicContact CG-CB 4.5Å
336	K	70.9	Confident	82.1	Confident	100 Å²	100	69.8 Å²	69.8	44%	0.435	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	0.8	-171.2	-51.6	-169.4	-170.7	-138.6	0	114.4	D282 A334	D282-K336 WeakPolarHBondContact OD1-CD 3.36Å; D282-K336 WeakPolarHBondContact OD1-CE 3.21Å; D282-K336 IonicContact OD1-NZ 3.62Å; D282-K336 PolarHBondContact OD1-NZ 3.29Å; D282-K336 IonicContact OD2-NZ 3.63Å; A334-K336 VanDerWaalsContact C-N 3.29Å; A334-K336 PolarHBondContact O-N 3.42Å
337	T	69.4	Low	81.9	Confident	78 Å²	78	68.7 Å²	68.7	48%	0.479	39%	0.393	S	S	.	.			trans	-106.4	139.7	-172.9	58.4	0	0	0	0	112.8	A334 L335 K346	A334-T337 PolarHBondContact O-OG1 3.37Å; L335-T337 VanDerWaalsContact C-N 3.33Å; L335-T337 PolarHBondContact O-N 3.01Å; T337-K346 PolarHBondContact O-NZ 2.99Å; T337-K346 PolarHBondContact OG1-NZ 2.96Å
338	G	70.9	Confident	81.7	Confident	43 Å²	43	68.6 Å²	68.6	44%	0.443	40%	0.397	S	S	.	.	S	Bend	trans	112.9	173.8	175.1	0	0	0	0	0	114
339	G	79.6	Confident	81.7	Confident	34 Å²	34	72.3 Å²	72.3	35%	0.351	42%	0.416	S	S	.	.			trans	-67.8	167.9	174.3	0	0	0	0	0	112.9	L341 V342 R343	G339-L341 PolarHBondContact O-N 2.88Å; G339-V342 PolarHBondContact O-N 3.43Å; G339-V342 VanDerWaalsContact O-N 3.13Å; G339-R343 WeakPolarHBondContact O-CB 3.48Å; G339-R343 PolarHBondContact O-N 3.46Å
340	L	80.3	Confident	81.9	Confident	65 Å²	65	70.2 Å²	70.2	34%	0.34	41%	0.408	S	S	.	.	H	α-helix	trans	-50.5	-50.3	-174.1	-178.7	68.6	0	0	0	113.3	R343 L344 L443	L340-R343 PolarHBondContact O-N 2.98Å; L340-L344 HydrophobicContact CD1-CD1 4.4Å; L340-L344 HydrophobicContact CG-CD1 4.17Å; L340-L344 WeakPolarHBondContact O-CG 3.5Å; L340-L344 PolarHBondContact O-N 3.37Å; L340-L443 HydrophobicContact CD1-CB 3.64Å
341	L	82.8	Confident	82.1	Confident	142 Å²	142	64.1 Å²	64.1	74%	0.743	38%	0.383	S	S	*	.	H	α-helix	trans	-65.1	-41.9	-178.9	-68.9	175.6	0	0	0	112.5	G339 R343 L344 A345	G339-L341 PolarHBondContact O-N 2.88Å; L341-R343 VanDerWaalsContact C-N 3.3Å; L341-R343 PolarHBondContact O-N 3.4Å; L341-L344 PolarHBondContact O-N 3.5Å; L341-A345 WeakPolarHBondContact O-CB 3.29Å; L341-A345 PolarHBondContact O-N 2.77Å
342	V	84.6	Confident	82.4	Confident	79 Å²	79	65 Å²	65	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-40.3	177.8	176.3	0	0	0	0	110.1	G339 A345 K346	G339-V342 PolarHBondContact O-N 3.43Å; G339-V342 VanDerWaalsContact O-N 3.13Å; V342-A345 PolarHBondContact O-N 3.48Å; V342-K346 HydrophobicContact CG1-CD 4.32Å; V342-K346 WeakPolarHBondContact O-CB 3.5Å; V342-K346 VanDerWaalsContact O-CG 3.29Å; V342-K346 WeakPolarHBondContact O-CG 3.24Å; V342-K346 PolarHBondContact O-N 3.46Å
343	R	84.4	Confident	82.9	Confident	13 Å²	13	65 Å²	65	5%	0.049	38%	0.384	C	S	.	.	H	α-helix	trans	-67.3	-44	177.5	-174.5	168.7	176.2	-177	-10.8	112.2	D282 G339 L340 L341 A345 K346 V347 N442 L443	D282-R343 IonicContact OD1-NH2 3.87Å; D282-R343 IonicContact OD2-CZ 3.05Å; D282-R343 IonicContact OD2-NH1 3.17Å; D282-R343 IonicContact OD2-NH2 3.93Å; D282-R343 PolarHBondContact OD2-NH2 3.3Å; G339-R343 WeakPolarHBondContact O-CB 3.48Å; G339-R343 PolarHBondContact O-N 3.46Å; L340-R343 PolarHBondContact O-N 2.98Å; L341-R343 VanDerWaalsContact C-N 3.3Å; L341-R343 PolarHBondContact O-N 3.4Å; R343-A345 VanDerWaalsContact C-N 3.34Å; R343-A345 PolarHBondContact O-N 2.96Å; R343-K346 PolarHBondContact O-N 2.92Å; R343-V347 WeakPolarHBondContact O-CG2 3.49Å; R343-V347 PolarHBondContact O-N 2.95Å; R343-N442 PolarHBondContact NH1-O 3.32Å; R343-L443 HydrophobicContact CG-CD2 4.19Å
344	L	86.1	Confident	84	Confident	81 Å²	81	59.6 Å²	59.6	42%	0.424	35%	0.348	S	S	.	.	H	α-helix	trans	-60.2	-44	174.1	-73.6	171.4	0	0	0	111.5	L340 L341 K346 V347 L348 L443	L340-L344 HydrophobicContact CD1-CD1 4.4Å; L340-L344 HydrophobicContact CG-CD1 4.17Å; L340-L344 WeakPolarHBondContact O-CG 3.5Å; L340-L344 PolarHBondContact O-N 3.37Å; L341-L344 PolarHBondContact O-N 3.5Å; L344-K346 PolarHBondContact O-N 3.44Å; L344-V347 PolarHBondContact O-N 3.4Å; L344-L348 WeakPolarHBondContact O-CB 3.17Å; L344-L348 PolarHBondContact O-N 2.88Å; L344-L443 HydrophobicContact CD2-CD1 4.2Å
345	A	87.2	Confident	85.1	Confident	59 Å²	59	62 Å²	62	49%	0.488	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-42.7	175.6	0	0	0	0	0	112.2	L341 V342 R343 L348 L349	L341-A345 WeakPolarHBondContact O-CB 3.29Å; L341-A345 PolarHBondContact O-N 2.77Å; V342-A345 PolarHBondContact O-N 3.48Å; R343-A345 VanDerWaalsContact C-N 3.34Å; R343-A345 PolarHBondContact O-N 2.96Å; A345-L348 PolarHBondContact O-N 2.93Å; A345-L349 WeakPolarHBondContact O-CB 3.29Å; A345-L349 PolarHBondContact O-N 2.76Å
346	K	87.9	Confident	86.2	Confident	66 Å²	66	65.4 Å²	65.4	29%	0.287	37%	0.371	S	S	.	.	H	α-helix	trans	-61.2	-44.6	174.4	-77.1	176.1	176.6	-175.1	0	112.2	A334 T337 V342 R343 L344 L349 H350	A334-K346 PolarHBondContact O-NZ 2.92Å; T337-K346 PolarHBondContact O-NZ 2.99Å; T337-K346 PolarHBondContact OG1-NZ 2.96Å; V342-K346 HydrophobicContact CG1-CD 4.32Å; V342-K346 WeakPolarHBondContact O-CB 3.5Å; V342-K346 VanDerWaalsContact O-CG 3.29Å; V342-K346 WeakPolarHBondContact O-CG 3.24Å; V342-K346 PolarHBondContact O-N 3.46Å; R343-K346 PolarHBondContact O-N 2.92Å; L344-K346 PolarHBondContact O-N 3.44Å; K346-L349 PolarHBondContact O-N 3.28Å; K346-H350 VanDerWaalsContact O-CB 3.23Å; K346-H350 WeakPolarHBondContact O-CB 3.3Å; K346-H350 PolarHBondContact O-N 3.3Å
347	V	88.7	Confident	87.4	Confident	22 Å²	22	62.5 Å²	62.5	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-64.1	-41.9	177.6	166	0	0	0	0	111.4	I280 L335 R343 L344 H350 S351	I280-V347 HydrophobicContact CD1-CG1 4.25Å; I280-V347 HydrophobicContact CG1-CG1 4.39Å; I280-V347 HydrophobicContact CG2-CB 4.32Å; I280-V347 HydrophobicContact CG2-CG1 3.34Å; I280-V347 HydrophobicContact CG2-CG2 3.94Å; L335-V347 HydrophobicContact CD2-CG2 4.27Å; R343-V347 WeakPolarHBondContact O-CG2 3.49Å; R343-V347 PolarHBondContact O-N 2.95Å; L344-V347 PolarHBondContact O-N 3.4Å; V347-H350 PolarHBondContact O-N 3.45Å; V347-S351 WeakPolarHBondContact O-CB 3.35Å; V347-S351 PolarHBondContact O-N 3.3Å; V347-S351 PolarHBondContact O-OG 3.3Å
348	L	90.5	Very high	88.6	Confident	112 Å²	112	59.3 Å²	59.3	59%	0.586	34%	0.341	S	S	*	.	H	α-helix	trans	-63.2	-48.9	176.5	-177.3	67.9	0	0	0	110.7	L344 A345 H350 S351 I352	L344-L348 WeakPolarHBondContact O-CB 3.17Å; L344-L348 PolarHBondContact O-N 2.88Å; A345-L348 PolarHBondContact O-N 2.93Å; L348-H350 VanDerWaalsContact C-N 3.35Å; L348-H350 PolarHBondContact O-N 3.24Å; L348-S351 PolarHBondContact O-N 3.41Å; L348-I352 HydrophobicContact CD1-CD1 4.41Å; L348-I352 HydrophobicContact CG-CD1 4.06Å; L348-I352 WeakPolarHBondContact O-CG1 3.32Å; L348-I352 PolarHBondContact O-N 2.93Å
349	L	90.9	Very high	89.6	Confident	94 Å²	94	64.2 Å²	64.2	49%	0.492	35%	0.35	S	S	.	.	H	α-helix	trans	-59.3	-46	176.2	179.5	63.6	0	0	0	111.4	A345 K346 S351 I352 L353	A345-L349 WeakPolarHBondContact O-CB 3.29Å; A345-L349 PolarHBondContact O-N 2.76Å; K346-L349 PolarHBondContact O-N 3.28Å; L349-S351 VanDerWaalsContact C-N 3.3Å; L349-S351 PolarHBondContact O-N 2.97Å; L349-I352 PolarHBondContact O-N 2.88Å; L349-L353 HydrophobicContact CD1-CD1 4.25Å; L349-L353 HydrophobicContact CD1-CG 4.31Å; L349-L353 HydrophobicContact CG-CD1 4.02Å; L349-L353 HydrophobicContact CG-CG 4.49Å; L349-L353 WeakPolarHBondContact O-CB 3.28Å; L349-L353 VanDerWaalsContact O-CG 3.27Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.32Å
350	H	91.4	Very high	90.2	Very high	2 Å²	2	66 Å²	66	1%	0.009	35%	0.351	C	S	.	.	H	α-helix	trans	-56.6	-45.9	176.2	-172.7	77.2	0	0	0	111.4	Y276 I328 Q332 L335 K346 V347 L348 L353 V354	Y276-H350 PolarHBondContact OH-CD2 3.32Å; I328-H350 VanDerWaalsContact CG2-CE1 3.48Å; I328-H350 WeakPolarHBondContact CG2-CE1 3.39Å; I328-H350 WeakPolarHBondContact CG2-ND1 3.49Å; Q332-H350 PolarHBondContact OE1-ND1 3Å; L335-H350 HydrophobicContact CD1-CB 4.47Å; L335-H350 HydrophobicContact CD2-CB 3.87Å; L335-H350 HydrophobicContact CG-CB 4.5Å; K346-H350 VanDerWaalsContact O-CB 3.23Å; K346-H350 WeakPolarHBondContact O-CB 3.3Å; K346-H350 PolarHBondContact O-N 3.3Å; V347-H350 PolarHBondContact O-N 3.45Å; L348-H350 VanDerWaalsContact C-N 3.35Å; L348-H350 PolarHBondContact O-N 3.24Å; H350-L353 PolarHBondContact O-N 3Å; H350-V354 VanDerWaalsContact O-CG2 3.3Å; H350-V354 WeakPolarHBondContact O-CG2 3.21Å; H350-V354 PolarHBondContact O-N 2.98Å
351	S	93.2	Very high	90.8	Very high	27 Å²	27	64.7 Å²	64.7	19%	0.189	35%	0.346	C	S	.	.	H	α-helix	trans	-66.3	-40.8	179.3	-56.7	0	0	0	0	112.9	Y276 V347 L348 L349 L353 V354 L355	Y276-S351 WeakPolarHBondContact OH-CA 3.37Å; Y276-S351 WeakPolarHBondContact OH-CB 3.4Å; Y276-S351 PolarHBondContact OH-OG 2.97Å; V347-S351 WeakPolarHBondContact O-CB 3.35Å; V347-S351 PolarHBondContact O-N 3.3Å; V347-S351 PolarHBondContact O-OG 3.3Å; L348-S351 PolarHBondContact O-N 3.41Å; L349-S351 VanDerWaalsContact C-N 3.3Å; L349-S351 PolarHBondContact O-N 2.97Å; S351-L353 VanDerWaalsContact C-N 3.34Å; S351-V354 PolarHBondContact O-N 3.49Å; S351-L355 WeakPolarHBondContact O-CB 3.41Å; S351-L355 VanDerWaalsContact O-CG 3.28Å; S351-L355 WeakPolarHBondContact O-CG 3.33Å; S351-L355 PolarHBondContact O-N 2.92Å
352	I	93.6	Very high	91.2	Very high	92 Å²	92	58.4 Å²	58.4	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-61.5	-45.3	174.1	-68.7	167.3	0	0	0	110.3	L348 L349 L355 L356	L348-I352 HydrophobicContact CD1-CD1 4.41Å; L348-I352 HydrophobicContact CG-CD1 4.06Å; L348-I352 WeakPolarHBondContact O-CG1 3.32Å; L348-I352 PolarHBondContact O-N 2.93Å; L349-I352 PolarHBondContact O-N 2.88Å; I352-L355 PolarHBondContact O-N 2.91Å; I352-L356 WeakPolarHBondContact O-CB 2.98Å; I352-L356 PolarHBondContact O-N 3.32Å
353	L	94.3	Very high	91.4	Very high	58 Å²	58	56.8 Å²	56.8	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-43.1	178.9	-70.8	171.2	0	0	0	112.3	I328 L349 H350 S351 L357	I328-L353 HydrophobicContact CD1-CB 4.21Å; I328-L353 HydrophobicContact CG1-CB 4.44Å; I328-L353 HydrophobicContact CG2-CB 4.15Å; L349-L353 HydrophobicContact CD1-CD1 4.25Å; L349-L353 HydrophobicContact CD1-CG 4.31Å; L349-L353 HydrophobicContact CG-CD1 4.02Å; L349-L353 HydrophobicContact CG-CG 4.49Å; L349-L353 WeakPolarHBondContact O-CB 3.28Å; L349-L353 VanDerWaalsContact O-CG 3.27Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.32Å; H350-L353 PolarHBondContact O-N 3Å; S351-L353 VanDerWaalsContact C-N 3.34Å; L353-L357 VanDerWaalsContact O-CB 3.26Å; L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 3.34Å
354	V	94.9	Very high	91.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.6	-48.2	176.8	169.4	0	0	0	0	110.7	Y276 F321 A325 I328 H350 S351 L357 A358	Y276-V354 HydrophobicContact CE2-CG1 4.34Å; Y276-V354 HydrophobicContact CE2-CG2 4.18Å; F321-V354 HydrophobicContact CD2-CG1 4.27Å; F321-V354 HydrophobicContact CE2-CG1 3.86Å; A325-V354 HydrophobicContact CB-CG1 4.15Å; I328-V354 HydrophobicContact CB-CG2 3.77Å; I328-V354 HydrophobicContact CG1-CG2 3.98Å; I328-V354 HydrophobicContact CG2-CG2 4.01Å; H350-V354 VanDerWaalsContact O-CG2 3.3Å; H350-V354 WeakPolarHBondContact O-CG2 3.21Å; H350-V354 PolarHBondContact O-N 2.98Å; S351-V354 PolarHBondContact O-N 3.49Å; V354-L357 PolarHBondContact O-N 3.02Å; V354-A358 WeakPolarHBondContact O-CB 3.47Å; V354-A358 PolarHBondContact O-N 3.36Å
355	L	94.5	Very high	91.7	Very high	107 Å²	107	59.4 Å²	59.4	56%	0.56	32%	0.322	S	S	*	.	H	α-helix	trans	-66.4	-41.3	-179.7	-68.2	175.5	0	0	0	112.2	F321 S351 I352 A358 F359	F321-L355 HydrophobicContact CE2-CD2 4.42Å; S351-L355 WeakPolarHBondContact O-CB 3.41Å; S351-L355 VanDerWaalsContact O-CG 3.28Å; S351-L355 WeakPolarHBondContact O-CG 3.33Å; S351-L355 PolarHBondContact O-N 2.92Å; I352-L355 PolarHBondContact O-N 2.91Å; L355-A358 PolarHBondContact O-N 3.27Å; L355-F359 WeakPolarHBondContact O-CB 3.4Å; L355-F359 PolarHBondContact O-N 3Å
356	L	94.6	Very high	91.7	Very high	100 Å²	100	58 Å²	58	52%	0.524	31%	0.305	S	S	.	.	H	α-helix	trans	-65	-45.2	177.5	-177	139.2	0	0	0	111.2	I352 F359 I360	I352-L356 WeakPolarHBondContact O-CB 2.98Å; I352-L356 PolarHBondContact O-N 3.32Å; L356-F359 PolarHBondContact O-N 2.96Å; L356-I360 HydrophobicContact CD2-CD1 3.52Å; L356-I360 HydrophobicContact CG-CD1 4.23Å; L356-I360 VanDerWaalsContact O-CG1 3.3Å; L356-I360 WeakPolarHBondContact O-CG1 3.36Å; L356-I360 PolarHBondContact O-N 3.44Å
357	L	95.1	Very high	91.6	Very high	38 Å²	38	63.3 Å²	63.3	20%	0.199	33%	0.328	C	S	.	.	H	α-helix	trans	-65.1	-42.6	175.7	-178.9	62.1	0	0	0	111.4	A324 F327 I328 L353 V354 F359 I360 V361	A324-L357 HydrophobicContact CB-CB 3.99Å; A324-L357 HydrophobicContact CB-CD2 3.97Å; A324-L357 HydrophobicContact CB-CG 3.85Å; F327-L357 HydrophobicContact CB-CD2 4.24Å; F327-L357 HydrophobicContact CD1-CD2 3.52Å; F327-L357 HydrophobicContact CE1-CD2 4.3Å; F327-L357 HydrophobicContact CG-CD2 4.23Å; I328-L357 HydrophobicContact CD1-CB 4.48Å; I328-L357 HydrophobicContact CD1-CD2 3.73Å; I328-L357 HydrophobicContact CG1-CD2 3.84Å; L353-L357 VanDerWaalsContact O-CB 3.26Å; L353-L357 WeakPolarHBondContact O-CB 3.4Å; L353-L357 PolarHBondContact O-N 3.34Å; V354-L357 PolarHBondContact O-N 3.02Å; L357-F359 VanDerWaalsContact C-N 3.29Å; L357-F359 PolarHBondContact O-N 3.11Å; L357-I360 PolarHBondContact O-N 2.88Å; L357-V361 HydrophobicContact CD1-CG2 3.97Å; L357-V361 HydrophobicContact CG-CG2 4.19Å; L357-V361 WeakPolarHBondContact O-CB 3.29Å; L357-V361 VanDerWaalsContact O-CG2 3.29Å; L357-V361 WeakPolarHBondContact O-CG2 3.37Å; L357-V361 PolarHBondContact O-N 3.46Å
358	A	94.8	Very high	91.5	Very high	11 Å²	11	66.1 Å²	66.1	9%	0.091	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-41.6	176.2	0	0	0	0	0	111.5	A324 V354 L355 N362	A324-A358 HydrophobicContact CB-CB 3.82Å; V354-A358 WeakPolarHBondContact O-CB 3.47Å; V354-A358 PolarHBondContact O-N 3.36Å; L355-A358 PolarHBondContact O-N 3.27Å; A358-N362 VanDerWaalsContact O-CB 3.25Å; A358-N362 WeakPolarHBondContact O-CB 3.42Å; A358-N362 PolarHBondContact O-N 2.83Å
359	F	92	Very high	91.2	Very high	146 Å²	146	64 Å²	64	64%	0.64	34%	0.343	S	S	*	.	H	α-helix	trans	-65.2	-44	175.6	178.5	-97.9	0	0	0	112.5	L355 L356 L357 N362 S363	L355-F359 WeakPolarHBondContact O-CB 3.4Å; L355-F359 PolarHBondContact O-N 3Å; L356-F359 PolarHBondContact O-N 2.96Å; L357-F359 VanDerWaalsContact C-N 3.29Å; L357-F359 PolarHBondContact O-N 3.11Å; F359-N362 PolarHBondContact O-N 3.45Å; F359-S363 VanDerWaalsContact O-CB 3.27Å; F359-S363 WeakPolarHBondContact O-CB 3.26Å; F359-S363 PolarHBondContact O-N 2.9Å; F359-S363 PolarHBondContact O-OG 3.31Å
360	I	93.3	Very high	90.6	Very high	72 Å²	72	67.5 Å²	67.5	37%	0.369	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-51.1	176.8	-70.2	170	0	0	0	110.1	L356 L357 N362 S363 L364	L356-I360 HydrophobicContact CD2-CD1 3.52Å; L356-I360 HydrophobicContact CG-CD1 4.23Å; L356-I360 VanDerWaalsContact O-CG1 3.3Å; L356-I360 WeakPolarHBondContact O-CG1 3.36Å; L356-I360 PolarHBondContact O-N 3.44Å; L357-I360 PolarHBondContact O-N 2.88Å; I360-N362 VanDerWaalsContact C-N 3.34Å; I360-N362 PolarHBondContact O-N 2.87Å; I360-S363 PolarHBondContact O-N 3.29Å; I360-L364 HydrophobicContact CG2-CD1 3.66Å; I360-L364 HydrophobicContact CG2-CG 4.2Å; I360-L364 WeakPolarHBondContact O-CB 3.32Å; I360-L364 VanDerWaalsContact O-CG 3.26Å; I360-L364 WeakPolarHBondContact O-CG 3.3Å; I360-L364 PolarHBondContact O-N 3.5Å
361	V	92.7	Very high	89.6	Confident	37 Å²	37	68.6 Å²	68.6	22%	0.224	36%	0.362	C	S	.	.	H	α-helix	trans	-57.7	-47.5	178	171	0	0	0	0	110.2	L357 S363 L364 T365	L357-V361 HydrophobicContact CD1-CG2 3.97Å; L357-V361 HydrophobicContact CG-CG2 4.19Å; L357-V361 WeakPolarHBondContact O-CB 3.29Å; L357-V361 VanDerWaalsContact O-CG2 3.29Å; L357-V361 WeakPolarHBondContact O-CG2 3.37Å; L357-V361 PolarHBondContact O-N 3.46Å; V361-S363 PolarHBondContact O-N 3.44Å; V361-L364 PolarHBondContact O-N 3.3Å; V361-T365 VanDerWaalsContact O-CB 3.29Å; V361-T365 WeakPolarHBondContact O-CB 3.34Å; V361-T365 PolarHBondContact O-N 2.9Å; V361-T365 PolarHBondContact O-OG1 3.29Å
362	N	91.4	Very high	88.1	Confident	10 Å²	10	74.7 Å²	74.7	5%	0.053	38%	0.381	C	S	.	.	H	α-helix	trans	-62	-45.5	179.4	-166.2	-107.3	0	0	0	112.1	G315 S316 S320 A358 F359 I360 T365 K366	G315-N362 PolarHBondContact O-ND2 3.07Å; S316-N362 PolarHBondContact O-ND2 3.39Å; S320-N362 WeakPolarHBondContact OG-CA 3.37Å; S320-N362 WeakPolarHBondContact OG-CB 3.46Å; S320-N362 PolarHBondContact OG-ND2 3.34Å; A358-N362 VanDerWaalsContact O-CB 3.25Å; A358-N362 WeakPolarHBondContact O-CB 3.42Å; A358-N362 PolarHBondContact O-N 2.83Å; F359-N362 PolarHBondContact O-N 3.45Å; I360-N362 VanDerWaalsContact C-N 3.34Å; I360-N362 PolarHBondContact O-N 2.87Å; N362-T365 PolarHBondContact O-N 2.79Å; N362-K366 WeakPolarHBondContact O-CB 3.35Å; N362-K366 VanDerWaalsContact O-CG 3.31Å; N362-K366 WeakPolarHBondContact O-CG 3.23Å; N362-K366 PolarHBondContact O-N 3.16Å; N362-K366 WeakPolarHBondContact OD1-CD 3.48Å; N362-K366 WeakPolarHBondContact OD1-CE 3.48Å; N362-K366 PolarHBondContact OD1-NZ 3.27Å
363	S	87.3	Confident	86.3	Confident	46 Å²	46	71.6 Å²	71.6	32%	0.322	37%	0.367	S	S	.	.	H	α-helix	trans	-65.7	-42.5	-179.1	-60.8	0	0	0	0	112.1	F359 I360 V361 K367	F359-S363 VanDerWaalsContact O-CB 3.27Å; F359-S363 WeakPolarHBondContact O-CB 3.26Å; F359-S363 PolarHBondContact O-N 2.9Å; F359-S363 PolarHBondContact O-OG 3.31Å; I360-S363 PolarHBondContact O-N 3.29Å; V361-S363 PolarHBondContact O-N 3.44Å; S363-K367 VanDerWaalsContact O-CB 3.31Å; S363-K367 WeakPolarHBondContact O-CB 3.45Å; S363-K367 PolarHBondContact O-N 3.45Å
364	L	90	Very high	84.6	Confident	110 Å²	110	69.5 Å²	69.5	58%	0.576	36%	0.356	S	S	*	.	H	α-helix	trans	-65.4	-46.7	176.3	-71	176.4	0	0	0	111.3	I360 V361 K366 K367 A368	I360-L364 HydrophobicContact CG2-CD1 3.66Å; I360-L364 HydrophobicContact CG2-CG 4.2Å; I360-L364 WeakPolarHBondContact O-CB 3.32Å; I360-L364 VanDerWaalsContact O-CG 3.26Å; I360-L364 WeakPolarHBondContact O-CG 3.3Å; I360-L364 PolarHBondContact O-N 3.5Å; V361-L364 PolarHBondContact O-N 3.3Å; L364-K366 PolarHBondContact O-N 3.46Å; L364-K367 PolarHBondContact O-N 3.06Å; L364-A368 WeakPolarHBondContact O-CB 3.44Å; L364-A368 PolarHBondContact O-N 3.48Å
365	T	87.8	Confident	83.2	Confident	39 Å²	39	73.8 Å²	73.8	24%	0.239	38%	0.376	C	S	.	.	H	α-helix	trans	-60.8	-45.6	177.4	-62.3	0	0	0	0	111.2	V361 N362 K367 A368 L369	V361-T365 VanDerWaalsContact O-CB 3.29Å; V361-T365 WeakPolarHBondContact O-CB 3.34Å; V361-T365 PolarHBondContact O-N 2.9Å; V361-T365 PolarHBondContact O-OG1 3.29Å; N362-T365 PolarHBondContact O-N 2.79Å; T365-K367 VanDerWaalsContact C-N 3.34Å; T365-K367 PolarHBondContact O-N 3.18Å; T365-A368 PolarHBondContact O-N 3.3Å; T365-L369 HydrophobicContact CG2-CD1 3.7Å; T365-L369 HydrophobicContact CG2-CG 4.37Å; T365-L369 WeakPolarHBondContact O-CB 3.22Å; T365-L369 WeakPolarHBondContact O-CG 3.23Å; T365-L369 PolarHBondContact O-N 3.47Å
366	K	86.3	Confident	82	Confident	30 Å²	30	69.4 Å²	69.4	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-39.7	176.8	-76.4	179	172.3	172.4	0	112.7	G315 N362 L364 Q370 L371 D374	G315-K366 WeakPolarHBondContact O-CE 3.29Å; N362-K366 WeakPolarHBondContact O-CB 3.35Å; N362-K366 VanDerWaalsContact O-CG 3.31Å; N362-K366 WeakPolarHBondContact O-CG 3.23Å; N362-K366 PolarHBondContact O-N 3.16Å; N362-K366 WeakPolarHBondContact OD1-CD 3.48Å; N362-K366 WeakPolarHBondContact OD1-CE 3.48Å; N362-K366 PolarHBondContact OD1-NZ 3.27Å; L364-K366 PolarHBondContact O-N 3.46Å; K366-Q370 WeakPolarHBondContact O-CA 3.39Å; K366-Q370 PolarHBondContact O-N 3.28Å; K366-L371 HydrophobicContact CB-CB 4.34Å; K366-L371 HydrophobicContact CG-CB 4.19Å; K366-L371 HydrophobicContact CG-CD1 4.25Å; K366-L371 PolarHBondContact O-N 2.73Å; K366-D374 WeakPolarHBondContact CE-OD2 3.18Å; K366-D374 IonicContact NZ-OD2 3.88Å; K366-D374 PolarHBondContact NZ-OD2 3.32Å
367	K	86.7	Confident	80.9	Confident	176 Å²	176	66 Å²	66	77%	0.765	34%	0.335	S	S	*	.	H	α-helix	trans	-67.5	-41.8	176.1	-169.2	175.4	-178.3	-179.7	0	111.9	S363 L364 T365 Q370	S363-K367 VanDerWaalsContact O-CB 3.31Å; S363-K367 WeakPolarHBondContact O-CB 3.45Å; S363-K367 PolarHBondContact O-N 3.45Å; L364-K367 PolarHBondContact O-N 3.06Å; T365-K367 VanDerWaalsContact C-N 3.34Å; T365-K367 PolarHBondContact O-N 3.18Å; K367-Q370 PolarHBondContact O-N 2.89Å
368	A	87.2	Confident	79.8	Confident	82 Å²	82	68.6 Å²	68.6	68%	0.678	35%	0.345	S	S	*	.	H	α-helix	trans	-65.7	-40.6	178.1	0	0	0	0	0	112.2	L364 T365	L364-A368 WeakPolarHBondContact O-CB 3.44Å; L364-A368 PolarHBondContact O-N 3.48Å; T365-A368 PolarHBondContact O-N 3.3Å
369	L	82.8	Confident	78.9	Confident	68 Å²	68	72.1 Å²	72.1	36%	0.356	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	3	-179.7	-62.2	177.7	0	0	0	113.8	L314 T365 L371	L314-L369 HydrophobicContact CB-CD1 3.83Å; L314-L369 HydrophobicContact CD1-CD1 4.4Å; T365-L369 HydrophobicContact CG2-CD1 3.7Å; T365-L369 HydrophobicContact CG2-CG 4.37Å; T365-L369 WeakPolarHBondContact O-CB 3.22Å; T365-L369 WeakPolarHBondContact O-CG 3.23Å; T365-L369 PolarHBondContact O-N 3.47Å; L369-L371 HydrophobicContact CB-CD1 3.86Å; L369-L371 HydrophobicContact CB-CG 3.77Å; L369-L371 HydrophobicContact CD1-CD1 3.96Å; L369-L371 PolarHBondContact O-N 3.28Å
370	Q	78.2	Confident	78.2	Confident	166 Å²	166	66.3 Å²	66.3	78%	0.776	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	35	-176	-59	-174.9	-2.4	0	0	114.3	K366 K367 R372	K366-Q370 WeakPolarHBondContact O-CA 3.39Å; K366-Q370 PolarHBondContact O-N 3.28Å; K367-Q370 PolarHBondContact O-N 2.89Å; Q370-R372 PolarHBondContact O-N 3.44Å
371	L	71.9	Confident	77.4	Confident	25 Å²	25	66.4 Å²	66.4	13%	0.131	33%	0.333	C	S	.	.			trans	-75.7	111.3	-176.9	-70.3	169.4	0	0	0	111	S311 K366 L369	S311-L371 WeakPolarHBondContact O-CD1 3.4Å; S311-L371 WeakPolarHBondContact OG-CD2 3.21Å; K366-L371 HydrophobicContact CB-CB 4.34Å; K366-L371 HydrophobicContact CG-CB 4.19Å; K366-L371 HydrophobicContact CG-CD1 4.25Å; K366-L371 PolarHBondContact O-N 2.73Å; L369-L371 HydrophobicContact CB-CD1 3.86Å; L369-L371 HydrophobicContact CB-CG 3.77Å; L369-L371 HydrophobicContact CD1-CD1 3.96Å; L369-L371 PolarHBondContact O-N 3.28Å
372	R	60.9	Low	76.7	Confident	156 Å²	156	69.8 Å²	69.8	59%	0.589	35%	0.345	S	S	*	.			trans	-108.5	-2.1	174.6	-65.2	-178.7	177.4	173.3	-2.5	113.6	Q370 K607	Q370-R372 PolarHBondContact O-N 3.44Å; R372-K607 HydrophobicContact CB-CD 4.24Å
373	S	56	Low	76	Confident	26 Å²	26	70.3 Å²	70.3	18%	0.182	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-39.3	-170.3	-50	0	0	0	0	112.8	E375 H376 R610	S373-E375 VanDerWaalsContact C-N 3.29Å; S373-E375 PolarHBondContact O-N 3.32Å; S373-H376 PolarHBondContact O-CE1 2.89Å; S373-H376 PolarHBondContact O-ND1 3.41Å; S373-R610 PolarHBondContact O-NH2 2.84Å
374	D	59.3	Low	75.6	Confident	15 Å²	15	70.3 Å²	70.3	8%	0.08	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-10.6	-176.4	-64.3	-11.2	0	0	0	115	K366 H376 I377 F378	K366-D374 WeakPolarHBondContact CE-OD2 3.18Å; K366-D374 IonicContact NZ-OD2 3.88Å; K366-D374 PolarHBondContact NZ-OD2 3.32Å; D374-H376 PolarHBondContact O-N 3.22Å; D374-I377 PolarHBondContact O-N 3.48Å; D374-F378 HydrophobicContact CB-CD2 4.39Å; D374-F378 HydrophobicContact CB-CE2 4.13Å; D374-F378 WeakPolarHBondContact O-CD2 3.47Å; D374-F378 PolarHBondContact O-N 2.92Å
375	E	64.8	Low	75	Confident	90 Å²	90	71.1 Å²	71.1	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-54.1	-33.9	-176	-73.3	179	-179.9	0	0	111.7	S373 F378 K379	S373-E375 VanDerWaalsContact C-N 3.29Å; S373-E375 PolarHBondContact O-N 3.32Å; E375-F378 PolarHBondContact O-N 3.32Å; E375-K379 WeakPolarHBondContact O-CB 3.32Å; E375-K379 VanDerWaalsContact O-CG 3.25Å; E375-K379 WeakPolarHBondContact O-CG 3.46Å; E375-K379 PolarHBondContact O-N 3.13Å
376	H	69.2	Low	74.3	Confident	15 Å²	15	73.7 Å²	73.7	7%	0.069	37%	0.368	C	S	.	.	H	α-helix	trans	-67.8	-35	-179.4	76.4	-81.6	0	0	0	113.9	S373 D374 F378 K379 F380 R610	S373-H376 PolarHBondContact O-CE1 2.89Å; S373-H376 PolarHBondContact O-ND1 3.41Å; D374-H376 PolarHBondContact O-N 3.22Å; H376-F378 VanDerWaalsContact C-N 3.35Å; H376-K379 PolarHBondContact O-N 2.89Å; H376-F380 VanDerWaalsContact O-CB 3.22Å; H376-F380 WeakPolarHBondContact O-CB 3.15Å; H376-F380 PolarHBondContact O-N 3.4Å; H376-R610 VanDerWaalsContact CB-CZ 3.48Å; H376-R610 VanDerWaalsContact CB-NH1 3.27Å; H376-R610 PolarHBondContact ND1-NH2 2.91Å
377	I	71.1	Confident	73.2	Confident	27 Å²	27	78.6 Å²	78.6	14%	0.138	39%	0.394	C	S	.	.	H	α-helix	trans	-66.6	-43.8	177.9	-56.9	179	0	0	0	108.9	F266 D374 F380 I381	F266-I377 HydrophobicContact CE2-CD1 3.89Å; F266-I377 HydrophobicContact CZ-CD1 3.58Å; F266-I377 HydrophobicContact CZ-CG2 4.23Å; D374-I377 PolarHBondContact O-N 3.48Å; I377-F380 PolarHBondContact O-N 3.42Å; I377-I381 HydrophobicContact CG2-CD1 4.02Å; I377-I381 VanDerWaalsContact O-CG1 3.27Å; I377-I381 WeakPolarHBondContact O-CG1 3.32Å; I377-I381 PolarHBondContact O-N 3.47Å
378	F	72.9	Confident	71.9	Confident	94 Å²	94	71 Å²	71	41%	0.412	37%	0.366	S	S	.	.	H	α-helix	trans	-67.4	-40.5	176.6	-69.7	-74.6	0	0	0	112.4	L317 D374 E375 H376 F380 I381 K382	L317-F378 HydrophobicContact CD1-CZ 3.98Å; L317-F378 HydrophobicContact CD2-CZ 4.17Å; L317-F378 HydrophobicContact CG-CZ 4.46Å; D374-F378 HydrophobicContact CB-CD2 4.39Å; D374-F378 HydrophobicContact CB-CE2 4.13Å; D374-F378 WeakPolarHBondContact O-CD2 3.47Å; D374-F378 PolarHBondContact O-N 2.92Å; E375-F378 PolarHBondContact O-N 3.32Å; H376-F378 VanDerWaalsContact C-N 3.35Å; F378-F380 VanDerWaalsContact C-N 3.35Å; F378-I381 PolarHBondContact O-N 2.9Å; F378-K382 WeakPolarHBondContact O-CB 3.41Å; F378-K382 PolarHBondContact O-N 3.45Å
379	K	74.9	Confident	70.6	Confident	84 Å²	84	70.9 Å²	70.9	37%	0.365	36%	0.358	S	S	.	.	H	α-helix	trans	-62.2	-43.2	173.5	-72.9	-174.4	-175.2	-172.9	0	111.6	E375 H376 K382 S383 D392	E375-K379 WeakPolarHBondContact O-CB 3.32Å; E375-K379 VanDerWaalsContact O-CG 3.25Å; E375-K379 WeakPolarHBondContact O-CG 3.46Å; E375-K379 PolarHBondContact O-N 3.13Å; H376-K379 PolarHBondContact O-N 2.89Å; K379-K382 PolarHBondContact O-N 3.29Å; K379-S383 WeakPolarHBondContact O-CB 3.35Å; K379-S383 PolarHBondContact O-N 3.27Å; K379-S383 PolarHBondContact O-OG 2.61Å; K379-D392 WeakPolarHBondContact CD-OD2 3.45Å; K379-D392 IonicContact NZ-OD2 3.36Å; K379-D392 PolarHBondContact NZ-OD2 2.81Å
380	F	77.7	Confident	69.6	Low	24 Å²	24	72.4 Å²	72.4	11%	0.105	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-50.8	174.3	167.2	-102.3	0	0	0	111.4	H376 I377 F378 K382 S383 K384 Y398 L399 F404	H376-F380 VanDerWaalsContact O-CB 3.22Å; H376-F380 WeakPolarHBondContact O-CB 3.15Å; H376-F380 PolarHBondContact O-N 3.4Å; I377-F380 PolarHBondContact O-N 3.42Å; F378-F380 VanDerWaalsContact C-N 3.35Å; F380-K382 VanDerWaalsContact C-N 3.31Å; F380-K382 PolarHBondContact O-N 3.4Å; F380-S383 PolarHBondContact O-N 3.4Å; F380-K384 HydrophobicContact CE1-CD 4.01Å; F380-K384 HydrophobicContact CZ-CD 3.77Å; F380-K384 VanDerWaalsContact O-CB 3.23Å; F380-K384 WeakPolarHBondContact O-CB 2.93Å; F380-K384 PolarHBondContact O-N 3.22Å; F380-Y398 VanDerWaalsContact CD2-CB 3.45Å; F380-Y398 HydrophobicContact CD2-CG 4.27Å; F380-L399 HydrophobicContact CD2-CD2 4.15Å; F380-L399 HydrophobicContact CD2-CG 4.18Å; F380-L399 HydrophobicContact CE2-CD2 3.7Å; F380-L399 HydrophobicContact CE2-CG 4.05Å; F380-F404 HydrophobicContact CE2-CB 4.31Å; F380-F404 HydrophobicContact CZ-CB 4Å; F380-F404 HydrophobicContact CZ-CD1 4.05Å; F380-F404 HydrophobicContact CZ-CG 4.3Å
381	I	77.2	Confident	69.2	Low	74 Å²	74	68.2 Å²	68.2	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-58.8	-45.9	177.2	-69.4	167.8	0	0	0	110.4	I377 F378 S383 K384 F385	I377-I381 HydrophobicContact CG2-CD1 4.02Å; I377-I381 VanDerWaalsContact O-CG1 3.27Å; I377-I381 WeakPolarHBondContact O-CG1 3.32Å; I377-I381 PolarHBondContact O-N 3.47Å; F378-I381 PolarHBondContact O-N 2.9Å; I381-S383 PolarHBondContact O-N 2.86Å; I381-K384 WeakPolarHBondContact O-CB 3.32Å; I381-K384 PolarHBondContact O-N 3.36Å; I381-F385 HydrophobicContact CG2-CD2 3.88Å; I381-F385 HydrophobicContact CG2-CE2 3.97Å; I381-F385 VanDerWaalsContact O-CD2 3.23Å; I381-F385 WeakPolarHBondContact O-CD2 3.42Å; I381-F385 PolarHBondContact O-N 3.48Å; I381-F385 VanDerWaalsContact O-N 3.07Å
382	K	76.8	Confident	69.6	Low	109 Å²	109	68.2 Å²	68.2	47%	0.474	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-45.7	179.5	-167.9	-179.9	171.3	172.2	0	111	F378 K379 F380 F385 A386 L387 G388	F378-K382 WeakPolarHBondContact O-CB 3.41Å; F378-K382 PolarHBondContact O-N 3.45Å; K379-K382 PolarHBondContact O-N 3.29Å; F380-K382 VanDerWaalsContact C-N 3.31Å; F380-K382 PolarHBondContact O-N 3.4Å; K382-F385 PolarHBondContact O-N 3.35Å; K382-A386 PolarHBondContact O-N 3.27Å; K382-L387 WeakPolarHBondContact CE-O 3.47Å; K382-L387 HydrophobicContact CG-CB 3.68Å; K382-L387 WeakPolarHBondContact CG-O 3.4Å; K382-L387 WeakPolarHBondContact O-CA 3.31Å; K382-L387 WeakPolarHBondContact O-CB 3.48Å; K382-L387 PolarHBondContact O-N 3.06Å; K382-G388 PolarHBondContact O-N 3.42Å
383	S	76.4	Confident	70.7	Confident	20 Å²	20	60.9 Å²	60.9	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-69.8	-34.4	176.3	-62.6	0	0	0	0	112.7	K379 F380 I381 F385 A386	K379-S383 WeakPolarHBondContact O-CB 3.35Å; K379-S383 PolarHBondContact O-N 3.27Å; K379-S383 PolarHBondContact O-OG 2.61Å; F380-S383 PolarHBondContact O-N 3.4Å; I381-S383 PolarHBondContact O-N 2.86Å; S383-F385 VanDerWaalsContact C-N 3.3Å; S383-F385 PolarHBondContact O-N 2.88Å; S383-A386 PolarHBondContact O-N 3.46Å
384	K	79.8	Confident	72.1	Confident	47 Å²	47	60.6 Å²	60.6	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-37.2	175.3	-177	162.7	-179.4	154.6	0	112.6	F380 I381 A386 L399 F404 S484 T485	F380-K384 HydrophobicContact CE1-CD 4.01Å; F380-K384 HydrophobicContact CZ-CD 3.77Å; F380-K384 VanDerWaalsContact O-CB 3.23Å; F380-K384 WeakPolarHBondContact O-CB 2.93Å; F380-K384 PolarHBondContact O-N 3.22Å; I381-K384 WeakPolarHBondContact O-CB 3.32Å; I381-K384 PolarHBondContact O-N 3.36Å; K384-A386 VanDerWaalsContact C-N 3.3Å; K384-L399 HydrophobicContact CB-CD2 3.77Å; K384-L399 HydrophobicContact CG-CD2 4.19Å; K384-F404 PolarHBondContact NZ-O 2.94Å; K384-S484 WeakPolarHBondContact CE-O 3.46Å; K384-S484 PolarHBondContact NZ-O 3.5Å; K384-T485 PolarHBondContact NZ-OG1 3.25Å
385	F	77.3	Confident	73.1	Confident	127 Å²	127	60 Å²	60	56%	0.557	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	15.8	174.3	-67.7	-70.1	0	0	0	113.4	I381 K382 S383 L387	I381-F385 HydrophobicContact CG2-CD2 3.88Å; I381-F385 HydrophobicContact CG2-CE2 3.97Å; I381-F385 VanDerWaalsContact O-CD2 3.23Å; I381-F385 WeakPolarHBondContact O-CD2 3.42Å; I381-F385 PolarHBondContact O-N 3.48Å; I381-F385 VanDerWaalsContact O-N 3.07Å; K382-F385 PolarHBondContact O-N 3.35Å; S383-F385 VanDerWaalsContact C-N 3.3Å; S383-F385 PolarHBondContact O-N 2.88Å; F385-L387 HydrophobicContact CB-CD1 4.16Å; F385-L387 HydrophobicContact CB-CG 4.28Å; F385-L387 PolarHBondContact O-N 3.41Å; F385-L387 VanDerWaalsContact O-N 3.15Å
386	A	73	Confident	74	Confident	93 Å²	93	56.8 Å²	56.8	77%	0.769	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	24.7	-179.2	0	0	0	0	0	114.8	K382 S383 K384	K382-A386 PolarHBondContact O-N 3.27Å; S383-A386 PolarHBondContact O-N 3.46Å; K384-A386 VanDerWaalsContact C-N 3.3Å
387	L	62.8	Low	74.8	Confident	132 Å²	132	57.8 Å²	57.8	69%	0.691	31%	0.307	S	S	*	.			trans	-94.9	-6.2	177.8	-62.8	172.3	0	0	0	112.4	K382 F385	K382-L387 WeakPolarHBondContact CE-O 3.47Å; K382-L387 HydrophobicContact CG-CB 3.68Å; K382-L387 WeakPolarHBondContact CG-O 3.4Å; K382-L387 WeakPolarHBondContact O-CA 3.31Å; K382-L387 WeakPolarHBondContact O-CB 3.48Å; K382-L387 PolarHBondContact O-N 3.06Å; F385-L387 HydrophobicContact CB-CD1 4.16Å; F385-L387 HydrophobicContact CB-CG 4.28Å; F385-L387 PolarHBondContact O-N 3.41Å; F385-L387 VanDerWaalsContact O-N 3.15Å
388	G	60.3	Low	75.2	Confident	16 Å²	16	58.5 Å²	58.5	17%	0.165	31%	0.308	C	S	.	.	S	Bend	trans	-113.8	168.1	-167.5	0	0	0	0	0	114.7	K382 T390	K382-G388 PolarHBondContact O-N 3.42Å; G388-T390 PolarHBondContact O-N 3.14Å
389	P	59.4	Low	75.7	Confident	80 Å²	80	57 Å²	57	52%	0.519	30%	0.304	S	S	.	.			trans	-62	133.7	176.5	25.7	-31.7	0	0	0	110.7	R391	P389-R391 VanDerWaalsContact C-N 3.26Å; P389-R391 PolarHBondContact O-N 3.18Å
390	T	60.9	Low	76.1	Confident	101 Å²	101	54.2 Å²	54.2	62%	0.62	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13.8	-173	50	0	0	0	0	114.1	G388	G388-T390 PolarHBondContact O-N 3.14Å
391	R	71	Confident	76.4	Confident	77 Å²	77	57.4 Å²	57.4	29%	0.291	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	10	-168.3	-62.1	175.2	68	167.6	-2.4	115.6	P389 F393 L664 G667 E677 D679	P389-R391 VanDerWaalsContact C-N 3.26Å; P389-R391 PolarHBondContact O-N 3.18Å; R391-F393 PolarHBondContact O-N 3.04Å; R391-L664 PolarHBondContact NE-O 2.9Å; R391-L664 PolarHBondContact NH2-O 3.08Å; R391-G667 VanDerWaalsContact NH2-CA 3.25Å; R391-E677 IonicContact NH1-OE2 3.31Å; R391-D679 IonicContact CZ-OD2 2.97Å; R391-D679 IonicContact NH1-OD1 3.5Å; R391-D679 IonicContact NH1-OD2 3.46Å; R391-D679 PolarHBondContact NH1-OD2 3.47Å
392	D	80.4	Confident	76.6	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.134	32%	0.321	C	S	.	.			trans	-75.4	113.3	178	-161.7	-10.1	0	0	0	110.7	K379 D394 A395 S396	K379-D392 WeakPolarHBondContact CD-OD2 3.45Å; K379-D392 IonicContact NZ-OD2 3.36Å; K379-D392 PolarHBondContact NZ-OD2 2.81Å; D392-D394 VanDerWaalsContact C-N 3.3Å; D392-D394 PolarHBondContact O-N 2.64Å; D392-A395 HydrophobicContact CB-CB 4.16Å; D392-A395 PolarHBondContact O-N 3.45Å; D392-S396 PolarHBondContact O-N 3.04Å; D392-S396 PolarHBondContact O-OG 2.97Å
393	F	84.4	Confident	76.7	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.009	31%	0.308	C	S	.	.	H	α-helix	trans	-53.5	-45.6	-176.9	175.9	-97	0	0	0	112.3	R391 A395 S396 L397 R614 Y617 L658 L661 L662 A665	R391-F393 PolarHBondContact O-N 3.04Å; F393-A395 PolarHBondContact O-N 3.28Å; F393-S396 PolarHBondContact O-N 3.08Å; F393-L397 HydrophobicContact CE1-CD2 4.47Å; F393-L397 WeakPolarHBondContact O-CB 3.25Å; F393-L397 PolarHBondContact O-N 2.99Å; F393-R614 HydrophobicContact CD1-CB 4.12Å; F393-R614 HydrophobicContact CD1-CG 3.97Å; F393-R614 HydrophobicContact CE1-CB 4.23Å; F393-R614 HydrophobicContact CE1-CG 4.37Å; F393-R614 HydrophobicContact CG-CG 4.33Å; F393-Y617 AromaticContact CZ-CD2 3.97Å; F393-Y617 HydrophobicContact CZ-CD2 3.97Å; F393-L658 HydrophobicContact CE2-CD1 3.9Å; F393-L658 HydrophobicContact CZ-CD1 3.8Å; F393-L661 HydrophobicContact CD2-CB 3.94Å; F393-L661 HydrophobicContact CE2-CB 3.89Å; F393-L662 HydrophobicContact CD2-CD2 4.24Å; F393-L662 HydrophobicContact CE2-CD2 3.71Å; F393-L662 HydrophobicContact CE2-CG 4.03Å; F393-L662 HydrophobicContact CZ-CD2 4.24Å; F393-A665 HydrophobicContact CB-CB 4.05Å; F393-A665 HydrophobicContact CD2-CB 4.4Å
394	D	83.8	Confident	77	Confident	21 Å²	21	57 Å²	57	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-63	-44	-178.1	-72.3	-15.3	0	0	0	111.4	D392 Y398 Y604 R610	D392-D394 VanDerWaalsContact C-N 3.3Å; D392-D394 PolarHBondContact O-N 2.64Å; D394-Y398 WeakPolarHBondContact O-CD2 3.47Å; D394-Y604 HydrophobicContact CB-CE1 4.47Å; D394-Y604 PolarHBondContact OD1-OH 3.12Å; D394-R610 IonicContact OD2-CZ 3.31Å; D394-R610 IonicContact OD2-NH1 3.07Å; D394-R610 PolarHBondContact OD2-NH1 3.33Å
395	A	82.1	Confident	77.2	Confident	3 Å²	3	56 Å²	56	3%	0.025	31%	0.313	C	S	.	.	H	α-helix	trans	-68.5	-43	-179.3	0	0	0	0	0	111	D392 F393 L397 Y398 L399	D392-A395 HydrophobicContact CB-CB 4.16Å; D392-A395 PolarHBondContact O-N 3.45Å; F393-A395 PolarHBondContact O-N 3.28Å; A395-L397 VanDerWaalsContact C-N 3.33Å; A395-L397 PolarHBondContact O-N 3.27Å; A395-Y398 PolarHBondContact O-N 3.24Å; A395-L399 WeakPolarHBondContact O-CG 3.2Å; A395-L399 PolarHBondContact O-N 2.94Å
396	S	83.4	Confident	77.8	Confident	21 Å²	21	56.5 Å²	56.5	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-67.1	-32.6	179.4	-58.5	0	0	0	0	112.7	D392 F393 Y398 L399 C400	D392-S396 PolarHBondContact O-N 3.04Å; D392-S396 PolarHBondContact O-OG 2.97Å; F393-S396 PolarHBondContact O-N 3.08Å; S396-Y398 VanDerWaalsContact C-N 3.26Å; S396-Y398 PolarHBondContact O-N 2.97Å; S396-L399 PolarHBondContact O-N 3.15Å; S396-C400 VanDerWaalsContact O-CB 3.29Å; S396-C400 WeakPolarHBondContact O-CB 3.39Å; S396-C400 PolarHBondContact O-N 2.87Å; S396-C400 PolarHBondContact O-SG 3.48Å
397	L	84.7	Confident	78.7	Confident	36 Å²	36	52.8 Å²	52.8	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-58	-39.7	173.8	-171.6	68.3	0	0	0	111.7	F393 A395 Y604 L658 L661	F393-L397 HydrophobicContact CE1-CD2 4.47Å; F393-L397 WeakPolarHBondContact O-CB 3.25Å; F393-L397 PolarHBondContact O-N 2.99Å; A395-L397 VanDerWaalsContact C-N 3.33Å; A395-L397 PolarHBondContact O-N 3.27Å; L397-Y604 HydrophobicContact CD2-CE1 4.23Å; L397-L658 HydrophobicContact CD1-CD1 4.16Å; L397-L661 HydrophobicContact CD1-CD1 4.34Å
398	Y	80.3	Confident	80	Confident	42 Å²	42	49.2 Å²	49.2	17%	0.165	27%	0.272	C	S	.	.	H	α-helix	trans	-76.8	-41.6	175.1	-73.4	-71.8	0	0	0	113	F380 D394 A395 S396 C400 E401 F404 Y604	F380-Y398 VanDerWaalsContact CD2-CB 3.45Å; F380-Y398 HydrophobicContact CD2-CG 4.27Å; D394-Y398 WeakPolarHBondContact O-CD2 3.47Å; A395-Y398 PolarHBondContact O-N 3.24Å; S396-Y398 VanDerWaalsContact C-N 3.26Å; S396-Y398 PolarHBondContact O-N 2.97Å; Y398-C400 VanDerWaalsContact C-N 3.28Å; Y398-C400 PolarHBondContact O-N 3.48Å; Y398-E401 PolarHBondContact O-N 2.84Å; Y398-F404 AromaticContact CD1-CD2 3.95Å; Y398-F404 HydrophobicContact CD1-CD2 3.95Å; Y398-F404 HydrophobicContact CD1-CE1 4.22Å; Y398-F404 AromaticContact CD1-CE2 3.5Å; Y398-F404 HydrophobicContact CD1-CE2 3.5Å; Y398-F404 VanDerWaalsContact CD1-CE2 3.5Å; Y398-F404 HydrophobicContact CD1-CG 4.48Å; Y398-F404 AromaticContact CD1-CZ 3.64Å; Y398-F404 HydrophobicContact CD1-CZ 3.64Å; Y398-F404 HydrophobicContact CE1-CE2 4.03Å; Y398-F404 AromaticContact CE1-CZ 3.88Å; Y398-F404 HydrophobicContact CE1-CZ 3.88Å; Y398-F404 WeakPolarHBondContact O-CB 3.5Å; Y398-Y604 HydrophobicContact CE2-CD1 4.12Å; Y398-Y604 HydrophobicContact CE2-CE1 4.43Å
399	L	82.5	Confident	81.4	Confident	64 Å²	64	55.1 Å²	55.1	34%	0.335	30%	0.3	S	S	.	.	H	α-helix	trans	-66.7	-29.8	-177	-71	170.5	0	0	0	113.4	F380 K384 A395 S396 E401	F380-L399 HydrophobicContact CD2-CD2 4.15Å; F380-L399 HydrophobicContact CD2-CG 4.18Å; F380-L399 HydrophobicContact CE2-CD2 3.7Å; F380-L399 HydrophobicContact CE2-CG 4.05Å; K384-L399 HydrophobicContact CB-CD2 3.77Å; K384-L399 HydrophobicContact CG-CD2 4.19Å; A395-L399 WeakPolarHBondContact O-CG 3.2Å; A395-L399 PolarHBondContact O-N 2.94Å; S396-L399 PolarHBondContact O-N 3.15Å; L399-E401 VanDerWaalsContact C-N 3.34Å
400	C	84	Confident	83	Confident	25 Å²	25	55.4 Å²	55.4	17%	0.169	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.6	179	-74.1	0	0	0	0	114	S396 Y398 C656	S396-C400 VanDerWaalsContact O-CB 3.29Å; S396-C400 WeakPolarHBondContact O-CB 3.39Å; S396-C400 PolarHBondContact O-N 2.87Å; S396-C400 PolarHBondContact O-SG 3.48Å; Y398-C400 VanDerWaalsContact C-N 3.28Å; Y398-C400 PolarHBondContact O-N 3.48Å; C400-C656 VanDerWaalsContact CA-SG 3.55Å; C400-C656 HydrophobicContact CB-CB 3.43Å; C400-C656 VanDerWaalsContact CB-CB 3.43Å; C400-C656 WeakPolarHBondContact CB-SG 3.45Å; C400-C656 WeakPolarHBondContact SG-CA 3.24Å; C400-C656 WeakPolarHBondContact SG-CB 3.48Å; C400-C656 CovalentContact SG-SG 2.05Å; C400-C656 PolarHBondContact SG-SG 3.33Å
401	E	84.6	Confident	84.5	Confident	91 Å²	91	50.6 Å²	50.6	43%	0.425	27%	0.267	S	S	.	.	S	Bend	trans	-86.6	125.4	176.3	-174.8	65.8	-133.2	0	0	110.1	Y398 L399 A403 F404	Y398-E401 PolarHBondContact O-N 2.84Å; L399-E401 VanDerWaalsContact C-N 3.34Å; E401-A403 HydrophobicContact CG-CB 4.13Å; E401-A403 PolarHBondContact O-N 2.92Å; E401-A403 VanDerWaalsContact O-N 3.07Å; E401-F404 HydrophobicContact CB-CD2 4.11Å; E401-F404 HydrophobicContact CG-CD2 4.21Å; E401-F404 PolarHBondContact O-N 3.41Å
402	E	80.3	Confident	85.6	Confident	130 Å²	130	48.9 Å²	48.9	61%	0.607	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-56.8	-31.2	-175.4	-68.4	176.9	-178.1	0	0	112.6	F404 G405	E402-F404 PolarHBondContact O-N 3.37Å; E402-G405 PolarHBondContact O-N 2.87Å; E402-G405 VanDerWaalsContact O-N 3.09Å
403	A	79.1	Confident	86.2	Confident	25 Å²	25	54.5 Å²	54.5	21%	0.207	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.4	-26.7	177.7	0	0	0	0	0	113.8	E401 R487	E401-A403 HydrophobicContact CG-CB 4.13Å; E401-A403 PolarHBondContact O-N 2.92Å; E401-A403 VanDerWaalsContact O-N 3.07Å; A403-R487 HydrophobicContact CB-CB 4.43Å; A403-R487 VanDerWaalsContact O-CB 3.22Å; A403-R487 WeakPolarHBondContact O-CB 3.41Å; A403-R487 PolarHBondContact O-N 3.12Å
404	F	82.9	Confident	86.7	Confident	40 Å²	40	57.9 Å²	57.9	18%	0.175	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-102.4	0.2	179.3	-65.2	-83.3	0	0	0	113.7	F380 K384 Y398 E401 E402 T485	F380-F404 HydrophobicContact CE2-CB 4.31Å; F380-F404 HydrophobicContact CZ-CB 4Å; F380-F404 HydrophobicContact CZ-CD1 4.05Å; F380-F404 HydrophobicContact CZ-CG 4.3Å; K384-F404 PolarHBondContact NZ-O 2.94Å; Y398-F404 AromaticContact CD1-CD2 3.95Å; Y398-F404 HydrophobicContact CD1-CD2 3.95Å; Y398-F404 HydrophobicContact CD1-CE1 4.22Å; Y398-F404 AromaticContact CD1-CE2 3.5Å; Y398-F404 HydrophobicContact CD1-CE2 3.5Å; Y398-F404 VanDerWaalsContact CD1-CE2 3.5Å; Y398-F404 HydrophobicContact CD1-CG 4.48Å; Y398-F404 AromaticContact CD1-CZ 3.64Å; Y398-F404 HydrophobicContact CD1-CZ 3.64Å; Y398-F404 HydrophobicContact CE1-CE2 4.03Å; Y398-F404 AromaticContact CE1-CZ 3.88Å; Y398-F404 HydrophobicContact CE1-CZ 3.88Å; Y398-F404 WeakPolarHBondContact O-CB 3.5Å; E401-F404 HydrophobicContact CB-CD2 4.11Å; E401-F404 HydrophobicContact CG-CD2 4.21Å; E401-F404 PolarHBondContact O-N 3.41Å; E402-F404 PolarHBondContact O-N 3.37Å; F404-T485 HydrophobicContact CD1-CG2 4.05Å
405	G	84.9	Confident	87.2	Confident	26 Å²	26	56.9 Å²	56.9	27%	0.268	30%	0.296	S	S	.	.	S	Bend	trans	-70.7	-178	173.8	0	0	0	0	0	113.5	E402 T485 M486	E402-G405 PolarHBondContact O-N 2.87Å; E402-G405 VanDerWaalsContact O-N 3.09Å; G405-T485 CarbonylContact O-C 3.55Å; G405-T485 WeakPolarHBondContact O-CA 3.18Å; G405-M486 PolarHBondContact O-N 2.87Å
406	L	89.3	Confident	87.8	Confident	136 Å²	136	57.4 Å²	57.4	71%	0.712	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-68.4	155.9	173.3	-66.1	173.2	0	0	0	111.1	P408 F483	L406-P408 WeakPolarHBondContact O-CD 3.32Å; L406-F483 WeakPolarHBondContact CD2-O 3.35Å
407	L	91.2	Very high	88.2	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-66	123.6	176.5	-168.2	73	0	0	0	110.9	T411 F483 M486 K489 W492	L407-T411 HydrophobicContact CD1-CG2 4.19Å; L407-T411 HydrophobicContact CD2-CG2 4.41Å; L407-T411 HydrophobicContact CG-CG2 4.46Å; L407-F483 HydrophobicContact CB-CD1 4.2Å; L407-F483 HydrophobicContact CD2-CD1 4.07Å; L407-F483 HydrophobicContact CD2-CE1 4.01Å; L407-F483 HydrophobicContact CD2-CZ 4.39Å; L407-F483 PolarHBondContact N-O 2.89Å; L407-M486 HydrophobicContact CD1-CG 4.31Å; L407-K489 HydrophobicContact CD1-CB 4Å; L407-K489 HydrophobicContact CD1-CD 4.15Å; L407-W492 HydrophobicContact CD2-CZ3 3.99Å
408	P	90.8	Very high	88.7	Confident	57 Å²	57	56.2 Å²	56.2	37%	0.37	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-70.6	140.7	177.3	26.8	-31.4	0	0	0	110.9	L406 D410 T411	L406-P408 WeakPolarHBondContact O-CD 3.32Å; P408-D410 PolarHBondContact O-N 3.27Å; P408-T411 VanDerWaalsContact O-CB 3.23Å; P408-T411 WeakPolarHBondContact O-CB 3.39Å; P408-T411 PolarHBondContact O-N 2.61Å; P408-T411 PolarHBondContact O-OG1 3.01Å
409	L	89.9	Confident	89.3	Confident	140 Å²	140	56.1 Å²	56.1	73%	0.733	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.4	-177.5	-66	178.1	0	0	0	113.5	T411 L412 E413	L409-T411 PolarHBondContact O-N 3.42Å; L409-T411 VanDerWaalsContact O-N 3.15Å; L409-L412 HydrophobicContact CD2-CD1 4.26Å; L409-L412 WeakPolarHBondContact O-CB 3.47Å; L409-L412 PolarHBondContact O-N 3.2Å; L409-E413 PolarHBondContact O-N 2.97Å
410	D	93.1	Very high	90	Very high	87 Å²	87	53.1 Å²	53.1	47%	0.465	29%	0.286	S	S	.	.	H	α-helix	trans	-55.6	-27.8	172.3	174.6	39.8	0	0	0	112.4	P408 L412 E413 R414	P408-D410 PolarHBondContact O-N 3.27Å; D410-L412 VanDerWaalsContact C-N 3.35Å; D410-L412 PolarHBondContact O-N 3.19Å; D410-E413 PolarHBondContact O-N 2.85Å; D410-R414 WeakPolarHBondContact O-CG 3.17Å; D410-R414 PolarHBondContact O-N 3.04Å; D410-R414 IonicContact OD1-NH1 3.09Å; D410-R414 PolarHBondContact OD1-NH1 3.08Å; D410-R414 IonicContact OD2-CZ 3.59Å; D410-R414 IonicContact OD2-NH1 2.69Å; D410-R414 PolarHBondContact OD2-NH1 2.67Å
411	T	92.3	Very high	90.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-44.6	170.6	-47.2	0	0	0	0	111.6	L407 P408 L409 E413 R414 L415	L407-T411 HydrophobicContact CD1-CG2 4.19Å; L407-T411 HydrophobicContact CD2-CG2 4.41Å; L407-T411 HydrophobicContact CG-CG2 4.46Å; P408-T411 VanDerWaalsContact O-CB 3.23Å; P408-T411 WeakPolarHBondContact O-CB 3.39Å; P408-T411 PolarHBondContact O-N 2.61Å; P408-T411 PolarHBondContact O-OG1 3.01Å; L409-T411 PolarHBondContact O-N 3.42Å; L409-T411 VanDerWaalsContact O-N 3.15Å; T411-E413 VanDerWaalsContact C-N 3.32Å; T411-E413 PolarHBondContact O-N 3.29Å; T411-R414 PolarHBondContact O-N 3.23Å; T411-L415 HydrophobicContact CG2-CD1 4.07Å; T411-L415 WeakPolarHBondContact O-CG 3.37Å; T411-L415 PolarHBondContact O-N 3.41Å; T411-L415 VanDerWaalsContact O-N 3.09Å
412	L	93.9	Very high	91	Very high	40 Å²	40	55.9 Å²	55.9	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-34.1	179.9	-61	177.3	0	0	0	111.3	L409 D410 L415 A416 L421 F483 W492	L409-L412 HydrophobicContact CD2-CD1 4.26Å; L409-L412 WeakPolarHBondContact O-CB 3.47Å; L409-L412 PolarHBondContact O-N 3.2Å; D410-L412 VanDerWaalsContact C-N 3.35Å; D410-L412 PolarHBondContact O-N 3.19Å; L412-L415 PolarHBondContact O-N 2.86Å; L412-A416 WeakPolarHBondContact O-CB 3.41Å; L412-A416 PolarHBondContact O-N 3.39Å; L412-L421 HydrophobicContact CB-CD2 4.22Å; L412-L421 HydrophobicContact CD2-CD1 4.31Å; L412-F483 HydrophobicContact CD1-CE1 4.2Å; L412-F483 HydrophobicContact CD1-CZ 4.24Å; L412-F483 HydrophobicContact CD2-CZ 4.15Å; L412-W492 HydrophobicContact CD2-CH2 4.46Å
413	E	93.8	Very high	91.6	Very high	143 Å²	143	50.8 Å²	50.8	67%	0.668	27%	0.27	S	S	*	.	H	α-helix	trans	-63.4	-46.4	175.1	-172.6	173.1	176.5	0	0	111.6	L409 D410 T411 L415 A416 G417	L409-E413 PolarHBondContact O-N 2.97Å; D410-E413 PolarHBondContact O-N 2.85Å; T411-E413 VanDerWaalsContact C-N 3.32Å; T411-E413 PolarHBondContact O-N 3.29Å; E413-L415 PolarHBondContact O-N 2.9Å; E413-A416 PolarHBondContact O-N 3.49Å; E413-G417 PolarHBondContact O-N 3.22Å
414	R	93.9	Very high	92.5	Very high	73 Å²	73	50.4 Å²	50.4	28%	0.275	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-45.8	173.9	-71	-166.7	-60.6	-84.5	1.1	112.6	D204 D410 T411 A416 G417 T418	D204-R414 IonicContact OD1-CZ 3.84Å; D204-R414 IonicContact OD1-NE 3.93Å; D204-R414 IonicContact OD1-NH2 3.02Å; D204-R414 PolarHBondContact OD1-NH2 3.14Å; D204-R414 IonicContact OD2-CZ 2.74Å; D204-R414 IonicContact OD2-NE 3.22Å; D204-R414 PolarHBondContact OD2-NE 3.15Å; D204-R414 IonicContact OD2-NH2 3.58Å; D204-R414 PolarHBondContact OD2-NH2 3.14Å; D410-R414 WeakPolarHBondContact O-CG 3.17Å; D410-R414 PolarHBondContact O-N 3.04Å; D410-R414 IonicContact OD1-NH1 3.09Å; D410-R414 PolarHBondContact OD1-NH1 3.08Å; D410-R414 IonicContact OD2-CZ 3.59Å; D410-R414 IonicContact OD2-NH1 2.69Å; D410-R414 PolarHBondContact OD2-NH1 2.67Å; T411-R414 PolarHBondContact O-N 3.23Å; R414-A416 VanDerWaalsContact C-N 3.31Å; R414-A416 PolarHBondContact O-N 3.33Å; R414-G417 PolarHBondContact O-N 2.98Å; R414-G417 VanDerWaalsContact O-N 3.16Å; R414-T418 PolarHBondContact O-N 2.86Å
415	L	95.3	Very high	93.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-30.2	178.9	-63.8	170	0	0	0	112.6	N201 T411 L412 E413 T418 L420 L421 T493 M496	N201-L415 HydrophobicContact CB-CD2 4.18Å; T411-L415 HydrophobicContact CG2-CD1 4.07Å; T411-L415 WeakPolarHBondContact O-CG 3.37Å; T411-L415 PolarHBondContact O-N 3.41Å; T411-L415 VanDerWaalsContact O-N 3.09Å; L412-L415 PolarHBondContact O-N 2.86Å; E413-L415 PolarHBondContact O-N 2.9Å; L415-T418 PolarHBondContact O-OG1 3.38Å; L415-L420 HydrophobicContact CD2-CD2 3.92Å; L415-L420 PolarHBondContact O-N 3.36Å; L415-L420 VanDerWaalsContact O-N 3.11Å; L415-L421 HydrophobicContact CB-CB 4.31Å; L415-L421 PolarHBondContact O-N 3.3Å; L415-T493 HydrophobicContact CD2-CG2 3.68Å; L415-M496 HydrophobicContact CB-CE 4.33Å; L415-M496 HydrophobicContact CD1-CE 3.79Å; L415-M496 HydrophobicContact CD1-SD 4.32Å; L415-M496 HydrophobicContact CD2-CE 3.82Å; L415-M496 HydrophobicContact CG-CE 4.19Å
416	A	94.2	Very high	93.5	Very high	15 Å²	15	53.2 Å²	53.2	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-71.3	-40	171	0	0	0	0	0	111.3	L412 E413 R414 T418 L419 L421 Y422	L412-A416 WeakPolarHBondContact O-CB 3.41Å; L412-A416 PolarHBondContact O-N 3.39Å; E413-A416 PolarHBondContact O-N 3.49Å; R414-A416 VanDerWaalsContact C-N 3.31Å; R414-A416 PolarHBondContact O-N 3.33Å; A416-T418 PolarHBondContact O-N 2.87Å; A416-L419 WeakPolarHBondContact O-CA 3.37Å; A416-L419 PolarHBondContact O-N 3.38Å; A416-L421 HydrophobicContact CB-CB 4.21Å; A416-L421 HydrophobicContact CB-CD2 4.1Å; A416-Y422 HydrophobicContact CB-CE2 4.26Å; A416-Y422 WeakPolarHBondContact O-CE2 3.45Å
417	G	92.3	Very high	93.8	Very high	27 Å²	27	47.1 Å²	47.1	28%	0.278	25%	0.248	S	C	.	.	H	α-helix	trans	-57.8	-29.7	178.1	0	0	0	0	0	114.3	E413 R414 L419 W539 F544	E413-G417 PolarHBondContact O-N 3.22Å; R414-G417 PolarHBondContact O-N 2.98Å; R414-G417 VanDerWaalsContact O-N 3.16Å; G417-L419 VanDerWaalsContact C-N 3.35Å; G417-W539 WeakPolarHBondContact O-CH2 3.22Å; G417-F544 WeakPolarHBondContact O-CZ 2.92Å
418	T	93.4	Very high	94	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.025	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	14.2	175.3	58.6	0	0	0	0	113.9	W197 L200 N201 R414 L415 A416 L420 L540 F544	W197-T418 PolarHBondContact NE1-O 3.45Å; L200-T418 HydrophobicContact CB-CG2 4.31Å; N201-T418 VanDerWaalsContact CG-OG1 3.31Å; N201-T418 PolarHBondContact ND2-OG1 2.72Å; N201-T418 WeakPolarHBondContact OD1-CG2 3.24Å; N201-T418 PolarHBondContact OD1-OG1 3.07Å; R414-T418 PolarHBondContact O-N 2.86Å; L415-T418 PolarHBondContact O-OG1 3.38Å; A416-T418 PolarHBondContact O-N 2.87Å; T418-L420 PolarHBondContact O-N 3.23Å; T418-L540 VanDerWaalsContact O-CD2 3.23Å; T418-L540 WeakPolarHBondContact O-CD2 3.37Å; T418-F544 HydrophobicContact CG2-CE1 3.91Å; T418-F544 HydrophobicContact CG2-CE2 4.08Å; T418-F544 HydrophobicContact CG2-CZ 3.55Å
419	L	94.6	Very high	94.2	Very high	41 Å²	41	50.2 Å²	50.2	22%	0.215	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	17.7	-175.2	-58.1	174.6	0	0	0	114.6	A416 G417 Y422 P423 M536 W539	A416-L419 WeakPolarHBondContact O-CA 3.37Å; A416-L419 PolarHBondContact O-N 3.38Å; G417-L419 VanDerWaalsContact C-N 3.35Å; L419-Y422 HydrophobicContact CB-CD2 4.49Å; L419-Y422 HydrophobicContact CD2-CD2 3.7Å; L419-Y422 HydrophobicContact CD2-CE2 3.85Å; L419-P423 WeakPolarHBondContact O-CD 3.3Å; L419-P423 VanDerWaalsContact O-CG 3.29Å; L419-P423 WeakPolarHBondContact O-CG 3.46Å; L419-M536 HydrophobicContact CB-CE 3.95Å; L419-W539 HydrophobicContact CB-CZ3 4.41Å; L419-W539 HydrophobicContact CD1-CD2 3.72Å; L419-W539 HydrophobicContact CD1-CE3 3.25Å; L419-W539 HydrophobicContact CD1-CG 4.42Å; L419-W539 HydrophobicContact CD1-CH2 3.97Å; L419-W539 HydrophobicContact CD1-CZ2 4.39Å; L419-W539 HydrophobicContact CD1-CZ3 3.43Å; L419-W539 VanDerWaalsContact CD1-CZ3 3.43Å; L419-W539 HydrophobicContact CD2-CH2 4.1Å; L419-W539 HydrophobicContact CD2-CZ3 4.28Å; L419-W539 HydrophobicContact CG-CE3 3.8Å; L419-W539 HydrophobicContact CG-CH2 3.68Å; L419-W539 HydrophobicContact CG-CZ2 4.43Å; L419-W539 HydrophobicContact CG-CZ3 3.37Å
420	L	96	Very high	94.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.			trans	-83.5	-41	-177.2	171.3	61.3	0	0	0	110.9	W197 L415 T418 Y422 P423 Y424 M496 A500	W197-L420 HydrophobicContact CB-CD1 4.44Å; W197-L420 HydrophobicContact CB-CD2 4.44Å; W197-L420 HydrophobicContact CD2-CB 4.33Å; W197-L420 HydrophobicContact CD2-CD1 3.63Å; W197-L420 HydrophobicContact CD2-CG 4.46Å; W197-L420 HydrophobicContact CE3-CD1 3.59Å; W197-L420 HydrophobicContact CG-CB 4.29Å; W197-L420 HydrophobicContact CG-CD1 4.05Å; W197-L420 HydrophobicContact CH2-CD1 4.28Å; W197-L420 HydrophobicContact CZ2-CD1 4.3Å; W197-L420 HydrophobicContact CZ3-CD1 3.94Å; L415-L420 HydrophobicContact CD2-CD2 3.92Å; L415-L420 PolarHBondContact O-N 3.36Å; L415-L420 VanDerWaalsContact O-N 3.11Å; T418-L420 PolarHBondContact O-N 3.23Å; L420-Y422 PolarHBondContact O-N 3.22Å; L420-P423 VanDerWaalsContact O-CD 3.27Å; L420-P423 WeakPolarHBondContact O-CD 3.35Å; L420-P423 WeakPolarHBondContact O-CG 3.37Å; L420-Y424 WeakPolarHBondContact O-CB 3.44Å; L420-Y424 PolarHBondContact O-N 2.6Å; L420-M496 HydrophobicContact CD1-CE 4.18Å; L420-M496 HydrophobicContact CD2-CE 3.25Å; L420-M496 HydrophobicContact CG-CE 3.4Å; L420-M496 VanDerWaalsContact CG-CE 3.4Å; L420-A500 HydrophobicContact CD1-CB 3.5Å
421	L	95.6	Very high	94.4	Very high	31 Å²	31	42.2 Å²	42.2	16%	0.162	22%	0.22	C	C	.	.	H	α-helix	trans	-65.1	-38.7	-179	-170.7	66.3	0	0	0	112.8	L412 L415 A416 Y424 V425	L412-L421 HydrophobicContact CB-CD2 4.22Å; L412-L421 HydrophobicContact CD2-CD1 4.31Å; L415-L421 HydrophobicContact CB-CB 4.31Å; L415-L421 PolarHBondContact O-N 3.3Å; A416-L421 HydrophobicContact CB-CB 4.21Å; A416-L421 HydrophobicContact CB-CD2 4.1Å; L421-Y424 HydrophobicContact CD1-CD1 4.33Å; L421-Y424 PolarHBondContact O-N 2.78Å; L421-V425 HydrophobicContact CD1-CG2 3.78Å; L421-V425 HydrophobicContact CG-CG2 4.11Å; L421-V425 PolarHBondContact O-N 3.11Å
422	Y	93.9	Very high	94.5	Very high	144 Å²	144	44.4 Å²	44.4	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-61.6	-45.6	-176.2	-58.7	-61.3	0	0	0	114.9	A416 L419 L420 P426	A416-Y422 HydrophobicContact CB-CE2 4.26Å; A416-Y422 WeakPolarHBondContact O-CE2 3.45Å; L419-Y422 HydrophobicContact CB-CD2 4.49Å; L419-Y422 HydrophobicContact CD2-CD2 3.7Å; L419-Y422 HydrophobicContact CD2-CE2 3.85Å; L420-Y422 PolarHBondContact O-N 3.22Å; Y422-P426 WeakPolarHBondContact O-CD 3.34Å; Y422-P426 WeakPolarHBondContact O-CG 3.19Å
423	P	94.1	Very high	94.4	Very high	23 Å²	23	44.2 Å²	44.2	15%	0.149	24%	0.242	C	C	.	.	H	α-helix	trans	-77.1	-29.6	171.8	29.3	-35.5	0	0	0	112.3	W197 L419 L420 T427 A500 V504 M536	W197-P423 HydrophobicContact CH2-CG 3.86Å; W197-P423 HydrophobicContact CZ2-CG 4.05Å; L419-P423 WeakPolarHBondContact O-CD 3.3Å; L419-P423 VanDerWaalsContact O-CG 3.29Å; L419-P423 WeakPolarHBondContact O-CG 3.46Å; L420-P423 VanDerWaalsContact O-CD 3.27Å; L420-P423 WeakPolarHBondContact O-CD 3.35Å; L420-P423 WeakPolarHBondContact O-CG 3.37Å; P423-T427 WeakPolarHBondContact O-CB 3.48Å; P423-T427 PolarHBondContact O-N 3.43Å; P423-T427 VanDerWaalsContact O-N 3.16Å; P423-T427 PolarHBondContact O-OG1 2.88Å; P423-A500 HydrophobicContact CG-CB 4.48Å; P423-V504 HydrophobicContact CB-CG2 3.5Å; P423-V504 VanDerWaalsContact CB-CG2 3.5Å; P423-V504 HydrophobicContact CG-CG2 4.08Å; P423-M536 HydrophobicContact CG-CE 4.31Å
424	Y	96.4	Very high	94.2	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-52.3	-177.9	174.4	-106.8	0	0	0	112.7	L420 L421 T427 V428 S475 W492 M496 V499 A500	L420-Y424 WeakPolarHBondContact O-CB 3.44Å; L420-Y424 PolarHBondContact O-N 2.6Å; L421-Y424 HydrophobicContact CD1-CD1 4.33Å; L421-Y424 PolarHBondContact O-N 2.78Å; Y424-T427 WeakPolarHBondContact O-CB 3.45Å; Y424-T427 PolarHBondContact O-N 3.38Å; Y424-V428 HydrophobicContact CD2-CG2 3.91Å; Y424-V428 HydrophobicContact CE1-CG2 4.16Å; Y424-V428 HydrophobicContact CE2-CG2 3.37Å; Y424-V428 PolarHBondContact O-N 2.89Å; Y424-S475 VanDerWaalsContact CE2-OG 3.26Å; Y424-S475 WeakPolarHBondContact CE2-OG 3.36Å; Y424-S475 PolarHBondContact OH-OG 3.35Å; Y424-W492 AromaticContact CE1-CZ2 3.89Å; Y424-W492 HydrophobicContact CE1-CZ2 3.89Å; Y424-W492 AromaticContact CZ-NE1 3.98Å; Y424-W492 PolarHBondContact OH-NE1 2.79Å; Y424-W492 VanDerWaalsContact OH-NE1 3.15Å; Y424-M496 HydrophobicContact CD1-CG 3.8Å; Y424-M496 HydrophobicContact CD1-SD 3.75Å; Y424-M496 HydrophobicContact CD2-CB 4.41Å; Y424-M496 HydrophobicContact CD2-CG 3.28Å; Y424-M496 HydrophobicContact CD2-SD 4.32Å; Y424-M496 HydrophobicContact CE1-CG 3.78Å; Y424-M496 HydrophobicContact CE1-SD 3.82Å; Y424-M496 HydrophobicContact CE2-CB 4.23Å; Y424-M496 HydrophobicContact CE2-CG 3.26Å; Y424-M496 HydrophobicContact CE2-SD 4.39Å; Y424-M496 HydrophobicContact CG-CG 3.55Å; Y424-M496 HydrophobicContact CG-SD 4Å; Y424-V499 HydrophobicContact CD2-CG1 4.47Å; Y424-V499 HydrophobicContact CE2-CB 4.45Å; Y424-V499 HydrophobicContact CE2-CG1 4.28Å; Y424-A500 HydrophobicContact CD2-CB 4.37Å
425	V	95.8	Very high	94.1	Very high	64 Å²	64	36.9 Å²	36.9	39%	0.388	21%	0.213	S	C	.	.	H	α-helix	trans	-60.3	-51.6	-174.8	172	0	0	0	0	112	L421 T427 V428 L429	L421-V425 HydrophobicContact CD1-CG2 3.78Å; L421-V425 HydrophobicContact CG-CG2 4.11Å; L421-V425 PolarHBondContact O-N 3.11Å; V425-T427 VanDerWaalsContact C-N 3.29Å; V425-T427 PolarHBondContact O-N 3.42Å; V425-V428 PolarHBondContact O-N 3.32Å; V425-L429 HydrophobicContact CG1-CD1 3.79Å; V425-L429 HydrophobicContact CG1-CG 4.36Å; V425-L429 WeakPolarHBondContact O-CB 3.47Å; V425-L429 VanDerWaalsContact O-CG 3.27Å; V425-L429 WeakPolarHBondContact O-CG 3.26Å; V425-L429 PolarHBondContact O-N 3.2Å
426	P	94.1	Very high	93.9	Very high	61 Å²	61	39.8 Å²	39.8	40%	0.396	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-38.3	175.1	-23.1	34.6	0	0	0	112.6	Y422 L429 L430	Y422-P426 WeakPolarHBondContact O-CD 3.34Å; Y422-P426 WeakPolarHBondContact O-CG 3.19Å; P426-L429 PolarHBondContact O-N 2.84Å; P426-L430 VanDerWaalsContact O-CB 3.27Å; P426-L430 WeakPolarHBondContact O-CB 3.46Å; P426-L430 WeakPolarHBondContact O-CG 3.3Å; P426-L430 PolarHBondContact O-N 2.74Å
427	T	94.6	Very high	93.7	Very high	8 Å²	8	43.9 Å²	43.9	5%	0.049	26%	0.26	C	S	.	.	H	α-helix	trans	-60.9	-50.3	178.5	-64.4	0	0	0	0	111.2	P423 Y424 V425 L429 L431 V499 G503 L509	P423-T427 WeakPolarHBondContact O-CB 3.48Å; P423-T427 PolarHBondContact O-N 3.43Å; P423-T427 VanDerWaalsContact O-N 3.16Å; P423-T427 PolarHBondContact O-OG1 2.88Å; Y424-T427 WeakPolarHBondContact O-CB 3.45Å; Y424-T427 PolarHBondContact O-N 3.38Å; V425-T427 VanDerWaalsContact C-N 3.29Å; V425-T427 PolarHBondContact O-N 3.42Å; T427-L429 PolarHBondContact O-N 3.19Å; T427-L431 HydrophobicContact CG2-CD1 3.59Å; T427-L431 HydrophobicContact CG2-CG 4.34Å; T427-L431 VanDerWaalsContact O-CB 3.25Å; T427-L431 WeakPolarHBondContact O-CB 3.39Å; T427-L431 WeakPolarHBondContact O-CD1 3.09Å; T427-L431 WeakPolarHBondContact O-CG 3.23Å; T427-L431 PolarHBondContact O-N 3.36Å; T427-V499 HydrophobicContact CG2-CG1 4.16Å; T427-G503 WeakPolarHBondContact OG1-CA 3.3Å; T427-L509 HydrophobicContact CG2-CD1 3.8Å
428	V	95.8	Very high	93.5	Very high	20 Å²	20	43.4 Å²	43.4	12%	0.121	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-42	178.3	172.7	0	0	0	0	111.3	Y424 V425 S432 L472 V476 V499	Y424-V428 HydrophobicContact CD2-CG2 3.91Å; Y424-V428 HydrophobicContact CE1-CG2 4.16Å; Y424-V428 HydrophobicContact CE2-CG2 3.37Å; Y424-V428 PolarHBondContact O-N 2.89Å; V425-V428 PolarHBondContact O-N 3.32Å; V428-S432 WeakPolarHBondContact O-CB 3.28Å; V428-S432 PolarHBondContact O-N 2.94Å; V428-S432 PolarHBondContact O-OG 2.98Å; V428-L472 HydrophobicContact CB-CD1 4.46Å; V428-L472 HydrophobicContact CG1-CD1 4.1Å; V428-L472 HydrophobicContact CG2-CD1 4.48Å; V428-V476 HydrophobicContact CG1-CG2 3.99Å; V428-V499 HydrophobicContact CG2-CG1 4.22Å
429	L	95.1	Very high	93.1	Very high	118 Å²	118	44.6 Å²	44.6	62%	0.618	26%	0.26	S	S	*	.	H	α-helix	trans	-63.5	-48	178.7	-71.1	174	0	0	0	112	V425 P426 T427 S432 G433	V425-L429 HydrophobicContact CG1-CD1 3.79Å; V425-L429 HydrophobicContact CG1-CG 4.36Å; V425-L429 WeakPolarHBondContact O-CB 3.47Å; V425-L429 VanDerWaalsContact O-CG 3.27Å; V425-L429 WeakPolarHBondContact O-CG 3.26Å; V425-L429 PolarHBondContact O-N 3.2Å; P426-L429 PolarHBondContact O-N 2.84Å; T427-L429 PolarHBondContact O-N 3.19Å; L429-S432 PolarHBondContact O-N 3.15Å; L429-G433 PolarHBondContact O-N 3.35Å
430	L	93.3	Very high	92.7	Very high	57 Å²	57	46.7 Å²	46.7	30%	0.298	27%	0.271	S	S	.	.	H	α-helix	trans	-65.6	-44.3	179.1	-71	171.6	0	0	0	111.5	P426 S432 G433 M434 L509 L512 L513	P426-L430 VanDerWaalsContact O-CB 3.27Å; P426-L430 WeakPolarHBondContact O-CB 3.46Å; P426-L430 WeakPolarHBondContact O-CG 3.3Å; P426-L430 PolarHBondContact O-N 2.74Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.39Å; L430-G433 PolarHBondContact O-N 2.94Å; L430-M434 WeakPolarHBondContact O-CG 3.35Å; L430-M434 PolarHBondContact O-N 2.85Å; L430-L509 HydrophobicContact CB-CD2 3.43Å; L430-L509 VanDerWaalsContact CB-CD2 3.43Å; L430-L509 HydrophobicContact CD1-CD2 3.77Å; L430-L509 HydrophobicContact CG-CD2 4.25Å; L430-L512 HydrophobicContact CD2-CD2 4.45Å; L430-L513 HydrophobicContact CD1-CD1 4.39Å; L430-L513 HydrophobicContact CD1-CD2 4.26Å; L430-L513 HydrophobicContact CD1-CG 4.43Å
431	L	93.6	Very high	92.1	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-39	176.7	-70.2	170.2	0	0	0	111.9	T427 M434 L435 F464 V468 L472 Y502 L509	T427-L431 HydrophobicContact CG2-CD1 3.59Å; T427-L431 HydrophobicContact CG2-CG 4.34Å; T427-L431 VanDerWaalsContact O-CB 3.25Å; T427-L431 WeakPolarHBondContact O-CB 3.39Å; T427-L431 WeakPolarHBondContact O-CD1 3.09Å; T427-L431 WeakPolarHBondContact O-CG 3.23Å; T427-L431 PolarHBondContact O-N 3.36Å; L431-M434 HydrophobicContact CD2-CE 3.49Å; L431-M434 VanDerWaalsContact CD2-CE 3.49Å; L431-M434 HydrophobicContact CG-CE 4.24Å; L431-M434 PolarHBondContact O-N 3.36Å; L431-L435 VanDerWaalsContact O-CB 3.3Å; L431-L435 WeakPolarHBondContact O-CB 3.23Å; L431-L435 PolarHBondContact O-N 2.92Å; L431-F464 HydrophobicContact CD2-CE2 4.44Å; L431-F464 HydrophobicContact CD2-CZ 4.21Å; L431-V468 HydrophobicContact CD2-CG1 3.81Å; L431-L472 HydrophobicContact CB-CD1 3.75Å; L431-L472 HydrophobicContact CB-CD2 3.81Å; L431-L472 HydrophobicContact CB-CG 4.31Å; L431-L472 HydrophobicContact CD1-CD1 4.29Å; L431-Y502 HydrophobicContact CD1-CD1 4.06Å; L431-Y502 HydrophobicContact CD1-CE1 3.89Å; L431-Y502 HydrophobicContact CD2-CE1 3.81Å; L431-Y502 HydrophobicContact CG-CE1 4.46Å; L431-L509 HydrophobicContact CD1-CD1 4.49Å; L431-L509 HydrophobicContact CD2-CD1 4.34Å; L431-L509 HydrophobicContact CD2-CD2 4.42Å; L431-L509 HydrophobicContact CD2-CG 4.44Å; L431-L509 HydrophobicContact CG-CD1 4.29Å; L431-L509 HydrophobicContact CG-CD2 4.3Å
432	S	94.3	Very high	91.4	Very high	45 Å²	45	50.5 Å²	50.5	32%	0.315	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-40.5	175.4	-59	0	0	0	0	111.5	V428 L429 L430 L435 A436	V428-S432 WeakPolarHBondContact O-CB 3.28Å; V428-S432 PolarHBondContact O-N 2.94Å; V428-S432 PolarHBondContact O-OG 2.98Å; L429-S432 PolarHBondContact O-N 3.15Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.39Å; S432-L435 PolarHBondContact O-N 2.97Å; S432-A436 WeakPolarHBondContact O-CB 3.22Å; S432-A436 PolarHBondContact O-N 2.98Å
433	G	92.2	Very high	90.6	Very high	36 Å²	36	44.6 Å²	44.6	37%	0.371	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-46.5	173.2	0	0	0	0	0	112.3	L429 L430 L435 A436 V437	L429-G433 PolarHBondContact O-N 3.35Å; L430-G433 PolarHBondContact O-N 2.94Å; G433-L435 PolarHBondContact O-N 2.8Å; G433-A436 PolarHBondContact O-N 3.06Å; G433-V437 WeakPolarHBondContact O-CG2 3.45Å; G433-V437 PolarHBondContact O-N 3.17Å
434	M	90.2	Very high	89.7	Confident	43 Å²	43	50.2 Å²	50.2	21%	0.212	29%	0.285	C	S	.	.	H	α-helix	trans	-62.6	-41.7	175.9	-71.8	-170.5	-65.7	0	0	112.1	L430 L431 V437 A438 F464 L509 L512	L430-M434 WeakPolarHBondContact O-CG 3.35Å; L430-M434 PolarHBondContact O-N 2.85Å; L431-M434 HydrophobicContact CD2-CE 3.49Å; L431-M434 VanDerWaalsContact CD2-CE 3.49Å; L431-M434 HydrophobicContact CG-CE 4.24Å; L431-M434 PolarHBondContact O-N 3.36Å; M434-V437 PolarHBondContact O-N 3.18Å; M434-A438 WeakPolarHBondContact O-CB 3.21Å; M434-A438 PolarHBondContact O-N 2.97Å; M434-F464 HydrophobicContact CB-CD2 4.06Å; M434-F464 HydrophobicContact CB-CE2 3.72Å; M434-F464 HydrophobicContact CE-CE2 4.36Å; M434-L509 HydrophobicContact CE-CD2 3.85Å; M434-L509 HydrophobicContact CE-CG 4.36Å; M434-L512 HydrophobicContact CG-CD2 4.25Å; M434-L512 HydrophobicContact SD-CD2 3.93Å
435	L	91.4	Very high	88.1	Confident	20 Å²	20	53 Å²	53	11%	0.105	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-45.9	174.2	179.1	61.3	0	0	0	110.7	L283 L431 S432 G433 V437 A438 V439 F464 A469 L472 L473	L283-L435 HydrophobicContact CD1-CD1 3.44Å; L283-L435 VanDerWaalsContact CD1-CD1 3.44Å; L431-L435 VanDerWaalsContact O-CB 3.3Å; L431-L435 WeakPolarHBondContact O-CB 3.23Å; L431-L435 PolarHBondContact O-N 2.92Å; S432-L435 PolarHBondContact O-N 2.97Å; G433-L435 PolarHBondContact O-N 2.8Å; L435-V437 VanDerWaalsContact C-N 3.33Å; L435-V437 PolarHBondContact O-N 3.39Å; L435-A438 PolarHBondContact O-N 3.44Å; L435-V439 HydrophobicContact CD1-CG2 4.07Å; L435-V439 HydrophobicContact CG-CG2 4.2Å; L435-V439 WeakPolarHBondContact O-CB 3.27Å; L435-V439 WeakPolarHBondContact O-CG2 3.46Å; L435-V439 PolarHBondContact O-N 3.45Å; L435-F464 HydrophobicContact CB-CE1 4.49Å; L435-F464 HydrophobicContact CB-CZ 4.47Å; L435-F464 HydrophobicContact CD1-CD1 4.1Å; L435-F464 HydrophobicContact CD1-CE1 4.28Å; L435-A469 HydrophobicContact CD1-CB 4.3Å; L435-L472 HydrophobicContact CB-CD2 4.2Å; L435-L472 HydrophobicContact CD2-CD2 3.9Å; L435-L473 HydrophobicContact CD2-CD2 4.29Å; L435-L473 HydrophobicContact CD2-CG 4.49Å
436	A	91.4	Very high	86.5	Confident	60 Å²	60	58.7 Å²	58.7	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-40.3	177.8	0	0	0	0	0	112.4	S432 G433 V439 L440	S432-A436 WeakPolarHBondContact O-CB 3.22Å; S432-A436 PolarHBondContact O-N 2.98Å; G433-A436 PolarHBondContact O-N 3.06Å; A436-V439 PolarHBondContact O-N 2.9Å; A436-L440 WeakPolarHBondContact O-CB 3.34Å; A436-L440 PolarHBondContact O-N 3.06Å
437	V	89.4	Confident	84.3	Confident	102 Å²	102	59.2 Å²	59.2	62%	0.618	34%	0.342	S	S	*	.	H	α-helix	trans	-64.5	-44.5	174.1	172.7	0	0	0	0	111.1	G433 M434 L435 L440 H441	G433-V437 WeakPolarHBondContact O-CG2 3.45Å; G433-V437 PolarHBondContact O-N 3.17Å; M434-V437 PolarHBondContact O-N 3.18Å; L435-V437 VanDerWaalsContact C-N 3.33Å; L435-V437 PolarHBondContact O-N 3.39Å; V437-L440 PolarHBondContact O-N 3.25Å; V437-H441 WeakPolarHBondContact O-CB 3.44Å; V437-H441 PolarHBondContact O-N 3.25Å
438	A	87.4	Confident	82	Confident	17 Å²	17	60.7 Å²	60.7	14%	0.14	36%	0.358	C	S	.	.	H	α-helix	trans	-63.6	-40.8	177.2	0	0	0	0	0	112.1	M434 L435 H441 N442 F464	M434-A438 WeakPolarHBondContact O-CB 3.21Å; M434-A438 PolarHBondContact O-N 2.97Å; L435-A438 PolarHBondContact O-N 3.44Å; A438-H441 PolarHBondContact O-N 3.47Å; A438-N442 WeakPolarHBondContact O-CB 3.25Å; A438-N442 VanDerWaalsContact O-CG 3.28Å; A438-N442 PolarHBondContact O-N 2.87Å; A438-F464 HydrophobicContact CB-CB 3.63Å; A438-F464 HydrophobicContact CB-CG 4.4Å
439	V	86.9	Confident	79.5	Confident	29 Å²	29	70.3 Å²	70.3	18%	0.176	39%	0.393	C	S	.	.	H	α-helix	trans	-61.8	-48.4	174.3	173.5	0	0	0	0	110	V281 L435 A436 H441 N442 L443	V281-V439 HydrophobicContact CB-CG1 4.37Å; V281-V439 HydrophobicContact CB-CG2 3.87Å; V281-V439 HydrophobicContact CG1-CG1 3.97Å; V281-V439 HydrophobicContact CG1-CG2 3.8Å; V281-V439 HydrophobicContact CG2-CG2 4.44Å; L435-V439 HydrophobicContact CD1-CG2 4.07Å; L435-V439 HydrophobicContact CG-CG2 4.2Å; L435-V439 WeakPolarHBondContact O-CB 3.27Å; L435-V439 WeakPolarHBondContact O-CG2 3.46Å; L435-V439 PolarHBondContact O-N 3.45Å; A436-V439 PolarHBondContact O-N 2.9Å; V439-H441 VanDerWaalsContact C-N 3.27Å; V439-H441 PolarHBondContact O-N 3.16Å; V439-N442 PolarHBondContact O-N 3.35Å; V439-L443 HydrophobicContact CG1-CD1 3.67Å; V439-L443 HydrophobicContact CG1-CG 4.16Å; V439-L443 WeakPolarHBondContact O-CB 3.28Å; V439-L443 WeakPolarHBondContact O-CG 3.49Å; V439-L443 PolarHBondContact O-N 3.24Å
440	L	85.3	Confident	77.2	Confident	84 Å²	84	71.8 Å²	71.8	44%	0.44	40%	0.397	S	S	.	.	H	α-helix	trans	-61	-38.3	178.6	-174	65.4	0	0	0	111.6	A436 V437 R444	A436-L440 WeakPolarHBondContact O-CB 3.34Å; A436-L440 PolarHBondContact O-N 3.06Å; V437-L440 PolarHBondContact O-N 3.25Å; L440-R444 WeakPolarHBondContact O-CG 3.4Å; L440-R444 PolarHBondContact O-N 3.15Å
441	H	83.5	Confident	75.2	Confident	76 Å²	76	72.4 Å²	72.4	35%	0.352	40%	0.398	S	S	.	.	H	α-helix	trans	-65.1	-48.6	174.1	-172.8	-80.9	0	0	0	111.6	V437 A438 V439 L443 R444	V437-H441 WeakPolarHBondContact O-CB 3.44Å; V437-H441 PolarHBondContact O-N 3.25Å; A438-H441 PolarHBondContact O-N 3.47Å; V439-H441 VanDerWaalsContact C-N 3.27Å; V439-H441 PolarHBondContact O-N 3.16Å; H441-L443 VanDerWaalsContact C-N 3.26Å; H441-L443 PolarHBondContact O-N 2.86Å; H441-R444 WeakPolarHBondContact O-CB 3.49Å; H441-R444 PolarHBondContact O-N 3.3Å; H441-R444 VanDerWaalsContact O-N 3.16Å
442	N	81.9	Confident	73	Confident	36 Å²	36	79.4 Å²	79.4	19%	0.193	43%	0.431	C	S	.	.	H	α-helix	trans	-62.6	-32.8	179.1	-75.6	-6.8	0	0	0	112.9	V281 R343 A438 V439	V281-N442 PolarHBondContact O-ND2 3.49Å; R343-N442 PolarHBondContact NH1-O 3.32Å; A438-N442 WeakPolarHBondContact O-CB 3.25Å; A438-N442 VanDerWaalsContact O-CG 3.28Å; A438-N442 PolarHBondContact O-N 2.87Å; V439-N442 PolarHBondContact O-N 3.35Å
443	L	76	Confident	70.6	Confident	20 Å²	20	84.8 Å²	84.8	11%	0.105	45%	0.448	C	S	.	.	H	α-helix	trans	-79	-15.4	179	-69.7	175.8	0	0	0	113.5	L340 R343 L344 V439 H441	L340-L443 HydrophobicContact CD1-CB 3.64Å; R343-L443 HydrophobicContact CG-CD2 4.19Å; L344-L443 HydrophobicContact CD2-CD1 4.2Å; V439-L443 HydrophobicContact CG1-CD1 3.67Å; V439-L443 HydrophobicContact CG1-CG 4.16Å; V439-L443 WeakPolarHBondContact O-CB 3.28Å; V439-L443 WeakPolarHBondContact O-CG 3.49Å; V439-L443 PolarHBondContact O-N 3.24Å; H441-L443 VanDerWaalsContact C-N 3.26Å; H441-L443 PolarHBondContact O-N 2.86Å
444	R	75	Confident	68.3	Low	140 Å²	140	91.1 Å²	91.1	53%	0.528	46%	0.461	S	S	.	.	S	Bend	trans	-70.5	147.8	175.4	-80.7	175.1	-176.5	-160.4	0.4	110.9	L440 H441 K446	L440-R444 WeakPolarHBondContact O-CG 3.4Å; L440-R444 PolarHBondContact O-N 3.15Å; H441-R444 WeakPolarHBondContact O-CB 3.49Å; H441-R444 PolarHBondContact O-N 3.3Å; H441-R444 VanDerWaalsContact O-N 3.16Å; R444-K446 PolarHBondContact O-N 2.84Å
445	P	64.1	Low	66.2	Low	75 Å²	75	92.5 Å²	92.5	49%	0.487	48%	0.479	S	S	.	.			trans	-65.7	121.6	179.8	24.7	-31.1	0	0	0	110.4	G447	P445-G447 PolarHBondContact O-N 3.2Å; P445-G447 VanDerWaalsContact O-N 3.14Å
446	K	60.8	Low	63.6	Low	183 Å²	183	95.8 Å²	95.8	80%	0.796	51%	0.509	S	S	*	.	S	Bend	trans	-69.8	101.5	167.4	-70.5	-176.1	177.3	-177.6	0	108.2	R444 E451	R444-K446 PolarHBondContact O-N 2.84Å; K446-E451 WeakPolarHBondContact CA-OE2 3.2Å
447	G	48.7	Very low	60.9	Low	72 Å²	72	96.9 Å²	96.9	74%	0.742	52%	0.518	S	S	*	.			trans	155.7	22.2	-177.6	0	0	0	0	0	117.3	P445 E451	P445-G447 PolarHBondContact O-N 3.2Å; P445-G447 VanDerWaalsContact O-N 3.14Å; G447-E451 PolarHBondContact N-OE2 3.11Å
448	G	45.8	Very low	58.1	Low	39 Å²	39	95.4 Å²	95.4	40%	0.402	52%	0.523	S	S	.	.			trans	-95.5	139.1	169	0	0	0	0	0	111.4	E450 E451	G448-E450 PolarHBondContact O-N 2.77Å; G448-E451 PolarHBondContact O-N 3.01Å
449	W	42.6	Very low	55.7	Low	223 Å²	223	96.7 Å²	96.7	85%	0.845	54%	0.538	S	S	*	.	H	α-helix	trans	-49.7	-22.8	172.6	-165.1	6.9	0	0	0	113.4
450	E	48.4	Very low	53.2	Low	149 Å²	149	103.9 Å²	103.9	70%	0.696	57%	0.57	S	S	*	*	H	α-helix	trans	-75	-27.6	174.6	-68.7	-148.4	147.8	0	0	115.4	G448 K453 R454	G448-E450 PolarHBondContact O-N 2.77Å; E450-K453 PolarHBondContact O-N 2.93Å; E450-R454 PolarHBondContact O-N 3.19Å
451	E	50.5	Low	51.3	Low	70 Å²	70	105.2 Å²	105.2	33%	0.327	58%	0.581	S	S	.	*	H	α-helix	trans	-75.4	-38	-178.1	-130.8	179.8	175	0	0	111	K446 G447 G448 K453 R454 A455	K446-E451 WeakPolarHBondContact CA-OE2 3.2Å; G447-E451 PolarHBondContact N-OE2 3.11Å; G448-E451 PolarHBondContact O-N 3.01Å; E451-K453 VanDerWaalsContact C-N 3.33Å; E451-R454 PolarHBondContact O-N 3.02Å; E451-A455 WeakPolarHBondContact O-CB 3.27Å; E451-A455 PolarHBondContact O-N 3.06Å
452	E	46.9	Very low	49.9	Very low	149 Å²	149	110.2 Å²	110.2	70%	0.696	61%	0.605	S	S	*	*	H	α-helix	trans	-63.8	-38.7	172.4	-127.5	173.5	-173.1	0	0	111.4	A456	E452-A456 VanDerWaalsContact O-CB 3.31Å; E452-A456 WeakPolarHBondContact O-CB 3.39Å; E452-A456 PolarHBondContact O-N 2.81Å
453	K	43.5	Very low	49.1	Very low	157 Å²	157	112.6 Å²	112.6	68%	0.683	63%	0.629	S	S	*	*	H	α-helix	trans	-67.5	-37.3	175	-121.3	179	-179.3	178.1	0	112.8	E450 E451 A457	E450-K453 PolarHBondContact O-N 2.93Å; E451-K453 VanDerWaalsContact C-N 3.33Å; K453-A457 WeakPolarHBondContact O-CB 2.84Å; K453-A457 PolarHBondContact O-N 3.46Å; K453-A457 VanDerWaalsContact O-N 3.1Å
454	R	45.6	Very low	49.6	Very low	170 Å²	170	113.1 Å²	113.1	64%	0.642	63%	0.631	S	S	*	*	H	α-helix	trans	-74.5	-35.1	175.7	-82.9	-177	175.1	171.9	1.8	113.2	E450 E451 A457 G459	E450-R454 PolarHBondContact O-N 3.19Å; E451-R454 PolarHBondContact O-N 3.02Å; R454-A457 PolarHBondContact O-N 3.43Å; R454-G459 PolarHBondContact O-N 3.18Å
455	A	44.2	Very low	50.2	Low	71 Å²	71	109.7 Å²	109.7	59%	0.587	62%	0.618	S	S	*	*	H	α-helix	trans	-66	-39.5	172	0	0	0	0	0	111.8	E451 A457 G458	E451-A455 WeakPolarHBondContact O-CB 3.27Å; E451-A455 PolarHBondContact O-N 3.06Å; A455-A457 VanDerWaalsContact C-N 3.33Å; A455-G458 PolarHBondContact O-N 3.41Å
456	A	37.9	Very low	51.5	Low	90 Å²	90	107.3 Å²	107.3	74%	0.744	60%	0.603	S	S	*	*	H	α-helix	trans	-70	-25.2	174	0	0	0	0	0	113.7	E452 G458	E452-A456 VanDerWaalsContact O-CB 3.31Å; E452-A456 WeakPolarHBondContact O-CB 3.39Å; E452-A456 PolarHBondContact O-N 2.81Å; A456-G458 VanDerWaalsContact C-N 3.26Å; A456-G458 PolarHBondContact O-N 3.19Å
457	A	35.4	Very low	53.1	Low	82 Å²	82	98.6 Å²	98.6	68%	0.678	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	12.6	177.5	0	0	0	0	0	114.3	K453 R454 A455 G459	K453-A457 WeakPolarHBondContact O-CB 2.84Å; K453-A457 PolarHBondContact O-N 3.46Å; K453-A457 VanDerWaalsContact O-N 3.1Å; R454-A457 PolarHBondContact O-N 3.43Å; A455-A457 VanDerWaalsContact C-N 3.33Å; A457-G459 PolarHBondContact O-N 3.03Å
458	G	30.8	Very low	55.2	Low	71 Å²	71	95.3 Å²	95.3	73%	0.732	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	7.8	177.9	0	0	0	0	0	115	A455 A456 Q460	A455-G458 PolarHBondContact O-N 3.41Å; A456-G458 VanDerWaalsContact C-N 3.26Å; A456-G458 PolarHBondContact O-N 3.19Å; G458-Q460 PolarHBondContact O-N 2.99Å
459	G	36.1	Very low	57.6	Low	44 Å²	44	93.5 Å²	93.5	45%	0.454	51%	0.511	S	S	.	.			trans	-88.5	65	177.5	0	0	0	0	0	112.2	R454 A457 V461	R454-G459 PolarHBondContact O-N 3.18Å; A457-G459 PolarHBondContact O-N 3.03Å; G459-V461 PolarHBondContact O-N 3.14Å
460	Q	34.3	Very low	60.2	Low	181 Å²	181	82.9 Å²	82.9	85%	0.846	47%	0.471	S	S	*	.			trans	-65.5	105.7	163.1	-87.8	-176.1	-18.5	0	0	108	G458 E462	G458-Q460 PolarHBondContact O-N 2.99Å; Q460-E462 PolarHBondContact O-N 3Å
461	V	44.8	Very low	62.5	Low	112 Å²	112	75.9 Å²	75.9	68%	0.679	44%	0.439	S	S	*	.			trans	-64.7	106.4	166.1	179.8	0	0	0	0	106.1	G459 A463	G459-V461 PolarHBondContact O-N 3.14Å; V461-A463 PolarHBondContact O-N 2.94Å; V461-A463 VanDerWaalsContact O-N 3.14Å
462	E	53.9	Low	64.7	Low	180 Å²	180	72.7 Å²	72.7	84%	0.841	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-53.5	120.3	177.6	-73.8	178.9	158.8	0	0	109.2	Q460 F464	Q460-E462 PolarHBondContact O-N 3Å; E462-F464 PolarHBondContact O-N 3.39Å
463	A	66.8	Low	67	Low	86 Å²	86	66.7 Å²	66.7	71%	0.711	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.4	134.5	177.4	0	0	0	0	0	109.7	V461 R465	V461-A463 PolarHBondContact O-N 2.94Å; V461-A463 VanDerWaalsContact O-N 3.14Å; A463-R465 PolarHBondContact O-N 3.49Å
464	F	85.5	Confident	69.5	Low	32 Å²	32	59.2 Å²	59.2	14%	0.14	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-58.5	132.3	-179.7	-170.7	-91.7	0	0	0	110.5	L283 L431 M434 L435 A438 E462 V468 A469	L283-F464 HydrophobicContact CD2-CB 4.31Å; L431-F464 HydrophobicContact CD2-CE2 4.44Å; L431-F464 HydrophobicContact CD2-CZ 4.21Å; M434-F464 HydrophobicContact CB-CD2 4.06Å; M434-F464 HydrophobicContact CB-CE2 3.72Å; M434-F464 HydrophobicContact CE-CE2 4.36Å; L435-F464 HydrophobicContact CB-CE1 4.49Å; L435-F464 HydrophobicContact CB-CZ 4.47Å; L435-F464 HydrophobicContact CD1-CD1 4.1Å; L435-F464 HydrophobicContact CD1-CE1 4.28Å; A438-F464 HydrophobicContact CB-CB 3.63Å; A438-F464 HydrophobicContact CB-CG 4.4Å; E462-F464 PolarHBondContact O-N 3.39Å; F464-V468 HydrophobicContact CE1-CB 4.3Å; F464-V468 HydrophobicContact CE1-CG1 4.23Å; F464-V468 HydrophobicContact CZ-CB 4.43Å; F464-V468 HydrophobicContact CZ-CG1 3.92Å; F464-A469 HydrophobicContact CD1-CB 3.86Å; F464-A469 HydrophobicContact CE1-CB 3.64Å
465	R	88.8	Confident	71.9	Confident	67 Å²	67	51.1 Å²	51.1	25%	0.253	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-61.9	121.5	-173.9	-82.5	179.3	61.7	-166.7	2	111.9	L184 A463 D467 V468 A469 D508	L184-R465 PolarHBondContact O-NH1 3.25Å; L184-R465 PolarHBondContact O-NH2 3.18Å; A463-R465 PolarHBondContact O-N 3.49Å; R465-D467 VanDerWaalsContact C-N 3.34Å; R465-D467 WeakPolarHBondContact CB-OD1 3.13Å; R465-D467 IonicContact CZ-OD1 3.58Å; R465-D467 IonicContact CZ-OD2 2.7Å; R465-D467 IonicContact NE-OD1 2.98Å; R465-D467 PolarHBondContact NE-OD1 3.31Å; R465-D467 IonicContact NE-OD2 2.8Å; R465-D467 IonicContact NH2-OD1 3.13Å; R465-D467 IonicContact NH2-OD2 3.37Å; R465-D467 PolarHBondContact NH2-OD2 2.84Å; R465-D467 PolarHBondContact O-N 3.02Å; R465-V468 HydrophobicContact CB-CB 3.99Å; R465-V468 HydrophobicContact CB-CG2 3.72Å; R465-V468 PolarHBondContact O-N 2.88Å; R465-A469 PolarHBondContact O-N 3.44Å; R465-D508 IonicContact NH1-OD2 3.55Å
466	P	91.4	Very high	74.4	Confident	25 Å²	25	50 Å²	50	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-67.6	-32.8	-176	26.2	-34.4	0	0	0	112.9	L234 L284 A469 Y470	L234-P466 WeakPolarHBondContact O-CG 3.18Å; L284-P466 HydrophobicContact CD2-CB 3.93Å; P466-A469 PolarHBondContact O-N 3.46Å; P466-Y470 WeakPolarHBondContact O-CB 3.35Å; P466-Y470 PolarHBondContact O-N 3.26Å
467	D	92.9	Very high	77.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-38.5	174.8	60.5	-45.9	0	0	0	111.9	T231 L234 R465 N471	T231-D467 HydrophobicContact CG2-CB 4.17Å; L234-D467 HydrophobicContact CB-CB 4.01Å; R465-D467 VanDerWaalsContact C-N 3.34Å; R465-D467 WeakPolarHBondContact CB-OD1 3.13Å; R465-D467 IonicContact CZ-OD1 3.58Å; R465-D467 IonicContact CZ-OD2 2.7Å; R465-D467 IonicContact NE-OD1 2.98Å; R465-D467 PolarHBondContact NE-OD1 3.31Å; R465-D467 IonicContact NE-OD2 2.8Å; R465-D467 IonicContact NH2-OD1 3.13Å; R465-D467 IonicContact NH2-OD2 3.37Å; R465-D467 PolarHBondContact NH2-OD2 2.84Å; R465-D467 PolarHBondContact O-N 3.02Å; D467-N471 PolarHBondContact O-N 3.43Å; D467-N471 PolarHBondContact O-ND2 2.9Å
468	V	94	Very high	80	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-70.2	-41.4	174.3	-179.9	0	0	0	0	110.9	L184 L431 F464 R465 Y470 N471 L472 Y502	L184-V468 HydrophobicContact CD2-CG2 4.1Å; L431-V468 HydrophobicContact CD2-CG1 3.81Å; F464-V468 HydrophobicContact CE1-CB 4.3Å; F464-V468 HydrophobicContact CE1-CG1 4.23Å; F464-V468 HydrophobicContact CZ-CB 4.43Å; F464-V468 HydrophobicContact CZ-CG1 3.92Å; R465-V468 HydrophobicContact CB-CB 3.99Å; R465-V468 HydrophobicContact CB-CG2 3.72Å; R465-V468 PolarHBondContact O-N 2.88Å; V468-Y470 VanDerWaalsContact C-N 3.33Å; V468-Y470 PolarHBondContact O-N 3.48Å; V468-N471 PolarHBondContact O-N 2.86Å; V468-L472 WeakPolarHBondContact O-CB 3.46Å; V468-L472 PolarHBondContact O-N 2.96Å; V468-Y502 HydrophobicContact CG1-CE1 3.78Å; V468-Y502 HydrophobicContact CG2-CE2 4.49Å
469	A	94.9	Very high	83.1	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-42.8	177.5	0	0	0	0	0	112.1	L278 L283 L435 F464 R465 P466 L472 L473	L278-A469 HydrophobicContact CD2-CB 3.52Å; L283-A469 HydrophobicContact CD1-CB 3.84Å; L435-A469 HydrophobicContact CD1-CB 4.3Å; F464-A469 HydrophobicContact CD1-CB 3.86Å; F464-A469 HydrophobicContact CE1-CB 3.64Å; R465-A469 PolarHBondContact O-N 3.44Å; P466-A469 PolarHBondContact O-N 3.46Å; A469-L472 PolarHBondContact O-N 2.9Å; A469-L473 WeakPolarHBondContact O-CG 3.45Å; A469-L473 PolarHBondContact O-N 3.28Å
470	Y	96.8	Very high	85.9	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-58.9	-48.8	176.3	172.4	-103.8	0	0	0	112.3	V227 V230 L234 Q271 I274 L278 P466 V468 L473 H474	V227-Y470 HydrophobicContact CG1-CE1 4.17Å; V230-Y470 HydrophobicContact CB-CE1 4.1Å; V230-Y470 HydrophobicContact CG1-CD1 4.12Å; V230-Y470 HydrophobicContact CG1-CD2 4.37Å; V230-Y470 HydrophobicContact CG1-CE1 3.67Å; V230-Y470 HydrophobicContact CG1-CE2 3.96Å; V230-Y470 HydrophobicContact CG1-CG 4.44Å; L234-Y470 HydrophobicContact CD1-CD1 4.42Å; L234-Y470 HydrophobicContact CD1-CD2 4.41Å; L234-Y470 HydrophobicContact CD1-CG 3.96Å; Q271-Y470 HydrophobicContact CG-CE2 4.26Å; Q271-Y470 PolarHBondContact NE2-OH 3.46Å; I274-Y470 HydrophobicContact CG2-CD2 3.68Å; I274-Y470 HydrophobicContact CG2-CE2 4.16Å; L278-Y470 HydrophobicContact CD1-CD2 4.23Å; P466-Y470 WeakPolarHBondContact O-CB 3.35Å; P466-Y470 PolarHBondContact O-N 3.26Å; V468-Y470 VanDerWaalsContact C-N 3.33Å; V468-Y470 PolarHBondContact O-N 3.48Å; Y470-L473 PolarHBondContact O-N 3.42Å; Y470-H474 AromaticContact CE1-CD2 3.67Å; Y470-H474 AromaticContact CE1-NE2 3.87Å; Y470-H474 AromaticContact CE2-CD2 3.58Å; Y470-H474 AromaticContact CE2-NE2 3.33Å; Y470-H474 VanDerWaalsContact CE2-NE2 3.33Å; Y470-H474 WeakPolarHBondContact CE2-NE2 3.48Å; Y470-H474 AromaticContact CZ-CD2 3.34Å; Y470-H474 AromaticContact CZ-NE2 3.09Å; Y470-H474 PolarHBondContact O-CD2 2.8Å; Y470-H474 PolarHBondContact O-N 2.89Å; Y470-H474 VanDerWaalsContact O-N 3.12Å; Y470-H474 PolarHBondContact OH-NE2 3.45Å
471	N	96.8	Very high	88.6	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.011	21%	0.212	C	C	.	.	H	α-helix	trans	-69.9	-33.5	179.7	-76	-80.8	0	0	0	112.7	L184 T231 D467 V468 S475 H495	L184-N471 HydrophobicContact CD1-CB 3.99Å; L184-N471 HydrophobicContact CD2-CB 4.47Å; T231-N471 WeakPolarHBondContact CG2-ND2 3.49Å; T231-N471 PolarHBondContact OG1-ND2 2.97Å; D467-N471 PolarHBondContact O-N 3.43Å; D467-N471 PolarHBondContact O-ND2 2.9Å; V468-N471 PolarHBondContact O-N 2.86Å; N471-S475 PolarHBondContact O-N 3.45Å; N471-S475 VanDerWaalsContact O-N 3.07Å; N471-H495 PolarHBondContact O-NE2 3.01Å; N471-H495 PolarHBondContact OD1-CE1 2.83Å
472	L	96.8	Very high	90.9	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-50.2	173.5	175.3	67.1	0	0	0	111.6	V428 L431 L435 V468 A469 H474 S475 V476	V428-L472 HydrophobicContact CB-CD1 4.46Å; V428-L472 HydrophobicContact CG1-CD1 4.1Å; V428-L472 HydrophobicContact CG2-CD1 4.48Å; L431-L472 HydrophobicContact CB-CD1 3.75Å; L431-L472 HydrophobicContact CB-CD2 3.81Å; L431-L472 HydrophobicContact CB-CG 4.31Å; L431-L472 HydrophobicContact CD1-CD1 4.29Å; L435-L472 HydrophobicContact CB-CD2 4.2Å; L435-L472 HydrophobicContact CD2-CD2 3.9Å; V468-L472 WeakPolarHBondContact O-CB 3.46Å; V468-L472 PolarHBondContact O-N 2.96Å; A469-L472 PolarHBondContact O-N 2.9Å; L472-H474 VanDerWaalsContact C-N 3.3Å; L472-H474 PolarHBondContact O-N 3.02Å; L472-S475 VanDerWaalsContact O-CB 3.3Å; L472-S475 WeakPolarHBondContact O-CB 3.39Å; L472-S475 PolarHBondContact O-N 3.23Å; L472-S475 VanDerWaalsContact O-N 3.08Å; L472-V476 HydrophobicContact CD1-CG2 4.41Å; L472-V476 WeakPolarHBondContact O-CG2 3.37Å; L472-V476 PolarHBondContact O-N 2.93Å
473	L	96.7	Very high	92.8	Very high	22 Å²	22	29 Å²	29	12%	0.115	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-37.2	-179.1	-71.6	174.2	0	0	0	111.6	I274 I277 L278 L435 A469 Y470 V476 L477	I274-L473 HydrophobicContact CB-CB 4.45Å; I274-L473 HydrophobicContact CD1-CB 4.4Å; I274-L473 HydrophobicContact CG1-CB 3.98Å; I274-L473 HydrophobicContact CG2-CB 3.8Å; I274-L473 HydrophobicContact CG2-CD1 3.97Å; I277-L473 HydrophobicContact CB-CD1 4.21Å; I277-L473 HydrophobicContact CG2-CD1 3.77Å; I277-L473 HydrophobicContact CG2-CD2 4.35Å; L278-L473 HydrophobicContact CD2-CD1 3.61Å; L278-L473 HydrophobicContact CG-CD1 3.77Å; L435-L473 HydrophobicContact CD2-CD2 4.29Å; L435-L473 HydrophobicContact CD2-CG 4.49Å; A469-L473 WeakPolarHBondContact O-CG 3.45Å; A469-L473 PolarHBondContact O-N 3.28Å; Y470-L473 PolarHBondContact O-N 3.42Å; L473-V476 PolarHBondContact O-N 2.89Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 WeakPolarHBondContact O-CG 3.36Å; L473-L477 PolarHBondContact O-N 3.42Å
474	H	95.8	Very high	93.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.3	-50	168.9	-93.9	-59.9	0	0	0	111.8	I274 Y470 L472 V476 L477 Y478	I274-H474 HydrophobicContact CD1-CB 4.06Å; I274-H474 VanDerWaalsContact CD1-CE1 3.44Å; I274-H474 WeakPolarHBondContact CD1-CE1 3.48Å; I274-H474 WeakPolarHBondContact CD1-ND1 3.23Å; Y470-H474 AromaticContact CE1-CD2 3.67Å; Y470-H474 AromaticContact CE1-NE2 3.87Å; Y470-H474 AromaticContact CE2-CD2 3.58Å; Y470-H474 AromaticContact CE2-NE2 3.33Å; Y470-H474 VanDerWaalsContact CE2-NE2 3.33Å; Y470-H474 WeakPolarHBondContact CE2-NE2 3.48Å; Y470-H474 AromaticContact CZ-CD2 3.34Å; Y470-H474 AromaticContact CZ-NE2 3.09Å; Y470-H474 PolarHBondContact O-CD2 2.8Å; Y470-H474 PolarHBondContact O-N 2.89Å; Y470-H474 VanDerWaalsContact O-N 3.12Å; Y470-H474 PolarHBondContact OH-NE2 3.45Å; L472-H474 VanDerWaalsContact C-N 3.3Å; L472-H474 PolarHBondContact O-N 3.02Å; H474-V476 VanDerWaalsContact C-N 3.3Å; H474-V476 PolarHBondContact O-N 3.46Å; H474-L477 PolarHBondContact O-N 2.88Å; H474-Y478 HydrophobicContact CB-CD2 4.28Å; H474-Y478 HydrophobicContact CB-CE2 4.12Å; H474-Y478 AromaticContact CE1-CZ 3.71Å; H474-Y478 PolarHBondContact CE1-OH 2.9Å; H474-Y478 AromaticContact CG-CE2 3.95Å; H474-Y478 AromaticContact ND1-CE1 3.95Å; H474-Y478 AromaticContact ND1-CE2 3.21Å; H474-Y478 WeakPolarHBondContact ND1-CE2 2.86Å; H474-Y478 AromaticContact ND1-CZ 3.16Å; H474-Y478 PolarHBondContact ND1-OH 2.88Å; H474-Y478 VanDerWaalsContact ND1-OH 3.15Å; H474-Y478 VanDerWaalsContact O-CB 3.24Å; H474-Y478 WeakPolarHBondContact O-CB 3.22Å; H474-Y478 WeakPolarHBondContact O-CD2 3.5Å; H474-Y478 VanDerWaalsContact O-CG 3.26Å; H474-Y478 PolarHBondContact O-N 3.48Å
475	S	95.9	Very high	94.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-40.9	179.6	-155.6	0	0	0	0	112.9	Y424 N471 L472 G479 W492	Y424-S475 VanDerWaalsContact CE2-OG 3.26Å; Y424-S475 WeakPolarHBondContact CE2-OG 3.36Å; Y424-S475 PolarHBondContact OH-OG 3.35Å; N471-S475 PolarHBondContact O-N 3.45Å; N471-S475 VanDerWaalsContact O-N 3.07Å; L472-S475 VanDerWaalsContact O-CB 3.3Å; L472-S475 WeakPolarHBondContact O-CB 3.39Å; L472-S475 PolarHBondContact O-N 3.23Å; L472-S475 VanDerWaalsContact O-N 3.08Å; S475-G479 PolarHBondContact O-N 2.96Å; S475-W492 PolarHBondContact O-NE1 3.38Å
476	V	96.4	Very high	94	Very high	49 Å²	49	24.5 Å²	24.5	30%	0.297	13%	0.131	S	C	.	.	H	α-helix	trans	-71.1	-50.5	179.6	174	0	0	0	0	111	V428 L472 L473 H474 G479 L480	V428-V476 HydrophobicContact CG1-CG2 3.99Å; L472-V476 HydrophobicContact CD1-CG2 4.41Å; L472-V476 WeakPolarHBondContact O-CG2 3.37Å; L472-V476 PolarHBondContact O-N 2.93Å; L473-V476 PolarHBondContact O-N 2.89Å; H474-V476 VanDerWaalsContact C-N 3.3Å; H474-V476 PolarHBondContact O-N 3.46Å; V476-G479 PolarHBondContact O-N 3.45Å; V476-L480 HydrophobicContact CG1-CD1 4.44Å; V476-L480 WeakPolarHBondContact O-CG 3.29Å; V476-L480 PolarHBondContact O-N 2.93Å
477	L	96.4	Very high	93.9	Very high	45 Å²	45	25.7 Å²	25.7	24%	0.236	13%	0.133	C	C	.	.	H	α-helix	trans	-68.7	-38.5	-177.1	-65.7	-177.1	0	0	0	112.4	V270 I274 L473 H474 G479 L480 L481	V270-L477 HydrophobicContact CG1-CB 3.82Å; V270-L477 HydrophobicContact CG1-CD1 3.89Å; I274-L477 HydrophobicContact CD1-CD1 4.04Å; I274-L477 HydrophobicContact CG1-CD1 3.49Å; I274-L477 VanDerWaalsContact CG1-CD1 3.49Å; L473-L477 WeakPolarHBondContact O-CB 3.46Å; L473-L477 WeakPolarHBondContact O-CG 3.36Å; L473-L477 PolarHBondContact O-N 3.42Å; H474-L477 PolarHBondContact O-N 2.88Å; L477-G479 VanDerWaalsContact C-N 3.34Å; L477-L480 HydrophobicContact CD2-CD1 4.29Å; L477-L480 PolarHBondContact O-N 2.84Å; L477-L481 WeakPolarHBondContact O-CB 3.3Å; L477-L481 PolarHBondContact O-N 3.4Å
478	Y	95.3	Very high	93.8	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-36	172.1	-66.3	-24.6	0	0	0	112.3	F223 I267 V270 H474 L481 A482 I491	F223-Y478 HydrophobicContact CE1-CE2 4.27Å; F223-Y478 WeakPolarHBondContact CE1-OH 3.32Å; F223-Y478 WeakPolarHBondContact CZ-OH 3.46Å; I267-Y478 HydrophobicContact CG2-CE1 4.38Å; I267-Y478 WeakPolarHBondContact CG2-OH 3.26Å; V270-Y478 HydrophobicContact CB-CE1 4.31Å; V270-Y478 HydrophobicContact CG1-CD1 4.17Å; V270-Y478 HydrophobicContact CG1-CE1 3.78Å; H474-Y478 HydrophobicContact CB-CD2 4.28Å; H474-Y478 HydrophobicContact CB-CE2 4.12Å; H474-Y478 AromaticContact CE1-CZ 3.71Å; H474-Y478 PolarHBondContact CE1-OH 2.9Å; H474-Y478 AromaticContact CG-CE2 3.95Å; H474-Y478 AromaticContact ND1-CE1 3.95Å; H474-Y478 AromaticContact ND1-CE2 3.21Å; H474-Y478 WeakPolarHBondContact ND1-CE2 2.86Å; H474-Y478 AromaticContact ND1-CZ 3.16Å; H474-Y478 PolarHBondContact ND1-OH 2.88Å; H474-Y478 VanDerWaalsContact ND1-OH 3.15Å; H474-Y478 VanDerWaalsContact O-CB 3.24Å; H474-Y478 WeakPolarHBondContact O-CB 3.22Å; H474-Y478 WeakPolarHBondContact O-CD2 3.5Å; H474-Y478 VanDerWaalsContact O-CG 3.26Å; H474-Y478 PolarHBondContact O-N 3.48Å; Y478-L481 PolarHBondContact O-N 2.9Å; Y478-A482 VanDerWaalsContact O-CB 3.27Å; Y478-A482 WeakPolarHBondContact O-CB 3.31Å; Y478-A482 PolarHBondContact O-N 2.98Å; Y478-I491 HydrophobicContact CD1-CG2 4.17Å; Y478-I491 HydrophobicContact CD2-CG2 3.93Å; Y478-I491 HydrophobicContact CE1-CG2 4.09Å; Y478-I491 HydrophobicContact CE2-CG2 3.84Å; Y478-I491 HydrophobicContact CG-CG2 4.1Å
479	G	95	Very high	93.7	Very high	5 Å²	5	27.8 Å²	27.8	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-58.9	-51.4	171.5	0	0	0	0	0	111.8	S475 V476 L477 L481 A482 F483	S475-G479 PolarHBondContact O-N 2.96Å; V476-G479 PolarHBondContact O-N 3.45Å; L477-G479 VanDerWaalsContact C-N 3.34Å; G479-L481 VanDerWaalsContact C-N 3.28Å; G479-L481 PolarHBondContact O-N 3.39Å; G479-A482 PolarHBondContact O-N 2.91Å; G479-A482 VanDerWaalsContact O-N 3.16Å; G479-F483 WeakPolarHBondContact O-CD2 3.36Å; G479-F483 PolarHBondContact O-N 3Å
480	L	94.4	Very high	93.6	Very high	115 Å²	115	29 Å²	29	60%	0.602	15%	0.147	S	C	*	.	H	α-helix	trans	-57.1	-42.5	177	-68.9	174.5	0	0	0	112.1	V476 L477 S484	V476-L480 HydrophobicContact CG1-CD1 4.44Å; V476-L480 WeakPolarHBondContact O-CG 3.29Å; V476-L480 PolarHBondContact O-N 2.93Å; L477-L480 HydrophobicContact CD2-CD1 4.29Å; L477-L480 PolarHBondContact O-N 2.84Å; L480-S484 WeakPolarHBondContact O-CB 3.33Å; L480-S484 PolarHBondContact O-N 3.3Å; L480-S484 VanDerWaalsContact O-N 3.11Å
481	L	92.1	Very high	93.4	Very high	55 Å²	55	29.5 Å²	29.5	29%	0.288	15%	0.15	S	C	.	.	H	α-helix	trans	-66.4	-41.2	177.7	-174	63.6	0	0	0	112	L477 Y478 G479 S484 T485 M488	L477-L481 WeakPolarHBondContact O-CB 3.3Å; L477-L481 PolarHBondContact O-N 3.4Å; Y478-L481 PolarHBondContact O-N 2.9Å; G479-L481 VanDerWaalsContact C-N 3.28Å; G479-L481 PolarHBondContact O-N 3.39Å; L481-S484 PolarHBondContact O-N 2.89Å; L481-T485 PolarHBondContact O-N 2.92Å; L481-M488 HydrophobicContact CD1-CG 4.28Å; L481-M488 HydrophobicContact CD2-CB 4.08Å; L481-M488 HydrophobicContact CD2-CG 3.9Å; L481-M488 HydrophobicContact CD2-SD 3.96Å; L481-M488 HydrophobicContact CG-CB 3.78Å; L481-M488 HydrophobicContact CG-CG 3.69Å; L481-M488 HydrophobicContact CG-SD 4.4Å
482	A	93.3	Very high	93.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-42.7	177.5	0	0	0	0	0	112.5	Y478 G479 S484 T485 K489 W492	Y478-A482 VanDerWaalsContact O-CB 3.27Å; Y478-A482 WeakPolarHBondContact O-CB 3.31Å; Y478-A482 PolarHBondContact O-N 2.98Å; G479-A482 PolarHBondContact O-N 2.91Å; G479-A482 VanDerWaalsContact O-N 3.16Å; A482-S484 VanDerWaalsContact C-N 3.27Å; A482-S484 PolarHBondContact O-N 2.92Å; A482-T485 CarbonylContact O-C 3.58Å; A482-T485 VanDerWaalsContact O-C 3.25Å; A482-T485 PolarHBondContact O-N 2.69Å; A482-T485 VanDerWaalsContact O-O 3.12Å; A482-K489 HydrophobicContact CB-CB 4.42Å; A482-W492 HydrophobicContact CB-CB 3.98Å; A482-W492 HydrophobicContact CB-CD2 4.12Å; A482-W492 HydrophobicContact CB-CE3 3.71Å; A482-W492 HydrophobicContact CB-CG 4.26Å
483	F	92.9	Very high	93.2	Very high	93 Å²	93	29.6 Å²	29.6	41%	0.408	15%	0.15	S	C	.	.	H	α-helix	trans	-62.1	-36.9	174.2	-84.6	-72.3	0	0	0	112.1	L406 L407 L412 G479 W492	L406-F483 WeakPolarHBondContact CD2-O 3.35Å; L407-F483 HydrophobicContact CB-CD1 4.2Å; L407-F483 HydrophobicContact CD2-CD1 4.07Å; L407-F483 HydrophobicContact CD2-CE1 4.01Å; L407-F483 HydrophobicContact CD2-CZ 4.39Å; L407-F483 PolarHBondContact N-O 2.89Å; L412-F483 HydrophobicContact CD1-CE1 4.2Å; L412-F483 HydrophobicContact CD1-CZ 4.24Å; L412-F483 HydrophobicContact CD2-CZ 4.15Å; G479-F483 WeakPolarHBondContact O-CD2 3.36Å; G479-F483 PolarHBondContact O-N 3Å; F483-W492 AromaticContact CE2-CH2 3.96Å; F483-W492 HydrophobicContact CE2-CH2 3.96Å; F483-W492 HydrophobicContact CE2-CZ2 4.48Å; F483-W492 HydrophobicContact CE2-CZ3 4.47Å; F483-W492 HydrophobicContact CZ-CH2 4.34Å
484	S	89.6	Confident	93.2	Very high	31 Å²	31	28.6 Å²	28.6	22%	0.217	15%	0.145	C	C	.	.	H	α-helix	trans	-71.2	-42	175.1	-177.2	0	0	0	0	112.5	K384 L480 L481 A482	K384-S484 WeakPolarHBondContact CE-O 3.46Å; K384-S484 PolarHBondContact NZ-O 3.5Å; L480-S484 WeakPolarHBondContact O-CB 3.33Å; L480-S484 PolarHBondContact O-N 3.3Å; L480-S484 VanDerWaalsContact O-N 3.11Å; L481-S484 PolarHBondContact O-N 2.89Å; A482-S484 VanDerWaalsContact C-N 3.27Å; A482-S484 PolarHBondContact O-N 2.92Å
485	T	88.9	Confident	93.2	Very high	14 Å²	14	29 Å²	29	9%	0.086	15%	0.147	C	C	.	.			trans	-136.2	109.8	-172.6	-51.1	0	0	0	0	110.3	K384 F404 G405 L481 A482 R487 M488	K384-T485 PolarHBondContact NZ-OG1 3.25Å; F404-T485 HydrophobicContact CD1-CG2 4.05Å; G405-T485 CarbonylContact O-C 3.55Å; G405-T485 WeakPolarHBondContact O-CA 3.18Å; L481-T485 PolarHBondContact O-N 2.92Å; A482-T485 CarbonylContact O-C 3.58Å; A482-T485 VanDerWaalsContact O-C 3.25Å; A482-T485 PolarHBondContact O-N 2.69Å; A482-T485 VanDerWaalsContact O-O 3.12Å; T485-R487 VanDerWaalsContact C-N 3.3Å; T485-R487 PolarHBondContact O-N 3.09Å; T485-R487 VanDerWaalsContact O-N 3.17Å; T485-M488 HydrophobicContact CG2-CG 4.16Å; T485-M488 WeakPolarHBondContact O-CB 3.27Å; T485-M488 PolarHBondContact O-N 3.36Å
486	M	88.4	Confident	93.2	Very high	46 Å²	46	29 Å²	29	23%	0.227	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-50.7	-44.5	-174	-174.5	-78.4	-148.4	0	0	113.3	G405 L407 M488 K489	G405-M486 PolarHBondContact O-N 2.87Å; L407-M486 HydrophobicContact CD1-CG 4.31Å; M486-M488 PolarHBondContact O-N 2.75Å; M486-K489 VanDerWaalsContact O-CB 3.27Å; M486-K489 WeakPolarHBondContact O-CB 3.25Å; M486-K489 WeakPolarHBondContact O-CG 3.21Å; M486-K489 PolarHBondContact O-N 3.19Å; M486-K489 HydrophobicContact SD-CD 4.04Å
487	R	89	Confident	93.2	Very high	51 Å²	51	26.7 Å²	26.7	19%	0.192	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-57.4	-23	178.8	-173.4	172.9	178.8	174.8	0.4	113.9	E216 A403 T485 K489 Y490	E216-R487 IonicContact OE2-CZ 3.72Å; E216-R487 IonicContact OE2-NE 2.83Å; E216-R487 IonicContact OE2-NH2 2.84Å; E216-R487 PolarHBondContact OE2-NH2 3.31Å; A403-R487 HydrophobicContact CB-CB 4.43Å; A403-R487 VanDerWaalsContact O-CB 3.22Å; A403-R487 WeakPolarHBondContact O-CB 3.41Å; A403-R487 PolarHBondContact O-N 3.12Å; T485-R487 VanDerWaalsContact C-N 3.3Å; T485-R487 PolarHBondContact O-N 3.09Å; T485-R487 VanDerWaalsContact O-N 3.17Å; R487-K489 PolarHBondContact O-N 3.22Å; R487-Y490 VanDerWaalsContact O-CD2 3.27Å; R487-Y490 WeakPolarHBondContact O-CD2 3.2Å
488	M	90.2	Very high	93.3	Very high	42 Å²	42	24.6 Å²	24.6	21%	0.207	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-78.2	-6.5	179.3	-59.4	-67.7	144.1	0	0	112.9	L481 T485 M486 Y490 I491 W492	L481-M488 HydrophobicContact CD1-CG 4.28Å; L481-M488 HydrophobicContact CD2-CB 4.08Å; L481-M488 HydrophobicContact CD2-CG 3.9Å; L481-M488 HydrophobicContact CD2-SD 3.96Å; L481-M488 HydrophobicContact CG-CB 3.78Å; L481-M488 HydrophobicContact CG-CG 3.69Å; L481-M488 HydrophobicContact CG-SD 4.4Å; T485-M488 HydrophobicContact CG2-CG 4.16Å; T485-M488 WeakPolarHBondContact O-CB 3.27Å; T485-M488 PolarHBondContact O-N 3.36Å; M486-M488 PolarHBondContact O-N 2.75Å; M488-Y490 PolarHBondContact O-N 3.09Å; M488-I491 PolarHBondContact O-N 2.64Å; M488-I491 HydrophobicContact SD-CD1 4.08Å; M488-W492 PolarHBondContact O-N 3.31Å
489	K	92.6	Very high	93.3	Very high	5 Å²	5	24.5 Å²	24.5	2%	0.022	12%	0.122	C	C	.	.	H	α-helix	trans	-58.2	-33.9	174.4	77.7	-178	-176.1	161	0	113	V203 D204 L407 A482 M486 R487 I491 W492 T493	V203-K489 PolarHBondContact O-NZ 2.93Å; D204-K489 IonicContact OD1-NZ 2.7Å; D204-K489 PolarHBondContact OD1-NZ 3.41Å; L407-K489 HydrophobicContact CD1-CB 4Å; L407-K489 HydrophobicContact CD1-CD 4.15Å; A482-K489 HydrophobicContact CB-CB 4.42Å; M486-K489 VanDerWaalsContact O-CB 3.27Å; M486-K489 WeakPolarHBondContact O-CB 3.25Å; M486-K489 WeakPolarHBondContact O-CG 3.21Å; M486-K489 PolarHBondContact O-N 3.19Å; M486-K489 HydrophobicContact SD-CD 4.04Å; R487-K489 PolarHBondContact O-N 3.22Å; K489-I491 PolarHBondContact O-N 3.47Å; K489-W492 PolarHBondContact O-N 3.46Å; K489-T493 PolarHBondContact O-N 2.59Å; K489-T493 PolarHBondContact O-OG1 3.47Å
490	Y	92	Very high	93.4	Very high	26 Å²	26	24.3 Å²	24.3	10%	0.102	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-27	-178.8	-61.3	-64	0	0	0	112.7	R207 R487 M488	R207-Y490 HydrophobicContact CB-CE1 4.17Å; R207-Y490 HydrophobicContact CG-CE1 4.28Å; R207-Y490 HydrophobicContact CG-CE2 4.23Å; R487-Y490 VanDerWaalsContact O-CD2 3.27Å; R487-Y490 WeakPolarHBondContact O-CD2 3.2Å; M488-Y490 PolarHBondContact O-N 3.09Å
491	I	92.5	Very high	93.5	Very high	12 Å²	12	18.8 Å²	18.8	6%	0.062	9%	0.091	C	C	.	.	H	α-helix	trans	-79.7	-39.3	174	-52.9	-178.5	0	0	0	110.3	L220 W261 I267 Y478 M488 K489	L220-I491 HydrophobicContact CD2-CG1 4.04Å; W261-I491 HydrophobicContact CH2-CD1 4.15Å; I267-I491 HydrophobicContact CD1-CD1 3.4Å; I267-I491 VanDerWaalsContact CD1-CD1 3.4Å; I267-I491 HydrophobicContact CG1-CD1 4.07Å; Y478-I491 HydrophobicContact CD1-CG2 4.17Å; Y478-I491 HydrophobicContact CD2-CG2 3.93Å; Y478-I491 HydrophobicContact CE1-CG2 4.09Å; Y478-I491 HydrophobicContact CE2-CG2 3.84Å; Y478-I491 HydrophobicContact CG-CG2 4.1Å; M488-I491 PolarHBondContact O-N 2.64Å; M488-I491 HydrophobicContact SD-CD1 4.08Å; K489-I491 PolarHBondContact O-N 3.47Å
492	W	95.4	Very high	93.7	Very high	7 Å²	7	16.4 Å²	16.4	3%	0.027	8%	0.078	C	C	.	.	H	α-helix	trans	-75.1	-51.5	-174.7	178.1	46.3	0	0	0	113.2	L407 L412 Y424 S475 A482 F483 M488 K489 G494 H495 M496	L407-W492 HydrophobicContact CD2-CZ3 3.99Å; L412-W492 HydrophobicContact CD2-CH2 4.46Å; Y424-W492 AromaticContact CE1-CZ2 3.89Å; Y424-W492 HydrophobicContact CE1-CZ2 3.89Å; Y424-W492 AromaticContact CZ-NE1 3.98Å; Y424-W492 PolarHBondContact OH-NE1 2.79Å; Y424-W492 VanDerWaalsContact OH-NE1 3.15Å; S475-W492 PolarHBondContact O-NE1 3.38Å; A482-W492 HydrophobicContact CB-CB 3.98Å; A482-W492 HydrophobicContact CB-CD2 4.12Å; A482-W492 HydrophobicContact CB-CE3 3.71Å; A482-W492 HydrophobicContact CB-CG 4.26Å; F483-W492 AromaticContact CE2-CH2 3.96Å; F483-W492 HydrophobicContact CE2-CH2 3.96Å; F483-W492 HydrophobicContact CE2-CZ2 4.48Å; F483-W492 HydrophobicContact CE2-CZ3 4.47Å; F483-W492 HydrophobicContact CZ-CH2 4.34Å; M488-W492 PolarHBondContact O-N 3.31Å; K489-W492 PolarHBondContact O-N 3.46Å; W492-G494 PolarHBondContact O-N 3.38Å; W492-H495 CarbonylContact O-C 3.57Å; W492-H495 WeakPolarHBondContact O-CB 3.39Å; W492-H495 PolarHBondContact O-N 3.41Å; W492-H495 VanDerWaalsContact O-N 3.11Å; W492-M496 HydrophobicContact CH2-SD 4.01Å; W492-M496 HydrophobicContact CZ2-CG 4.49Å; W492-M496 HydrophobicContact CZ2-SD 3.72Å; W492-M496 WeakPolarHBondContact O-CB 3.25Å; W492-M496 PolarHBondContact O-N 3.32Å
493	T	95.4	Very high	93.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.4	-39.2	-169.4	-46.3	0	0	0	0	112.7	D204 T205 L415 K489 H495 M496 C497	D204-T493 HydrophobicContact CB-CG2 4.07Å; D204-T493 VanDerWaalsContact O-CB 3.23Å; D204-T493 WeakPolarHBondContact O-CB 3.37Å; D204-T493 PolarHBondContact O-OG1 2.93Å; T205-T493 HydrophobicContact CG2-CG2 3.57Å; L415-T493 HydrophobicContact CD2-CG2 3.68Å; K489-T493 PolarHBondContact O-N 2.59Å; K489-T493 PolarHBondContact O-OG1 3.47Å; T493-H495 PolarHBondContact O-N 2.87Å; T493-M496 HydrophobicContact CG2-CE 4.47Å; T493-M496 VanDerWaalsContact O-CB 3.22Å; T493-M496 WeakPolarHBondContact O-CB 3.47Å; T493-M496 PolarHBondContact O-N 3.35Å; T493-C497 PolarHBondContact O-N 3.31Å; T493-C497 VanDerWaalsContact O-N 3.1Å; T493-C497 PolarHBondContact O-SG 2.91Å
494	G	95.3	Very high	93.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.9	-43.7	175.6	0	0	0	0	0	112.2	W492 C497	W492-G494 PolarHBondContact O-N 3.38Å; G494-C497 WeakPolarHBondContact O-CB 3.35Å; G494-C497 PolarHBondContact O-N 3.19Å
495	H	95.7	Very high	93.8	Very high	10 Å²	10	11.2 Å²	11.2	5%	0.046	5%	0.053	C	C	.	.	H	α-helix	trans	-68.1	-35.6	174.8	-162.3	72.4	0	0	0	112.3	N471 W492 T493 C497 A498 V499	N471-H495 PolarHBondContact O-NE2 3.01Å; N471-H495 PolarHBondContact OD1-CE1 2.83Å; W492-H495 CarbonylContact O-C 3.57Å; W492-H495 WeakPolarHBondContact O-CB 3.39Å; W492-H495 PolarHBondContact O-N 3.41Å; W492-H495 VanDerWaalsContact O-N 3.11Å; T493-H495 PolarHBondContact O-N 2.87Å; H495-C497 VanDerWaalsContact C-N 3.26Å; H495-C497 PolarHBondContact O-N 2.96Å; H495-A498 PolarHBondContact O-N 3.3Å; H495-A498 VanDerWaalsContact O-N 3.12Å; H495-V499 PolarHBondContact O-N 3.34Å
496	M	96.4	Very high	93.7	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-55.8	-41.5	174.5	-156.1	-175.4	70.7	0	0	111.3	L415 L420 Y424 W492 T493 A498 V499 A500	L415-M496 HydrophobicContact CB-CE 4.33Å; L415-M496 HydrophobicContact CD1-CE 3.79Å; L415-M496 HydrophobicContact CD1-SD 4.32Å; L415-M496 HydrophobicContact CD2-CE 3.82Å; L415-M496 HydrophobicContact CG-CE 4.19Å; L420-M496 HydrophobicContact CD1-CE 4.18Å; L420-M496 HydrophobicContact CD2-CE 3.25Å; L420-M496 HydrophobicContact CG-CE 3.4Å; L420-M496 VanDerWaalsContact CG-CE 3.4Å; Y424-M496 HydrophobicContact CD1-CG 3.8Å; Y424-M496 HydrophobicContact CD1-SD 3.75Å; Y424-M496 HydrophobicContact CD2-CB 4.41Å; Y424-M496 HydrophobicContact CD2-CG 3.28Å; Y424-M496 HydrophobicContact CD2-SD 4.32Å; Y424-M496 HydrophobicContact CE1-CG 3.78Å; Y424-M496 HydrophobicContact CE1-SD 3.82Å; Y424-M496 HydrophobicContact CE2-CB 4.23Å; Y424-M496 HydrophobicContact CE2-CG 3.26Å; Y424-M496 HydrophobicContact CE2-SD 4.39Å; Y424-M496 HydrophobicContact CG-CG 3.55Å; Y424-M496 HydrophobicContact CG-SD 4Å; W492-M496 HydrophobicContact CH2-SD 4.01Å; W492-M496 HydrophobicContact CZ2-CG 4.49Å; W492-M496 HydrophobicContact CZ2-SD 3.72Å; W492-M496 WeakPolarHBondContact O-CB 3.25Å; W492-M496 PolarHBondContact O-N 3.32Å; T493-M496 HydrophobicContact CG2-CE 4.47Å; T493-M496 VanDerWaalsContact O-CB 3.22Å; T493-M496 WeakPolarHBondContact O-CB 3.47Å; T493-M496 PolarHBondContact O-N 3.35Å; M496-A498 PolarHBondContact O-N 3.02Å; M496-V499 PolarHBondContact O-N 3.21Å; M496-A500 WeakPolarHBondContact O-CB 3.16Å; M496-A500 PolarHBondContact O-N 3.42Å
497	C	97.4	Very high	93.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60	-45	176.3	-61.9	0	0	0	0	111.8	T194 W197 T493 G494 H495 A501	T194-C497 HydrophobicContact CG2-CB 3.91Å; W197-C497 HydrophobicContact CB-CB 4.18Å; T493-C497 PolarHBondContact O-N 3.31Å; T493-C497 VanDerWaalsContact O-N 3.1Å; T493-C497 PolarHBondContact O-SG 2.91Å; G494-C497 WeakPolarHBondContact O-CB 3.35Å; G494-C497 PolarHBondContact O-N 3.19Å; H495-C497 VanDerWaalsContact C-N 3.26Å; H495-C497 PolarHBondContact O-N 2.96Å; C497-A501 VanDerWaalsContact O-CB 3.32Å; C497-A501 WeakPolarHBondContact O-CB 3.39Å; C497-A501 PolarHBondContact O-N 2.88Å
498	A	97	Very high	93.3	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-67.6	-42.6	-179.5	0	0	0	0	0	112.3	A181 T194 H495 M496 A501 Y502	A181-A498 HydrophobicContact CB-CB 4.14Å; T194-A498 HydrophobicContact CG2-CB 4.04Å; H495-A498 PolarHBondContact O-N 3.3Å; H495-A498 VanDerWaalsContact O-N 3.12Å; M496-A498 PolarHBondContact O-N 3.02Å; A498-A501 PolarHBondContact O-N 3.23Å; A498-Y502 PolarHBondContact O-N 3.16Å
499	V	96.7	Very high	93	Very high	3 Å²	3	8.2 Å²	8.2	2%	0.018	4%	0.044	C	C	.	.	H	α-helix	trans	-69	-41.6	178.4	174.9	0	0	0	0	111.4	Y424 T427 V428 H495 M496 A501 Y502 G503	Y424-V499 HydrophobicContact CD2-CG1 4.47Å; Y424-V499 HydrophobicContact CE2-CB 4.45Å; Y424-V499 HydrophobicContact CE2-CG1 4.28Å; T427-V499 HydrophobicContact CG2-CG1 4.16Å; V428-V499 HydrophobicContact CG2-CG1 4.22Å; H495-V499 PolarHBondContact O-N 3.34Å; M496-V499 PolarHBondContact O-N 3.21Å; V499-A501 VanDerWaalsContact C-N 3.31Å; V499-A501 PolarHBondContact O-N 3.09Å; V499-Y502 WeakPolarHBondContact O-CB 3.46Å; V499-Y502 PolarHBondContact O-N 3.47Å; V499-G503 PolarHBondContact O-N 2.97Å
500	A	96.8	Very high	92.7	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-61.3	-41.5	174.3	0	0	0	0	0	111.4	W197 L420 P423 Y424 M496 Y502 G503 V504	W197-A500 HydrophobicContact CE3-CB 4.42Å; W197-A500 HydrophobicContact CH2-CB 4.06Å; W197-A500 HydrophobicContact CZ3-CB 3.7Å; L420-A500 HydrophobicContact CD1-CB 3.5Å; P423-A500 HydrophobicContact CG-CB 4.48Å; Y424-A500 HydrophobicContact CD2-CB 4.37Å; M496-A500 WeakPolarHBondContact O-CB 3.16Å; M496-A500 PolarHBondContact O-N 3.42Å; A500-Y502 VanDerWaalsContact C-N 3.34Å; A500-Y502 PolarHBondContact O-N 2.91Å; A500-G503 WeakPolarHBondContact O-CA 3.34Å; A500-G503 PolarHBondContact O-N 3.37Å; A500-V504 WeakPolarHBondContact O-CG2 3.28Å; A500-V504 PolarHBondContact O-N 3.29Å; A500-V504 VanDerWaalsContact O-N 3.08Å
501	A	96.6	Very high	92.3	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-67.8	-36.4	179.4	0	0	0	0	0	111.9	A181 A190 L193 T194 W197 C497 A498 V499 G503 V504 C505	A181-A501 HydrophobicContact CB-CB 4.41Å; A190-A501 HydrophobicContact CB-CB 4.33Å; A190-A501 VanDerWaalsContact O-CB 3.26Å; A190-A501 WeakPolarHBondContact O-CB 3.46Å; L193-A501 HydrophobicContact CB-CB 4.44Å; L193-A501 HydrophobicContact CD2-CB 4.39Å; T194-A501 WeakPolarHBondContact OG1-CB 3.34Å; W197-A501 HydrophobicContact CE3-CB 4.46Å; W197-A501 HydrophobicContact CZ3-CB 3.96Å; C497-A501 VanDerWaalsContact O-CB 3.32Å; C497-A501 WeakPolarHBondContact O-CB 3.39Å; C497-A501 PolarHBondContact O-N 2.88Å; A498-A501 PolarHBondContact O-N 3.23Å; V499-A501 VanDerWaalsContact C-N 3.31Å; V499-A501 PolarHBondContact O-N 3.09Å; A501-G503 VanDerWaalsContact C-N 3.28Å; A501-G503 PolarHBondContact O-N 2.98Å; A501-V504 PolarHBondContact O-N 2.68Å; A501-C505 VanDerWaalsContact O-CB 3.27Å; A501-C505 WeakPolarHBondContact O-CB 3.42Å; A501-C505 PolarHBondContact O-N 2.72Å; A501-C505 PolarHBondContact O-SG 3.04Å
502	Y	95.2	Very high	91.8	Very high	5 Å²	5	14 Å²	14	2%	0.02	7%	0.074	C	C	.	.	H	α-helix	trans	-58.7	-41.1	168.1	170.6	-109.2	0	0	0	111.8	L184 A185 L431 V468 A498 V499 A500 V504 G506 D508 L509	L184-Y502 VanDerWaalsContact C-CD2 3.46Å; L184-Y502 HydrophobicContact CB-CD2 3.55Å; L184-Y502 HydrophobicContact CB-CE2 4.19Å; L184-Y502 HydrophobicContact CB-CG 3.94Å; L184-Y502 VanDerWaalsContact O-CE2 3.29Å; L184-Y502 WeakPolarHBondContact O-CE2 3.32Å; A185-Y502 HydrophobicContact CB-CD2 4.15Å; L431-Y502 HydrophobicContact CD1-CD1 4.06Å; L431-Y502 HydrophobicContact CD1-CE1 3.89Å; L431-Y502 HydrophobicContact CD2-CE1 3.81Å; L431-Y502 HydrophobicContact CG-CE1 4.46Å; V468-Y502 HydrophobicContact CG1-CE1 3.78Å; V468-Y502 HydrophobicContact CG2-CE2 4.49Å; A498-Y502 PolarHBondContact O-N 3.16Å; V499-Y502 WeakPolarHBondContact O-CB 3.46Å; V499-Y502 PolarHBondContact O-N 3.47Å; A500-Y502 VanDerWaalsContact C-N 3.34Å; A500-Y502 PolarHBondContact O-N 2.91Å; Y502-V504 PolarHBondContact O-N 3.16Å; Y502-G506 WeakPolarHBondContact O-CA 3.19Å; Y502-G506 PolarHBondContact O-N 2.83Å; Y502-D508 PolarHBondContact OH-OD2 2.94Å; Y502-L509 HydrophobicContact CD1-CD1 4.44Å; Y502-L509 HydrophobicContact CE1-CD1 4.18Å
503	G	92.9	Very high	91.2	Very high	7 Å²	7	16.9 Å²	16.9	7%	0.072	9%	0.089	C	C	.	.	H	α-helix	trans	-54.5	-49.7	173.8	0	0	0	0	0	114.4	T427 V499 A500 A501	T427-G503 WeakPolarHBondContact OG1-CA 3.3Å; V499-G503 PolarHBondContact O-N 2.97Å; A500-G503 WeakPolarHBondContact O-CA 3.34Å; A500-G503 PolarHBondContact O-N 3.37Å; A501-G503 VanDerWaalsContact C-N 3.28Å; A501-G503 PolarHBondContact O-N 2.98Å
504	V	93.8	Very high	90.7	Very high	6 Å²	6	17.3 Å²	17.3	4%	0.036	9%	0.092	C	C	.	.	H	α-helix	trans	-76.5	-36.7	-177.1	-173.1	0	0	0	0	112	L193 W197 P423 A500 A501 Y502 W510 V532 P533 M536	L193-V504 HydrophobicContact CD2-CB 4.27Å; L193-V504 HydrophobicContact CD2-CG1 4.44Å; L193-V504 HydrophobicContact CD2-CG2 4.44Å; W197-V504 HydrophobicContact CH2-CG2 4.2Å; P423-V504 HydrophobicContact CB-CG2 3.5Å; P423-V504 VanDerWaalsContact CB-CG2 3.5Å; P423-V504 HydrophobicContact CG-CG2 4.08Å; A500-V504 WeakPolarHBondContact O-CG2 3.28Å; A500-V504 PolarHBondContact O-N 3.29Å; A500-V504 VanDerWaalsContact O-N 3.08Å; A501-V504 PolarHBondContact O-N 2.68Å; Y502-V504 PolarHBondContact O-N 3.16Å; V504-W510 PolarHBondContact O-NE1 3.11Å; V504-V532 HydrophobicContact CG1-CB 4.3Å; V504-V532 HydrophobicContact CG1-CG1 3.66Å; V504-P533 HydrophobicContact CG1-CB 4.5Å; V504-P533 HydrophobicContact CG1-CG 3.86Å; V504-M536 HydrophobicContact CG1-SD 3.96Å; V504-M536 HydrophobicContact CG2-SD 4.23Å
505	C	92.8	Very high	90.1	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	12%	0.12	C	C	.	.	H	α-helix	trans	-102	-11.8	-172	-58.8	0	0	0	0	114.1	A185 A190 A501 R529 P533	A185-C505 HydrophobicContact CB-CB 3.91Å; A190-C505 VanDerWaalsContact CA-SG 3.59Å; A190-C505 HydrophobicContact CB-CB 3.61Å; A501-C505 VanDerWaalsContact O-CB 3.27Å; A501-C505 WeakPolarHBondContact O-CB 3.42Å; A501-C505 PolarHBondContact O-N 2.72Å; A501-C505 PolarHBondContact O-SG 3.04Å; C505-R529 VanDerWaalsContact O-CZ 3.28Å; C505-R529 PolarHBondContact O-NE 2.72Å; C505-R529 PolarHBondContact O-NH2 2.92Å; C505-P533 WeakPolarHBondContact SG-CG 3.31Å
506	G	86.7	Confident	89.5	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.			trans	-75.3	153.5	-174.1	0	0	0	0	0	113.3	Y502 W510	Y502-G506 WeakPolarHBondContact O-CA 3.19Å; Y502-G506 PolarHBondContact O-N 2.83Å; G506-W510 VanDerWaalsContact O-CD1 3.25Å
507	T	84.9	Confident	88.8	Confident	36 Å²	36	33 Å²	33	22%	0.221	18%	0.181	C	C	.	.	H	α-helix	trans	-74.8	-39.9	175.1	38	0	0	0	0	112.6	L509 W510 T511	T507-L509 PolarHBondContact O-N 3.26Å; T507-W510 PolarHBondContact O-N 2.95Å; T507-T511 WeakPolarHBondContact O-CB 3.26Å; T507-T511 VanDerWaalsContact O-CG2 3.23Å; T507-T511 WeakPolarHBondContact O-CG2 3.46Å; T507-T511 PolarHBondContact O-N 2.88Å; T507-T511 PolarHBondContact O-OG1 3.27Å; T507-T511 VanDerWaalsContact O-OG1 3.06Å
508	D	83.5	Confident	88	Confident	50 Å²	50	44.2 Å²	44.2	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-69	-41.2	-158.5	-54.2	-10.1	0	0	0	110.6	R465 Y502 T511 L512	R465-D508 IonicContact NH1-OD2 3.55Å; Y502-D508 PolarHBondContact OH-OD2 2.94Å; D508-T511 PolarHBondContact O-OG1 2.78Å; D508-L512 PolarHBondContact O-N 3.24Å
509	L	83.6	Confident	87.1	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-71.1	-46.6	178.4	-72	155.3	0	0	0	112.7	T427 L430 L431 M434 Y502 T507 T511 L512 L513	T427-L509 HydrophobicContact CG2-CD1 3.8Å; L430-L509 HydrophobicContact CB-CD2 3.43Å; L430-L509 VanDerWaalsContact CB-CD2 3.43Å; L430-L509 HydrophobicContact CD1-CD2 3.77Å; L430-L509 HydrophobicContact CG-CD2 4.25Å; L431-L509 HydrophobicContact CD1-CD1 4.49Å; L431-L509 HydrophobicContact CD2-CD1 4.34Å; L431-L509 HydrophobicContact CD2-CD2 4.42Å; L431-L509 HydrophobicContact CD2-CG 4.44Å; L431-L509 HydrophobicContact CG-CD1 4.29Å; L431-L509 HydrophobicContact CG-CD2 4.3Å; M434-L509 HydrophobicContact CE-CD2 3.85Å; M434-L509 HydrophobicContact CE-CG 4.36Å; Y502-L509 HydrophobicContact CD1-CD1 4.44Å; Y502-L509 HydrophobicContact CE1-CD1 4.18Å; T507-L509 PolarHBondContact O-N 3.26Å; L509-T511 VanDerWaalsContact C-N 3.34Å; L509-T511 PolarHBondContact O-N 2.91Å; L509-L512 PolarHBondContact O-N 3.31Å; L509-L513 WeakPolarHBondContact O-CG 3.31Å; L509-L513 PolarHBondContact O-N 3.1Å
510	W	85.8	Confident	86	Confident	56 Å²	56	50.9 Å²	50.9	21%	0.212	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-37	178.5	-75.7	116.8	0	0	0	112.3	V504 G506 T507 L512 L513 L514 L525 I528 V532	V504-W510 PolarHBondContact O-NE1 3.11Å; G506-W510 VanDerWaalsContact O-CD1 3.25Å; T507-W510 PolarHBondContact O-N 2.95Å; W510-L512 VanDerWaalsContact C-N 3.34Å; W510-L513 HydrophobicContact CE3-CD1 4.24Å; W510-L513 HydrophobicContact CZ3-CD1 4.47Å; W510-L513 PolarHBondContact O-N 3.32Å; W510-L514 VanDerWaalsContact O-CB 3.24Å; W510-L514 WeakPolarHBondContact O-CB 3.16Å; W510-L514 WeakPolarHBondContact O-CG 3.44Å; W510-L514 PolarHBondContact O-N 3.09Å; W510-L525 HydrophobicContact CB-CD1 3.34Å; W510-L525 HydrophobicContact CG-CD1 4.39Å; W510-I528 HydrophobicContact CD2-CG2 3.67Å; W510-I528 HydrophobicContact CE3-CG2 3.78Å; W510-I528 HydrophobicContact CG-CG2 4.37Å; W510-I528 HydrophobicContact CH2-CG2 3.72Å; W510-I528 HydrophobicContact CZ2-CG2 3.59Å; W510-I528 HydrophobicContact CZ3-CG2 3.81Å; W510-V532 HydrophobicContact CZ2-CG2 4.41Å
511	T	84.4	Confident	85.3	Confident	35 Å²	35	54.8 Å²	54.8	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-39.7	175.4	56.8	0	0	0	0	111.8	T507 D508 L509 K515 L525	T507-T511 WeakPolarHBondContact O-CB 3.26Å; T507-T511 VanDerWaalsContact O-CG2 3.23Å; T507-T511 WeakPolarHBondContact O-CG2 3.46Å; T507-T511 PolarHBondContact O-N 2.88Å; T507-T511 PolarHBondContact O-OG1 3.27Å; T507-T511 VanDerWaalsContact O-OG1 3.06Å; D508-T511 PolarHBondContact O-OG1 2.78Å; L509-T511 VanDerWaalsContact C-N 3.34Å; L509-T511 PolarHBondContact O-N 2.91Å; T511-K515 WeakPolarHBondContact O-CB 3.11Å; T511-K515 WeakPolarHBondContact O-CG 2.97Å; T511-K515 PolarHBondContact O-N 2.72Å; T511-L525 HydrophobicContact CG2-CD1 3.98Å; T511-L525 HydrophobicContact CG2-CD2 3.51Å; T511-L525 HydrophobicContact CG2-CG 4.41Å
512	L	82.5	Confident	84.5	Confident	74 Å²	74	63.3 Å²	63.3	39%	0.387	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-49.3	174.1	-175.3	71.9	0	0	0	111.4	L430 M434 D508 L509 W510 K515 A516	L430-L512 HydrophobicContact CD2-CD2 4.45Å; M434-L512 HydrophobicContact CG-CD2 4.25Å; M434-L512 HydrophobicContact SD-CD2 3.93Å; D508-L512 PolarHBondContact O-N 3.24Å; L509-L512 PolarHBondContact O-N 3.31Å; W510-L512 VanDerWaalsContact C-N 3.34Å; L512-K515 PolarHBondContact O-N 3.31Å; L512-A516 WeakPolarHBondContact O-CB 3.47Å; L512-A516 PolarHBondContact O-N 3.44Å
513	L	82.3	Confident	83.9	Confident	67 Å²	67	68.8 Å²	68.8	35%	0.351	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-46.9	-179.9	-71.4	168.1	0	0	0	112.2	L430 L509 W510 K515 A516 L517	L430-L513 HydrophobicContact CD1-CD1 4.39Å; L430-L513 HydrophobicContact CD1-CD2 4.26Å; L430-L513 HydrophobicContact CD1-CG 4.43Å; L509-L513 WeakPolarHBondContact O-CG 3.31Å; L509-L513 PolarHBondContact O-N 3.1Å; W510-L513 HydrophobicContact CE3-CD1 4.24Å; W510-L513 HydrophobicContact CZ3-CD1 4.47Å; W510-L513 PolarHBondContact O-N 3.32Å; L513-K515 VanDerWaalsContact C-N 3.35Å; L513-K515 PolarHBondContact O-N 3.17Å; L513-A516 WeakPolarHBondContact O-CB 3.42Å; L513-A516 PolarHBondContact O-N 3.16Å; L513-L517 WeakPolarHBondContact O-CB 3.43Å; L513-L517 VanDerWaalsContact O-CG 3.3Å; L513-L517 WeakPolarHBondContact O-CG 3.4Å; L513-L517 PolarHBondContact O-N 3.5Å
514	L	84.1	Confident	83.5	Confident	10 Å²	10	71.4 Å²	71.4	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-69	-32.1	179.8	-68.7	172.7	0	0	0	112.5	W510 L517 R518 C519 N520 L524 L525 I528	W510-L514 VanDerWaalsContact O-CB 3.24Å; W510-L514 WeakPolarHBondContact O-CB 3.16Å; W510-L514 WeakPolarHBondContact O-CG 3.44Å; W510-L514 PolarHBondContact O-N 3.09Å; L514-L517 CarbonylContact O-C 3.6Å; L514-L517 PolarHBondContact O-N 2.84Å; L514-R518 PolarHBondContact O-N 3Å; L514-R518 VanDerWaalsContact O-N 3.14Å; L514-C519 PolarHBondContact O-N 3.25Å; L514-N520 HydrophobicContact CB-CB 4.17Å; L514-L524 HydrophobicContact CD2-CD2 4.1Å; L514-L525 HydrophobicContact CD1-CB 4.17Å; L514-L525 HydrophobicContact CD1-CD1 3.92Å; L514-I528 HydrophobicContact CD1-CD1 4.25Å; L514-I528 HydrophobicContact CD2-CD1 4.02Å
515	K	82.8	Confident	83.1	Confident	135 Å²	135	72.2 Å²	72.2	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-65.4	-44.7	170.4	-79.3	174.6	-178.9	176.5	0	111	T511 L512 L513 L517 R518 N520	T511-K515 WeakPolarHBondContact O-CB 3.11Å; T511-K515 WeakPolarHBondContact O-CG 2.97Å; T511-K515 PolarHBondContact O-N 2.72Å; L512-K515 PolarHBondContact O-N 3.31Å; L513-K515 VanDerWaalsContact C-N 3.35Å; L513-K515 PolarHBondContact O-N 3.17Å; K515-L517 VanDerWaalsContact C-N 3.26Å; K515-L517 PolarHBondContact O-N 3.17Å; K515-R518 PolarHBondContact O-N 3.31Å; K515-R518 VanDerWaalsContact O-N 3.09Å; K515-N520 HydrophobicContact CG-CB 4.13Å
516	A	82.9	Confident	82.6	Confident	83 Å²	83	78.6 Å²	78.6	69%	0.686	40%	0.398	S	S	*	.	H	α-helix	trans	-60.8	-37.3	176.1	0	0	0	0	0	112	L512 L513 R518	L512-A516 WeakPolarHBondContact O-CB 3.47Å; L512-A516 PolarHBondContact O-N 3.44Å; L513-A516 WeakPolarHBondContact O-CB 3.42Å; L513-A516 PolarHBondContact O-N 3.16Å; A516-R518 VanDerWaalsContact C-N 3.28Å; A516-R518 PolarHBondContact O-N 2.88Å
517	L	83.2	Confident	82.7	Confident	122 Å²	122	85.6 Å²	85.6	64%	0.639	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	1.2	176.9	-65.7	167.6	0	0	0	114.2	L513 L514 K515 C519	L513-L517 WeakPolarHBondContact O-CB 3.43Å; L513-L517 VanDerWaalsContact O-CG 3.3Å; L513-L517 WeakPolarHBondContact O-CG 3.4Å; L513-L517 PolarHBondContact O-N 3.5Å; L514-L517 CarbonylContact O-C 3.6Å; L514-L517 PolarHBondContact O-N 2.84Å; K515-L517 VanDerWaalsContact C-N 3.26Å; K515-L517 PolarHBondContact O-N 3.17Å; L517-C519 PolarHBondContact O-N 2.87Å; L517-C519 PolarHBondContact O-SG 3.44Å; L517-C519 VanDerWaalsContact O-SG 3.4Å
518	R	80.2	Confident	82.8	Confident	235 Å²	235	85 Å²	85	89%	0.887	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	23.1	-176.5	-57.3	-174.4	-179.7	-174.6	0.6	115.3	L514 K515 A516	L514-R518 PolarHBondContact O-N 3Å; L514-R518 VanDerWaalsContact O-N 3.14Å; K515-R518 PolarHBondContact O-N 3.31Å; K515-R518 VanDerWaalsContact O-N 3.09Å; A516-R518 VanDerWaalsContact C-N 3.28Å; A516-R518 PolarHBondContact O-N 2.88Å
519	C	77.4	Confident	83	Confident	73 Å²	73	84.5 Å²	84.5	49%	0.493	42%	0.418	S	S	.	.			trans	-118.2	33	-176.7	-68.9	0	0	0	0	112.7	L514 L517 T521 L524	L514-C519 PolarHBondContact O-N 3.25Å; L517-C519 PolarHBondContact O-N 2.87Å; L517-C519 PolarHBondContact O-SG 3.44Å; L517-C519 VanDerWaalsContact O-SG 3.4Å; C519-T521 PolarHBondContact O-N 3.46Å; C519-T521 VanDerWaalsContact O-N 3.07Å; C519-L524 WeakPolarHBondContact O-CD2 3.33Å
520	N	73.6	Confident	83.2	Confident	70 Å²	70	88.4 Å²	88.4	37%	0.374	43%	0.433	S	S	.	.			trans	-83	86.5	-172.8	-172.6	30.6	0	0	0	112.8	L514 K515	L514-N520 HydrophobicContact CB-CB 4.17Å; K515-N520 HydrophobicContact CG-CB 4.13Å
521	T	81.5	Confident	83.5	Confident	82 Å²	82	87 Å²	87	50%	0.503	43%	0.433	S	S	.	.			trans	-105	140.3	165.1	60.1	0	0	0	0	111	C519 V523 L524 L525	C519-T521 PolarHBondContact O-N 3.46Å; C519-T521 VanDerWaalsContact O-N 3.07Å; T521-V523 PolarHBondContact O-N 2.98Å; T521-L524 PolarHBondContact O-N 3.42Å; T521-L524 WeakPolarHBondContact OG1-CB 3.45Å; T521-L524 PolarHBondContact OG1-N 2.97Å; T521-L525 PolarHBondContact O-N 3.25Å
522	K	80.7	Confident	83.9	Confident	179 Å²	179	87.4 Å²	87.4	78%	0.778	44%	0.436	S	S	*	.	H	α-helix	trans	-59.4	-33.1	180	-68.4	-175.6	179.3	-179.7	0	112.6	R526	K522-R526 PolarHBondContact O-N 2.84Å; K522-R526 VanDerWaalsContact O-N 3.13Å
523	V	82.9	Confident	84.4	Confident	120 Å²	120	83.9 Å²	83.9	73%	0.727	42%	0.417	S	S	*	.	H	α-helix	trans	-68.3	-48.1	177.5	-179.9	0	0	0	0	110.7	T521 L525 R526 F527	T521-V523 PolarHBondContact O-N 2.98Å; V523-L525 VanDerWaalsContact C-N 3.35Å; V523-L525 PolarHBondContact O-N 3.24Å; V523-R526 PolarHBondContact O-N 3.32Å; V523-F527 WeakPolarHBondContact O-CB 3.33Å; V523-F527 PolarHBondContact O-N 2.7Å
524	L	84.7	Confident	85	Confident	62 Å²	62	84.8 Å²	84.8	33%	0.325	43%	0.426	S	S	.	.	H	α-helix	trans	-61.8	-42.7	177.4	-178.4	63.6	0	0	0	111.7	L514 C519 T521 R526 F527 I528	L514-L524 HydrophobicContact CD2-CD2 4.1Å; C519-L524 WeakPolarHBondContact O-CD2 3.33Å; T521-L524 PolarHBondContact O-N 3.42Å; T521-L524 WeakPolarHBondContact OG1-CB 3.45Å; T521-L524 PolarHBondContact OG1-N 2.97Å; L524-R526 VanDerWaalsContact C-N 3.33Å; L524-R526 PolarHBondContact O-N 2.8Å; L524-F527 PolarHBondContact O-N 3.05Å; L524-I528 HydrophobicContact CD1-CD1 3.91Å; L524-I528 HydrophobicContact CD1-CG1 4.08Å; L524-I528 HydrophobicContact CD2-CD1 4.36Å; L524-I528 HydrophobicContact CG-CD1 3.75Å; L524-I528 HydrophobicContact CG-CG1 4.31Å; L524-I528 WeakPolarHBondContact O-CB 3.38Å; L524-I528 WeakPolarHBondContact O-CG1 3.44Å; L524-I528 PolarHBondContact O-N 2.98Å
525	L	84.4	Confident	85.5	Confident	23 Å²	23	90.4 Å²	90.4	12%	0.12	46%	0.455	C	S	.	.	H	α-helix	trans	-57.7	-46	175.6	179.8	70.6	0	0	0	111.5	W510 T511 L514 T521 V523 R529	W510-L525 HydrophobicContact CB-CD1 3.34Å; W510-L525 HydrophobicContact CG-CD1 4.39Å; T511-L525 HydrophobicContact CG2-CD1 3.98Å; T511-L525 HydrophobicContact CG2-CD2 3.51Å; T511-L525 HydrophobicContact CG2-CG 4.41Å; L514-L525 HydrophobicContact CD1-CB 4.17Å; L514-L525 HydrophobicContact CD1-CD1 3.92Å; T521-L525 PolarHBondContact O-N 3.25Å; V523-L525 VanDerWaalsContact C-N 3.35Å; V523-L525 PolarHBondContact O-N 3.24Å; L525-R529 WeakPolarHBondContact O-CB 3.45Å; L525-R529 WeakPolarHBondContact O-CG 3.36Å; L525-R529 PolarHBondContact O-N 2.97Å; L525-R529 VanDerWaalsContact O-N 3.15Å
526	R	83.6	Confident	86.1	Confident	134 Å²	134	85.3 Å²	85.3	51%	0.506	43%	0.434	S	S	.	.	H	α-helix	trans	-65.2	-42.8	177.9	-168.4	175.5	-73.4	168	2	110.8	T30 K522 V523 L524 R529 Y530	T30-R526 PolarHBondContact OG1-NH2 3.17Å; K522-R526 PolarHBondContact O-N 2.84Å; K522-R526 VanDerWaalsContact O-N 3.13Å; V523-R526 PolarHBondContact O-N 3.32Å; L524-R526 VanDerWaalsContact C-N 3.33Å; L524-R526 PolarHBondContact O-N 2.8Å; R526-R529 PolarHBondContact O-N 3.27Å; R526-Y530 HydrophobicContact CG-CD2 3.99Å; R526-Y530 HydrophobicContact CG-CE2 3.72Å; R526-Y530 WeakPolarHBondContact O-CD2 3.27Å; R526-Y530 PolarHBondContact O-N 3.47Å
527	F	87.3	Confident	86.7	Confident	147 Å²	147	83 Å²	83	65%	0.645	41%	0.41	S	S	*	.	H	α-helix	trans	-60.8	-51.4	178.3	-173	-95.4	0	0	0	111.9	V523 L524 R529 Y530 A531	V523-F527 WeakPolarHBondContact O-CB 3.33Å; V523-F527 PolarHBondContact O-N 2.7Å; L524-F527 PolarHBondContact O-N 3.05Å; F527-R529 VanDerWaalsContact C-N 3.33Å; F527-R529 PolarHBondContact O-N 3.39Å; F527-Y530 PolarHBondContact O-N 2.89Å; F527-A531 HydrophobicContact CD1-CB 4.1Å; F527-A531 HydrophobicContact CE1-CB 3.85Å; F527-A531 HydrophobicContact CZ-CB 4.18Å; F527-A531 WeakPolarHBondContact O-CB 3.21Å; F527-A531 PolarHBondContact O-N 2.88Å
528	I	87.6	Confident	87.2	Confident	25 Å²	25	79.1 Å²	79.1	13%	0.128	40%	0.398	C	S	.	.	H	α-helix	trans	-57.8	-45.1	179.4	-70	172.2	0	0	0	111.2	W510 L514 L524 Y530 A531 V532	W510-I528 HydrophobicContact CD2-CG2 3.67Å; W510-I528 HydrophobicContact CE3-CG2 3.78Å; W510-I528 HydrophobicContact CG-CG2 4.37Å; W510-I528 HydrophobicContact CH2-CG2 3.72Å; W510-I528 HydrophobicContact CZ2-CG2 3.59Å; W510-I528 HydrophobicContact CZ3-CG2 3.81Å; L514-I528 HydrophobicContact CD1-CD1 4.25Å; L514-I528 HydrophobicContact CD2-CD1 4.02Å; L524-I528 HydrophobicContact CD1-CD1 3.91Å; L524-I528 HydrophobicContact CD1-CG1 4.08Å; L524-I528 HydrophobicContact CD2-CD1 4.36Å; L524-I528 HydrophobicContact CG-CD1 3.75Å; L524-I528 HydrophobicContact CG-CG1 4.31Å; L524-I528 WeakPolarHBondContact O-CB 3.38Å; L524-I528 WeakPolarHBondContact O-CG1 3.44Å; L524-I528 PolarHBondContact O-N 2.98Å; I528-Y530 PolarHBondContact O-N 2.68Å; I528-A531 PolarHBondContact O-N 3.17Å; I528-V532 HydrophobicContact CG2-CG2 3.82Å; I528-V532 WeakPolarHBondContact O-CB 3.16Å; I528-V532 WeakPolarHBondContact O-CG2 3.2Å; I528-V532 PolarHBondContact O-N 2.83Å
529	R	86.8	Confident	87.9	Confident	39 Å²	39	72.3 Å²	72.3	15%	0.147	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-22.3	-178.4	-74.4	177.1	70.7	-155.2	2.5	114.6	A185 C505 L525 R526 F527 P533	A185-R529 PolarHBondContact O-NH2 3.32Å; C505-R529 VanDerWaalsContact O-CZ 3.28Å; C505-R529 PolarHBondContact O-NE 2.72Å; C505-R529 PolarHBondContact O-NH2 2.92Å; L525-R529 WeakPolarHBondContact O-CB 3.45Å; L525-R529 WeakPolarHBondContact O-CG 3.36Å; L525-R529 PolarHBondContact O-N 2.97Å; L525-R529 VanDerWaalsContact O-N 3.15Å; R526-R529 PolarHBondContact O-N 3.27Å; F527-R529 VanDerWaalsContact C-N 3.33Å; F527-R529 PolarHBondContact O-N 3.39Å; R529-P533 VanDerWaalsContact O-CD 3.32Å; R529-P533 WeakPolarHBondContact O-CD 3.27Å; R529-P533 VanDerWaalsContact O-CG 3.23Å; R529-P533 WeakPolarHBondContact O-CG 3.17Å
530	Y	89.3	Confident	88.8	Confident	86 Å²	86	68.9 Å²	68.9	34%	0.337	35%	0.35	S	S	.	.	H	α-helix	trans	-103.4	-40.7	175.7	-68.7	-67	0	0	0	112.1	W49 L189 R526 F527 I528 P533 V534	W49-Y530 HydrophobicContact CH2-CE1 4.42Å; W49-Y530 HydrophobicContact CZ2-CE1 4.38Å; L189-Y530 HydrophobicContact CD2-CD1 3.86Å; R526-Y530 HydrophobicContact CG-CD2 3.99Å; R526-Y530 HydrophobicContact CG-CE2 3.72Å; R526-Y530 WeakPolarHBondContact O-CD2 3.27Å; R526-Y530 PolarHBondContact O-N 3.47Å; F527-Y530 PolarHBondContact O-N 2.89Å; I528-Y530 PolarHBondContact O-N 2.68Å; Y530-P533 WeakPolarHBondContact O-CD 3.5Å; Y530-V534 WeakPolarHBondContact O-CB 3.33Å; Y530-V534 WeakPolarHBondContact O-CG2 3.18Å; Y530-V534 PolarHBondContact O-N 3.22Å
531	A	92.1	Very high	89.8	Confident	26 Å²	26	72.1 Å²	72.1	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-66.5	-45.4	-178.6	0	0	0	0	0	112.2	F527 I528 V534 L535	F527-A531 HydrophobicContact CD1-CB 4.1Å; F527-A531 HydrophobicContact CE1-CB 3.85Å; F527-A531 HydrophobicContact CZ-CB 4.18Å; F527-A531 WeakPolarHBondContact O-CB 3.21Å; F527-A531 PolarHBondContact O-N 2.88Å; I528-A531 PolarHBondContact O-N 3.17Å; A531-V534 PolarHBondContact O-N 2.99Å; A531-L535 WeakPolarHBondContact O-CB 3.35Å; A531-L535 VanDerWaalsContact O-CG 3.25Å; A531-L535 WeakPolarHBondContact O-CG 3.39Å; A531-L535 PolarHBondContact O-N 3.45Å
532	V	92.6	Very high	90.4	Very high	44 Å²	44	77.3 Å²	77.3	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-51.9	-177.4	176.8	0	0	0	0	111.7	V504 W510 I528 V534 L535 M536	V504-V532 HydrophobicContact CG1-CB 4.3Å; V504-V532 HydrophobicContact CG1-CG1 3.66Å; W510-V532 HydrophobicContact CZ2-CG2 4.41Å; I528-V532 HydrophobicContact CG2-CG2 3.82Å; I528-V532 WeakPolarHBondContact O-CB 3.16Å; I528-V532 WeakPolarHBondContact O-CG2 3.2Å; I528-V532 PolarHBondContact O-N 2.83Å; V532-V534 VanDerWaalsContact C-N 3.33Å; V532-V534 PolarHBondContact O-N 3.36Å; V532-L535 PolarHBondContact O-N 3.44Å; V532-M536 HydrophobicContact CG1-CG 4.36Å; V532-M536 HydrophobicContact CG1-SD 3.97Å; V532-M536 WeakPolarHBondContact O-CB 3.43Å; V532-M536 VanDerWaalsContact O-CG 3.27Å; V532-M536 WeakPolarHBondContact O-CG 3.36Å; V532-M536 PolarHBondContact O-N 3.08Å
533	P	93.2	Very high	91.1	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-37.8	177.5	-18.5	27.8	0	0	0	113.3	L189 L193 V504 C505 R529 Y530 M536 I537	L189-P533 HydrophobicContact CD1-CB 4.39Å; L189-P533 HydrophobicContact CD2-CB 3.7Å; L189-P533 HydrophobicContact CD2-CG 3.9Å; L189-P533 HydrophobicContact CG-CB 3.76Å; L189-P533 HydrophobicContact CG-CG 4.29Å; L193-P533 HydrophobicContact CD2-CB 4.34Å; V504-P533 HydrophobicContact CG1-CB 4.5Å; V504-P533 HydrophobicContact CG1-CG 3.86Å; C505-P533 WeakPolarHBondContact SG-CG 3.31Å; R529-P533 VanDerWaalsContact O-CD 3.32Å; R529-P533 WeakPolarHBondContact O-CD 3.27Å; R529-P533 VanDerWaalsContact O-CG 3.23Å; R529-P533 WeakPolarHBondContact O-CG 3.17Å; Y530-P533 WeakPolarHBondContact O-CD 3.5Å; P533-M536 PolarHBondContact O-N 2.98Å; P533-I537 WeakPolarHBondContact O-CB 3.31Å; P533-I537 VanDerWaalsContact O-CG1 3.23Å; P533-I537 WeakPolarHBondContact O-CG1 3.39Å; P533-I537 PolarHBondContact O-N 2.87Å
534	V	94.3	Very high	91.6	Very high	86 Å²	86	69.2 Å²	69.2	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-65.2	-44	178.5	169.7	0	0	0	0	111.2	L189 Y530 A531 V532 M536 I537 G538	L189-V534 HydrophobicContact CD1-CG2 4.42Å; L189-V534 HydrophobicContact CD2-CG2 4.18Å; Y530-V534 WeakPolarHBondContact O-CB 3.33Å; Y530-V534 WeakPolarHBondContact O-CG2 3.18Å; Y530-V534 PolarHBondContact O-N 3.22Å; A531-V534 PolarHBondContact O-N 2.99Å; V532-V534 VanDerWaalsContact C-N 3.33Å; V532-V534 PolarHBondContact O-N 3.36Å; V534-M536 VanDerWaalsContact C-N 3.34Å; V534-M536 PolarHBondContact O-N 3.46Å; V534-I537 PolarHBondContact O-N 3.36Å; V534-G538 PolarHBondContact O-N 3.04Å
535	L	94.8	Very high	91.9	Very high	128 Å²	128	72 Å²	72	67%	0.67	33%	0.331	S	S	*	.	H	α-helix	trans	-63.1	-40.9	175.4	-71.9	171.4	0	0	0	111.6	A531 V532 G538 W539	A531-L535 WeakPolarHBondContact O-CB 3.35Å; A531-L535 VanDerWaalsContact O-CG 3.25Å; A531-L535 WeakPolarHBondContact O-CG 3.39Å; A531-L535 PolarHBondContact O-N 3.45Å; V532-L535 PolarHBondContact O-N 3.44Å; L535-G538 PolarHBondContact O-N 3.47Å; L535-W539 PolarHBondContact O-N 3.06Å
536	M	94.8	Very high	92.4	Very high	28 Å²	28	74.6 Å²	74.6	14%	0.138	35%	0.349	C	S	.	.	H	α-helix	trans	-63.1	-46.9	175.4	-71.4	-178.4	75.1	0	0	111.7	W197 L419 P423 V504 V532 P533 V534 G538 W539 L540	W197-M536 HydrophobicContact CH2-CE 4.18Å; W197-M536 HydrophobicContact CZ2-CE 3.53Å; L419-M536 HydrophobicContact CB-CE 3.95Å; P423-M536 HydrophobicContact CG-CE 4.31Å; V504-M536 HydrophobicContact CG1-SD 3.96Å; V504-M536 HydrophobicContact CG2-SD 4.23Å; V532-M536 HydrophobicContact CG1-CG 4.36Å; V532-M536 HydrophobicContact CG1-SD 3.97Å; V532-M536 WeakPolarHBondContact O-CB 3.43Å; V532-M536 VanDerWaalsContact O-CG 3.27Å; V532-M536 WeakPolarHBondContact O-CG 3.36Å; V532-M536 PolarHBondContact O-N 3.08Å; P533-M536 PolarHBondContact O-N 2.98Å; V534-M536 VanDerWaalsContact C-N 3.34Å; V534-M536 PolarHBondContact O-N 3.46Å; M536-G538 VanDerWaalsContact C-N 3.32Å; M536-G538 PolarHBondContact O-N 3.16Å; M536-W539 PolarHBondContact O-N 3.05Å; M536-L540 WeakPolarHBondContact O-CB 3.41Å; M536-L540 WeakPolarHBondContact O-CG 3.41Å; M536-L540 PolarHBondContact O-N 3.43Å
537	I	94.9	Very high	92.8	Very high	35 Å²	35	74.5 Å²	74.5	18%	0.179	35%	0.352	C	S	.	.	H	α-helix	trans	-60.7	-43.4	176.5	-68.9	164.2	0	0	0	110.5	L189 L192 L193 P533 V534 W539 L540 Y541	L189-I537 HydrophobicContact CD1-CD1 3.85Å; L192-I537 HydrophobicContact CD2-CD1 3.9Å; L192-I537 HydrophobicContact CG-CD1 3.95Å; L193-I537 HydrophobicContact CD1-CD1 4.44Å; L193-I537 HydrophobicContact CD1-CG1 3.82Å; P533-I537 WeakPolarHBondContact O-CB 3.31Å; P533-I537 VanDerWaalsContact O-CG1 3.23Å; P533-I537 WeakPolarHBondContact O-CG1 3.39Å; P533-I537 PolarHBondContact O-N 2.87Å; V534-I537 PolarHBondContact O-N 3.36Å; I537-W539 PolarHBondContact O-N 3.14Å; I537-L540 PolarHBondContact O-N 2.63Å; I537-Y541 WeakPolarHBondContact O-CB 3.27Å; I537-Y541 PolarHBondContact O-N 3.23Å
538	G	95.1	Very high	93	Very high	39 Å²	39	68.8 Å²	68.8	40%	0.402	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-43.4	177	0	0	0	0	0	112.9	V534 L535 M536 Y542	V534-G538 PolarHBondContact O-N 3.04Å; L535-G538 PolarHBondContact O-N 3.47Å; M536-G538 VanDerWaalsContact C-N 3.32Å; M536-G538 PolarHBondContact O-N 3.16Å; G538-Y542 WeakPolarHBondContact O-CB 3.34Å; G538-Y542 PolarHBondContact O-N 3.02Å
539	W	95.2	Very high	93.2	Very high	93 Å²	93	72 Å²	72	35%	0.352	34%	0.344	S	S	.	.	H	α-helix	trans	-66.2	-43	175.3	-179.4	91.2	0	0	0	112.4	G417 L419 L535 M536 I537 Y541 Y542 K543 F544	G417-W539 WeakPolarHBondContact O-CH2 3.22Å; L419-W539 HydrophobicContact CB-CZ3 4.41Å; L419-W539 HydrophobicContact CD1-CD2 3.72Å; L419-W539 HydrophobicContact CD1-CE3 3.25Å; L419-W539 HydrophobicContact CD1-CG 4.42Å; L419-W539 HydrophobicContact CD1-CH2 3.97Å; L419-W539 HydrophobicContact CD1-CZ2 4.39Å; L419-W539 HydrophobicContact CD1-CZ3 3.43Å; L419-W539 VanDerWaalsContact CD1-CZ3 3.43Å; L419-W539 HydrophobicContact CD2-CH2 4.1Å; L419-W539 HydrophobicContact CD2-CZ3 4.28Å; L419-W539 HydrophobicContact CG-CE3 3.8Å; L419-W539 HydrophobicContact CG-CH2 3.68Å; L419-W539 HydrophobicContact CG-CZ2 4.43Å; L419-W539 HydrophobicContact CG-CZ3 3.37Å; L535-W539 PolarHBondContact O-N 3.06Å; M536-W539 PolarHBondContact O-N 3.05Å; I537-W539 PolarHBondContact O-N 3.14Å; W539-Y541 VanDerWaalsContact C-N 3.33Å; W539-Y541 PolarHBondContact O-N 3.29Å; W539-Y542 PolarHBondContact O-N 3.19Å; W539-K543 HydrophobicContact CH2-CD 3.34Å; W539-K543 HydrophobicContact CZ2-CD 3.34Å; W539-K543 HydrophobicContact CZ3-CD 3.94Å; W539-K543 WeakPolarHBondContact O-CB 3.34Å; W539-K543 PolarHBondContact O-N 2.82Å; W539-F544 HydrophobicContact CH2-CE2 4.46Å; W539-F544 HydrophobicContact CZ3-CE2 4.02Å
540	L	95.4	Very high	93.5	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-61.7	-44.2	178.1	-72.7	169.7	0	0	0	111	L193 V196 L200 T418 M536 I537 F544	L193-L540 HydrophobicContact CD1-CD1 4.35Å; V196-L540 HydrophobicContact CG1-CD1 4.18Å; L200-L540 HydrophobicContact CD1-CB 3.87Å; L200-L540 HydrophobicContact CD1-CD1 4.33Å; L200-L540 HydrophobicContact CD1-CD2 3.91Å; L200-L540 HydrophobicContact CD1-CG 4.25Å; T418-L540 VanDerWaalsContact O-CD2 3.23Å; T418-L540 WeakPolarHBondContact O-CD2 3.37Å; M536-L540 WeakPolarHBondContact O-CB 3.41Å; M536-L540 WeakPolarHBondContact O-CG 3.41Å; M536-L540 PolarHBondContact O-N 3.43Å; I537-L540 PolarHBondContact O-N 2.63Å; L540-F544 HydrophobicContact CD2-CD2 4.12Å; L540-F544 HydrophobicContact CD2-CE2 4.08Å; L540-F544 WeakPolarHBondContact O-CB 3.14Å; L540-F544 PolarHBondContact O-N 3.35Å
541	Y	93.9	Very high	93.5	Very high	138 Å²	138	76.2 Å²	76.2	54%	0.541	37%	0.368	S	S	.	.	H	α-helix	trans	-58.5	-54.2	173.7	179.1	-97.5	0	0	0	110.8	I537 W539 K543 W545	I537-Y541 WeakPolarHBondContact O-CB 3.27Å; I537-Y541 PolarHBondContact O-N 3.23Å; W539-Y541 VanDerWaalsContact C-N 3.33Å; W539-Y541 PolarHBondContact O-N 3.29Å; Y541-K543 VanDerWaalsContact C-N 3.33Å; Y541-K543 PolarHBondContact O-N 3.11Å; Y541-W545 HydrophobicContact CD2-CB 4.46Å; Y541-W545 HydrophobicContact CD2-CD2 4.34Å; Y541-W545 AromaticContact CD2-CE3 3.92Å; Y541-W545 HydrophobicContact CD2-CE3 3.92Å; Y541-W545 HydrophobicContact CE2-CB 4.4Å; Y541-W545 AromaticContact CE2-CD2 3.65Å; Y541-W545 HydrophobicContact CE2-CD2 3.65Å; Y541-W545 AromaticContact CE2-CE3 3.43Å; Y541-W545 HydrophobicContact CE2-CE3 3.43Å; Y541-W545 VanDerWaalsContact CE2-CE3 3.43Å; Y541-W545 HydrophobicContact CE2-CG 4.09Å; Y541-W545 AromaticContact CE2-CZ3 3.93Å; Y541-W545 HydrophobicContact CE2-CZ3 3.93Å; Y541-W545 WeakPolarHBondContact O-CB 3.21Å; Y541-W545 PolarHBondContact O-N 3.31Å
542	Y	94.9	Very high	93.5	Very high	190 Å²	190	77 Å²	77	75%	0.745	37%	0.368	S	S	*	.	H	α-helix	trans	-56.6	-44.1	-179.4	175.1	-100.7	0	0	0	113.2	G538 W539	G538-Y542 WeakPolarHBondContact O-CB 3.34Å; G538-Y542 PolarHBondContact O-N 3.02Å; W539-Y542 PolarHBondContact O-N 3.19Å
543	K	94.6	Very high	93.4	Very high	100 Å²	100	78.7 Å²	78.7	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-79.4	-41	-174.9	-173.8	176.2	179.7	-173.9	0	113.6	W539 Y541	W539-K543 HydrophobicContact CH2-CD 3.34Å; W539-K543 HydrophobicContact CZ2-CD 3.34Å; W539-K543 HydrophobicContact CZ3-CD 3.94Å; W539-K543 WeakPolarHBondContact O-CB 3.34Å; W539-K543 PolarHBondContact O-N 2.82Å; Y541-K543 VanDerWaalsContact C-N 3.33Å; Y541-K543 PolarHBondContact O-N 3.11Å
544	F	93.8	Very high	93.3	Very high	30 Å²	30	82.9 Å²	82.9	13%	0.132	40%	0.402	C	S	.	.	H	α-helix	trans	-100.7	-17.6	-170.3	-72.5	-89.3	0	0	0	114.3	L200 G417 T418 W539 L540 K547 L548	L200-F544 HydrophobicContact CD1-CB 4.34Å; L200-F544 HydrophobicContact CD1-CD2 4.33Å; L200-F544 HydrophobicContact CD1-CG 4.37Å; L200-F544 HydrophobicContact CD2-CB 3.67Å; L200-F544 HydrophobicContact CD2-CG 4.2Å; G417-F544 WeakPolarHBondContact O-CZ 2.92Å; T418-F544 HydrophobicContact CG2-CE1 3.91Å; T418-F544 HydrophobicContact CG2-CE2 4.08Å; T418-F544 HydrophobicContact CG2-CZ 3.55Å; W539-F544 HydrophobicContact CH2-CE2 4.46Å; W539-F544 HydrophobicContact CZ3-CE2 4.02Å; L540-F544 HydrophobicContact CD2-CD2 4.12Å; L540-F544 HydrophobicContact CD2-CE2 4.08Å; L540-F544 WeakPolarHBondContact O-CB 3.14Å; L540-F544 PolarHBondContact O-N 3.35Å; F544-K547 PolarHBondContact O-N 3.02Å; F544-L548 WeakPolarHBondContact O-CB 3.47Å; F544-L548 PolarHBondContact O-N 3.4Å
545	W	92.3	Very high	93.2	Very high	120 Å²	120	85.3 Å²	85.3	46%	0.455	41%	0.411	S	S	.	.	H	α-helix	trans	-53.3	-48.4	174	-172.9	-99.6	0	0	0	114.2	Y541 K547 L548 M549	Y541-W545 HydrophobicContact CD2-CB 4.46Å; Y541-W545 HydrophobicContact CD2-CD2 4.34Å; Y541-W545 AromaticContact CD2-CE3 3.92Å; Y541-W545 HydrophobicContact CD2-CE3 3.92Å; Y541-W545 HydrophobicContact CE2-CB 4.4Å; Y541-W545 AromaticContact CE2-CD2 3.65Å; Y541-W545 HydrophobicContact CE2-CD2 3.65Å; Y541-W545 AromaticContact CE2-CE3 3.43Å; Y541-W545 HydrophobicContact CE2-CE3 3.43Å; Y541-W545 VanDerWaalsContact CE2-CE3 3.43Å; Y541-W545 HydrophobicContact CE2-CG 4.09Å; Y541-W545 AromaticContact CE2-CZ3 3.93Å; Y541-W545 HydrophobicContact CE2-CZ3 3.93Å; Y541-W545 WeakPolarHBondContact O-CB 3.21Å; Y541-W545 PolarHBondContact O-N 3.31Å; W545-K547 VanDerWaalsContact C-N 3.33Å; W545-K547 PolarHBondContact O-N 2.81Å; W545-L548 PolarHBondContact O-N 3.37Å; W545-M549 HydrophobicContact CD2-CG 4.42Å; W545-M549 HydrophobicContact CZ2-CG 4.32Å; W545-M549 HydrophobicContact CZ2-SD 4.07Å; W545-M549 WeakPolarHBondContact O-CG 3.21Å; W545-M549 PolarHBondContact O-N 2.9Å
546	P	94.2	Very high	92.9	Very high	77 Å²	77	85 Å²	85	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-41.1	178.8	23.4	-33.5	0	0	0	112.1	L548 M549 E550	P546-L548 PolarHBondContact O-N 3.31Å; P546-M549 PolarHBondContact O-N 3.38Å; P546-E550 WeakPolarHBondContact O-CB 3.16Å; P546-E550 PolarHBondContact O-N 3.01Å
547	K	91.8	Very high	92.6	Very high	133 Å²	133	88.7 Å²	88.7	58%	0.578	42%	0.418	S	S	*	.	H	α-helix	trans	-63.8	-41.8	177.8	-172	179.9	178.7	-178.6	0	112	F544 W545 M549 E550 E551	F544-K547 PolarHBondContact O-N 3.02Å; W545-K547 VanDerWaalsContact C-N 3.33Å; W545-K547 PolarHBondContact O-N 2.81Å; K547-M549 VanDerWaalsContact C-N 3.33Å; K547-E550 PolarHBondContact O-N 3.24Å; K547-E551 WeakPolarHBondContact O-CB 3.47Å; K547-E551 PolarHBondContact O-N 2.93Å
548	L	91.1	Very high	92.3	Very high	27 Å²	27	88 Å²	88	14%	0.141	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-41.9	177.5	-164.7	79.8	0	0	0	111.4	Y67 F544 W545 P546 L552	Y67-L548 HydrophobicContact CD2-CD1 4.34Å; Y67-L548 HydrophobicContact CE2-CD1 3.33Å; Y67-L548 HydrophobicContact CE2-CD2 4.12Å; Y67-L548 HydrophobicContact CE2-CG 3.65Å; Y67-L548 VanDerWaalsContact CZ-CD1 3.43Å; Y67-L548 WeakPolarHBondContact OH-CD1 3.31Å; F544-L548 WeakPolarHBondContact O-CB 3.47Å; F544-L548 PolarHBondContact O-N 3.4Å; W545-L548 PolarHBondContact O-N 3.37Å; P546-L548 PolarHBondContact O-N 3.31Å; L548-L552 HydrophobicContact CG-CD1 4.38Å; L548-L552 WeakPolarHBondContact O-CB 3.49Å; L548-L552 VanDerWaalsContact O-CG 3.28Å; L548-L552 WeakPolarHBondContact O-CG 3.31Å; L548-L552 PolarHBondContact O-N 3.41Å
549	M	92.4	Very high	92	Very high	92 Å²	92	94.2 Å²	94.2	45%	0.453	43%	0.426	S	S	.	.	H	α-helix	trans	-71.6	-32.5	178.8	-71	-60.1	-63.4	0	0	112.7	W545 P546 K547 L552 S553	W545-M549 HydrophobicContact CD2-CG 4.42Å; W545-M549 HydrophobicContact CZ2-CG 4.32Å; W545-M549 HydrophobicContact CZ2-SD 4.07Å; W545-M549 WeakPolarHBondContact O-CG 3.21Å; W545-M549 PolarHBondContact O-N 2.9Å; P546-M549 PolarHBondContact O-N 3.38Å; K547-M549 VanDerWaalsContact C-N 3.33Å; M549-L552 HydrophobicContact SD-CD1 4.42Å; M549-S553 WeakPolarHBondContact O-CB 3.43Å; M549-S553 PolarHBondContact O-N 2.89Å; M549-S553 PolarHBondContact O-OG 2.95Å
550	E	93.1	Very high	91.8	Very high	138 Å²	138	91.5 Å²	91.5	65%	0.645	42%	0.419	S	S	*	.	H	α-helix	trans	-66.3	-45.2	172.3	-175.3	177.7	-167.5	0	0	111.4	P546 K547 L552 S553 E554	P546-E550 WeakPolarHBondContact O-CB 3.16Å; P546-E550 PolarHBondContact O-N 3.01Å; K547-E550 PolarHBondContact O-N 3.24Å; E550-L552 VanDerWaalsContact C-N 3.34Å; E550-L552 PolarHBondContact O-N 3.31Å; E550-S553 PolarHBondContact O-N 2.86Å; E550-S553 VanDerWaalsContact O-N 3.14Å; E550-S553 PolarHBondContact O-OG 3.41Å; E550-E554 PolarHBondContact O-N 3.36Å
551	E	89.5	Confident	91.8	Very high	76 Å²	76	94.1 Å²	94.1	36%	0.355	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.1	-170.9	180	-156.3	0	0	111.7	Y67 L71 K547 S553 E554	Y67-E551 PolarHBondContact OH-OE2 2.84Å; L71-E551 HydrophobicContact CD2-CG 3.85Å; K547-E551 WeakPolarHBondContact O-CB 3.47Å; K547-E551 PolarHBondContact O-N 2.93Å; E551-S553 VanDerWaalsContact C-N 3.28Å; E551-S553 PolarHBondContact O-N 3.17Å; E551-E554 PolarHBondContact O-N 2.87Å
552	L	91.3	Very high	91.9	Very high	41 Å²	41	89 Å²	89	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-72.9	-15.3	175.1	-73.7	172	0	0	0	114.1	Y67 T70 L71 N74 L548 M549 E550	Y67-L552 HydrophobicContact CD2-CD1 3.92Å; Y67-L552 HydrophobicContact CD2-CD2 3.86Å; Y67-L552 HydrophobicContact CD2-CG 4.19Å; Y67-L552 HydrophobicContact CE2-CD1 3.76Å; Y67-L552 HydrophobicContact CE2-CD2 3.7Å; Y67-L552 HydrophobicContact CE2-CG 3.72Å; T70-L552 HydrophobicContact CG2-CD2 3.81Å; L71-L552 HydrophobicContact CD2-CD2 3.96Å; L71-L552 HydrophobicContact CG-CD2 4.3Å; N74-L552 PolarHBondContact ND2-O 2.63Å; L548-L552 HydrophobicContact CG-CD1 4.38Å; L548-L552 WeakPolarHBondContact O-CB 3.49Å; L548-L552 VanDerWaalsContact O-CG 3.28Å; L548-L552 WeakPolarHBondContact O-CG 3.31Å; L548-L552 PolarHBondContact O-N 3.41Å; M549-L552 HydrophobicContact SD-CD1 4.42Å; E550-L552 VanDerWaalsContact C-N 3.34Å; E550-L552 PolarHBondContact O-N 3.31Å
553	S	91.8	Very high	91.9	Very high	81 Å²	81	80.5 Å²	80.5	57%	0.566	39%	0.385	S	S	*	.	H	α-helix	trans	-96.8	-13.6	175.6	70.6	0	0	0	0	112.7	M549 E550 E551 L555	M549-S553 WeakPolarHBondContact O-CB 3.43Å; M549-S553 PolarHBondContact O-N 2.89Å; M549-S553 PolarHBondContact O-OG 2.95Å; E550-S553 PolarHBondContact O-N 2.86Å; E550-S553 VanDerWaalsContact O-N 3.14Å; E550-S553 PolarHBondContact O-OG 3.41Å; E551-S553 VanDerWaalsContact C-N 3.28Å; E551-S553 PolarHBondContact O-N 3.17Å; S553-L555 PolarHBondContact O-N 3.27Å
554	E	90.9	Very high	91.9	Very high	88 Å²	88	77.2 Å²	77.2	41%	0.411	37%	0.374	S	S	.	.			trans	-69.8	109.8	173.8	-165.3	177.8	-179.4	0	0	109.8	E550 E551 R556	E550-E554 PolarHBondContact O-N 3.36Å; E551-E554 PolarHBondContact O-N 2.87Å; E554-R556 HydrophobicContact CG-CG 4.34Å; E554-R556 IonicContact OE1-CZ 2.85Å; E554-R556 IonicContact OE1-NE 2.95Å; E554-R556 PolarHBondContact OE1-NE 2.75Å; E554-R556 IonicContact OE1-NH2 2.61Å; E554-R556 PolarHBondContact OE1-NH2 2.88Å; E554-R556 IonicContact OE2-CZ 3.79Å; E554-R556 IonicContact OE2-NE 3.34Å; E554-R556 IonicContact OE2-NH2 3.54Å; E554-R556 PolarHBondContact OE2-NH2 3.27Å
555	L	90.8	Very high	92	Very high	136 Å²	136	80.2 Å²	80.2	71%	0.712	39%	0.388	S	S	*	.			trans	-100.3	124.7	175.4	-62.8	173.4	0	0	0	109	N74 S553	N74-L555 HydrophobicContact CB-CD2 4.11Å; S553-L555 PolarHBondContact O-N 3.27Å
556	R	88.9	Confident	92.3	Very high	123 Å²	123	74.5 Å²	74.5	46%	0.464	37%	0.366	S	S	.	.			trans	-125.3	153.5	176.2	-64.5	178.4	-179.5	153.9	-1.1	109.6	N74 D75 W77 E554	N74-R556 PolarHBondContact O-N 2.8Å; N74-R556 VanDerWaalsContact O-O 3.06Å; D75-R556 VanDerWaalsContact O-CB 3.31Å; D75-R556 WeakPolarHBondContact O-CB 3.31Å; D75-R556 IonicContact OD1-CZ 3.84Å; D75-R556 IonicContact OD1-NH1 3.51Å; D75-R556 PolarHBondContact OD1-NH1 3.12Å; D75-R556 VanDerWaalsContact OD1-NH1 3.17Å; W77-R556 PolarHBondContact N-O 3.43Å; E554-R556 HydrophobicContact CG-CG 4.34Å; E554-R556 IonicContact OE1-CZ 2.85Å; E554-R556 IonicContact OE1-NE 2.95Å; E554-R556 PolarHBondContact OE1-NE 2.75Å; E554-R556 IonicContact OE1-NH2 2.61Å; E554-R556 PolarHBondContact OE1-NH2 2.88Å; E554-R556 IonicContact OE2-CZ 3.79Å; E554-R556 IonicContact OE2-NE 3.34Å; E554-R556 IonicContact OE2-NH2 3.54Å; E554-R556 PolarHBondContact OE2-NH2 3.27Å
557	E	87.9	Confident	92.4	Very high	105 Å²	105	71 Å²	71	49%	0.491	34%	0.343	S	S	.	.			trans	-111.9	131.1	175.7	-174.5	174.9	174	0	0	109.5	W77 I81 Y559	W77-E557 HydrophobicContact CB-CG 4.49Å; W77-E557 HydrophobicContact CE3-CB 3.88Å; W77-E557 HydrophobicContact CE3-CG 3.75Å; W77-E557 HydrophobicContact CZ3-CG 4.45Å; I81-E557 HydrophobicContact CG2-CG 4.48Å; E557-Y559 PolarHBondContact O-N 2.75Å; E557-Y559 VanDerWaalsContact O-N 3.17Å
558	F	89.3	Confident	92.6	Very high	21 Å²	21	68 Å²	68	9%	0.092	34%	0.336	C	S	.	.			trans	-69.3	111.4	169.3	179.9	-100.1	0	0	0	110	L76 I81 E85 I88 D560	L76-F558 HydrophobicContact CB-CB 4.21Å; L76-F558 HydrophobicContact CD2-CB 4.01Å; L76-F558 HydrophobicContact CD2-CD2 4.01Å; L76-F558 HydrophobicContact CD2-CG 4.35Å; L76-F558 WeakPolarHBondContact O-CB 3.18Å; L76-F558 PolarHBondContact O-N 2.88Å; L76-F558 VanDerWaalsContact O-N 3.15Å; I81-F558 HydrophobicContact CD1-CB 4.31Å; I81-F558 HydrophobicContact CD1-CD1 4.48Å; E85-F558 HydrophobicContact CB-CD1 4.5Å; I88-F558 HydrophobicContact CB-CE1 4.18Å; I88-F558 HydrophobicContact CB-CZ 4.45Å; I88-F558 HydrophobicContact CG2-CE1 3.93Å; I88-F558 HydrophobicContact CG2-CZ 3.79Å; F558-D560 HydrophobicContact CE1-CB 4.05Å; F558-D560 HydrophobicContact CZ-CB 3.82Å
559	Y	88.7	Confident	92.9	Very high	169 Å²	169	68.6 Å²	68.6	66%	0.663	34%	0.337	S	S	*	.			trans	-128.2	108.4	-176.4	-171.5	-105.8	0	0	0	112.1	E557 P561	E557-Y559 PolarHBondContact O-N 2.75Å; E557-Y559 VanDerWaalsContact O-N 3.17Å; Y559-P561 HydrophobicContact CD1-CG 4.22Å; Y559-P561 HydrophobicContact CE1-CB 4.45Å; Y559-P561 VanDerWaalsContact CE1-CD 3.47Å; Y559-P561 HydrophobicContact CE1-CG 3.54Å; Y559-P561 HydrophobicContact CE2-CB 4.49Å; Y559-P561 HydrophobicContact CE2-CG 4.39Å
560	D	92.4	Very high	93.2	Very high	36 Å²	36	64.2 Å²	64.2	19%	0.193	32%	0.315	C	S	.	.			trans	-140.9	70.2	178.1	-166.1	-22.9	0	0	0	111.3	R91 F558 D562 T563 V564	R91-D560 IonicContact NH2-OD2 2.95Å; F558-D560 HydrophobicContact CE1-CB 4.05Å; F558-D560 HydrophobicContact CZ-CB 3.82Å; D560-D562 VanDerWaalsContact C-N 3.3Å; D560-D562 PolarHBondContact O-N 3.38Å; D560-T563 PolarHBondContact O-N 3.44Å; D560-T563 VanDerWaalsContact OD1-CB 3.23Å; D560-T563 WeakPolarHBondContact OD1-CB 3.27Å; D560-T563 PolarHBondContact OD1-N 2.91Å; D560-T563 VanDerWaalsContact OD1-N 3.13Å; D560-T563 PolarHBondContact OD1-OG1 3.06Å; D560-T563 PolarHBondContact OD2-OG1 2.87Å; D560-T563 VanDerWaalsContact OD2-OG1 3.06Å; D560-V564 WeakPolarHBondContact O-CG2 3.43Å; D560-V564 PolarHBondContact O-N 3.38Å; D560-V564 VanDerWaalsContact O-N 3.07Å
561	P	94.2	Very high	93.3	Very high	55 Å²	55	60 Å²	60	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-32.9	-173	27.3	-37.3	0	0	0	112.8	Y559 T563 V564 E565	Y559-P561 HydrophobicContact CD1-CG 4.22Å; Y559-P561 HydrophobicContact CE1-CB 4.45Å; Y559-P561 VanDerWaalsContact CE1-CD 3.47Å; Y559-P561 HydrophobicContact CE1-CG 3.54Å; Y559-P561 HydrophobicContact CE2-CB 4.49Å; Y559-P561 HydrophobicContact CE2-CG 4.39Å; P561-T563 VanDerWaalsContact C-N 3.34Å; P561-T563 PolarHBondContact O-N 3.42Å; P561-V564 PolarHBondContact O-N 3.07Å; P561-E565 WeakPolarHBondContact O-CB 3.31Å; P561-E565 PolarHBondContact O-N 3.5Å
562	D	95.2	Very high	93.6	Very high	31 Å²	31	60.9 Å²	60.9	17%	0.166	31%	0.311	C	S	.	.	H	α-helix	trans	-65.8	-39.3	179.9	-77.1	0.6	0	0	0	111.2	D560 L566 N709 K710 T711 F712	D560-D562 VanDerWaalsContact C-N 3.3Å; D560-D562 PolarHBondContact O-N 3.38Å; D562-L566 PolarHBondContact O-N 3.13Å; D562-L566 VanDerWaalsContact O-N 3.12Å; D562-N709 WeakPolarHBondContact CA-ND2 3.34Å; D562-N709 PolarHBondContact O-ND2 3.23Å; D562-K710 WeakPolarHBondContact OD2-CB 3.22Å; D562-T711 WeakPolarHBondContact OD2-CB 3.18Å; D562-T711 PolarHBondContact OD2-N 2.89Å; D562-T711 PolarHBondContact OD2-OG1 3.23Å; D562-F712 HydrophobicContact CB-CD2 4.42Å; D562-F712 HydrophobicContact CB-CE2 4.19Å
563	T	95.2	Very high	93.9	Very high	11 Å²	11	65.9 Å²	65.9	7%	0.067	33%	0.332	C	S	.	.	H	α-helix	trans	-74.2	-39.7	176.5	-54.7	0	0	0	0	110.9	I88 D560 P561 E565 L566 M567 F712	I88-T563 HydrophobicContact CD1-CG2 4.02Å; I88-T563 HydrophobicContact CG1-CG2 4.07Å; I88-T563 HydrophobicContact CG2-CG2 3.71Å; D560-T563 PolarHBondContact O-N 3.44Å; D560-T563 VanDerWaalsContact OD1-CB 3.23Å; D560-T563 WeakPolarHBondContact OD1-CB 3.27Å; D560-T563 PolarHBondContact OD1-N 2.91Å; D560-T563 VanDerWaalsContact OD1-N 3.13Å; D560-T563 PolarHBondContact OD1-OG1 3.06Å; D560-T563 PolarHBondContact OD2-OG1 2.87Å; D560-T563 VanDerWaalsContact OD2-OG1 3.06Å; P561-T563 VanDerWaalsContact C-N 3.34Å; P561-T563 PolarHBondContact O-N 3.42Å; T563-E565 VanDerWaalsContact C-N 3.31Å; T563-E565 PolarHBondContact O-N 3.42Å; T563-L566 PolarHBondContact O-N 2.77Å; T563-M567 HydrophobicContact CG2-CE 3.81Å; T563-M567 HydrophobicContact CG2-CG 4.3Å; T563-M567 VanDerWaalsContact O-CG 3.3Å; T563-M567 WeakPolarHBondContact O-CG 3.3Å; T563-M567 PolarHBondContact O-N 3.31Å; T563-F712 WeakPolarHBondContact OG1-CE2 3.35Å; T563-F712 WeakPolarHBondContact OG1-CZ 3.38Å
564	V	95.5	Very high	94.1	Very high	32 Å²	32	62.6 Å²	62.6	19%	0.194	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-44.8	174	172.5	0	0	0	0	111.1	E85 I88 D560 P561 M567 T568	E85-V564 HydrophobicContact CG-CG2 3.68Å; I88-V564 HydrophobicContact CD1-CB 4.23Å; I88-V564 HydrophobicContact CD1-CG2 3.51Å; D560-V564 WeakPolarHBondContact O-CG2 3.43Å; D560-V564 PolarHBondContact O-N 3.38Å; D560-V564 VanDerWaalsContact O-N 3.07Å; P561-V564 PolarHBondContact O-N 3.07Å; V564-M567 PolarHBondContact O-N 3.35Å; V564-T568 VanDerWaalsContact O-CB 3.3Å; V564-T568 WeakPolarHBondContact O-CB 3.5Å; V564-T568 PolarHBondContact O-N 2.89Å; V564-T568 PolarHBondContact O-OG1 3.24Å
565	E	96.8	Very high	94.3	Very high	92 Å²	92	62.3 Å²	62.3	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-46.1	176.9	-170.5	-168.2	-170	0	0	111.3	P561 T563 T568 W569 F707 N709	P561-E565 WeakPolarHBondContact O-CB 3.31Å; P561-E565 PolarHBondContact O-N 3.5Å; T563-E565 VanDerWaalsContact C-N 3.31Å; T563-E565 PolarHBondContact O-N 3.42Å; E565-T568 PolarHBondContact O-N 3Å; E565-W569 WeakPolarHBondContact O-CB 3.3Å; E565-W569 PolarHBondContact O-N 2.89Å; E565-F707 HydrophobicContact CB-CZ 4.36Å; E565-F707 HydrophobicContact CG-CE2 3.92Å; E565-F707 HydrophobicContact CG-CZ 3.86Å; E565-N709 WeakPolarHBondContact OE2-CB 3.39Å; E565-N709 PolarHBondContact OE2-ND2 2.78Å
566	L	97.1	Very high	94.4	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-50.4	176.4	175.6	65.9	0	0	0	111.3	D562 T563 T568 W569 I570 L586 V641 F707 F712 V714	D562-L566 PolarHBondContact O-N 3.13Å; D562-L566 VanDerWaalsContact O-N 3.12Å; T563-L566 PolarHBondContact O-N 2.77Å; L566-T568 VanDerWaalsContact C-N 3.33Å; L566-T568 PolarHBondContact O-N 3.15Å; L566-W569 PolarHBondContact O-N 3.44Å; L566-I570 HydrophobicContact CD1-CD1 4Å; L566-I570 HydrophobicContact CD1-CG1 4.24Å; L566-I570 HydrophobicContact CG-CD1 3.99Å; L566-I570 VanDerWaalsContact O-CG1 3.31Å; L566-I570 WeakPolarHBondContact O-CG1 3.45Å; L566-I570 PolarHBondContact O-N 3.25Å; L566-L586 HydrophobicContact CD2-CD1 4.18Å; L566-L586 HydrophobicContact CD2-CD2 4.12Å; L566-V641 HydrophobicContact CD2-CG1 4.27Å; L566-F707 HydrophobicContact CB-CE1 4.15Å; L566-F707 HydrophobicContact CB-CZ 4.32Å; L566-F707 HydrophobicContact CD1-CD1 3.85Å; L566-F707 HydrophobicContact CD1-CE1 3.83Å; L566-F712 HydrophobicContact CB-CD2 4.13Å; L566-F712 HydrophobicContact CD2-CB 4.19Å; L566-F712 HydrophobicContact CD2-CD1 3.94Å; L566-F712 HydrophobicContact CD2-CD2 3.84Å; L566-F712 HydrophobicContact CD2-CE1 4.26Å; L566-F712 HydrophobicContact CD2-CE2 4.17Å; L566-F712 HydrophobicContact CD2-CG 3.72Å; L566-F712 HydrophobicContact CD2-CZ 4.36Å; L566-V714 HydrophobicContact CD1-CG2 3.61Å
567	M	96.6	Very high	94.5	Very high	4 Å²	4	66.6 Å²	66.6	2%	0.02	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-40.4	-179.2	-63.9	-52.9	171.8	0	0	111.5	V84 I88 T563 V564 I570 S571 L586 I590 C593 T594	V84-M567 HydrophobicContact CG1-CB 4.29Å; I88-M567 HydrophobicContact CD1-CG 4.16Å; I88-M567 HydrophobicContact CG1-CG 4.24Å; T563-M567 HydrophobicContact CG2-CE 3.81Å; T563-M567 HydrophobicContact CG2-CG 4.3Å; T563-M567 VanDerWaalsContact O-CG 3.3Å; T563-M567 WeakPolarHBondContact O-CG 3.3Å; T563-M567 PolarHBondContact O-N 3.31Å; V564-M567 PolarHBondContact O-N 3.35Å; M567-I570 PolarHBondContact O-N 2.63Å; M567-S571 WeakPolarHBondContact O-CB 3.33Å; M567-S571 PolarHBondContact O-N 3.46Å; M567-S571 PolarHBondContact O-OG 2.72Å; M567-L586 HydrophobicContact CE-CD1 4.04Å; M567-I590 HydrophobicContact CE-CG1 3.75Å; M567-I590 HydrophobicContact SD-CB 4.39Å; M567-I590 HydrophobicContact SD-CG1 3.79Å; M567-C593 HydrophobicContact CB-CB 4.12Å; M567-C593 HydrophobicContact CG-CB 3.91Å; M567-C593 HydrophobicContact SD-CB 3.97Å; M567-T594 HydrophobicContact CB-CG2 4.39Å; M567-T594 HydrophobicContact SD-CG2 4.08Å
568	T	96.3	Very high	94.9	Very high	69 Å²	69	61.7 Å²	61.7	42%	0.423	31%	0.31	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.4	-58.3	0	0	0	0	111.3	V564 E565 L566 S571 T572	V564-T568 VanDerWaalsContact O-CB 3.3Å; V564-T568 WeakPolarHBondContact O-CB 3.5Å; V564-T568 PolarHBondContact O-N 2.89Å; V564-T568 PolarHBondContact O-OG1 3.24Å; E565-T568 PolarHBondContact O-N 3Å; L566-T568 VanDerWaalsContact C-N 3.33Å; L566-T568 PolarHBondContact O-N 3.15Å; T568-S571 PolarHBondContact O-N 3.29Å; T568-T572 WeakPolarHBondContact O-CB 3.23Å; T568-T572 WeakPolarHBondContact O-CG2 3.41Å; T568-T572 PolarHBondContact O-N 3.38Å; T568-T572 PolarHBondContact O-OG1 3.35Å
569	W	97.4	Very high	95.2	Very high	41 Å²	41	61.5 Å²	61.5	16%	0.155	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-45.9	175.9	176.4	90	0	0	0	111.8	E565 L566 S571 T572 K573 T574 F580 Y639 T706 F707 V714	E565-W569 WeakPolarHBondContact O-CB 3.3Å; E565-W569 PolarHBondContact O-N 2.89Å; L566-W569 PolarHBondContact O-N 3.44Å; W569-S571 VanDerWaalsContact C-N 3.3Å; W569-S571 PolarHBondContact O-N 2.93Å; W569-T572 PolarHBondContact O-N 3.45Å; W569-K573 HydrophobicContact CD2-CB 4.37Å; W569-K573 HydrophobicContact CG-CB 4.33Å; W569-K573 HydrophobicContact CG-CG 4.28Å; W569-K573 HydrophobicContact CZ2-CB 4.44Å; W569-K573 WeakPolarHBondContact O-CA 3.37Å; W569-K573 VanDerWaalsContact O-CB 3.31Å; W569-K573 WeakPolarHBondContact O-CB 3.44Å; W569-K573 PolarHBondContact O-N 2.88Å; W569-T574 HydrophobicContact CE3-CG2 4.39Å; W569-T574 HydrophobicContact CH2-CG2 3.65Å; W569-T574 HydrophobicContact CZ2-CG2 4.25Å; W569-T574 HydrophobicContact CZ3-CG2 3.74Å; W569-F580 HydrophobicContact CZ3-CE1 4.44Å; W569-Y639 HydrophobicContact CH2-CD1 4.26Å; W569-Y639 HydrophobicContact CH2-CE1 4.08Å; W569-T706 WeakPolarHBondContact CH2-OG1 3.23Å; W569-F707 HydrophobicContact CB-CD2 3.74Å; W569-F707 HydrophobicContact CB-CE2 3.8Å; W569-F707 AromaticContact CD1-CD2 3.62Å; W569-F707 HydrophobicContact CD2-CB 3.76Å; W569-F707 AromaticContact CD2-CD2 3.77Å; W569-F707 HydrophobicContact CD2-CD2 3.77Å; W569-F707 AromaticContact CD2-CG 3.97Å; W569-F707 HydrophobicContact CD2-CG 3.97Å; W569-F707 HydrophobicContact CE3-CB 3.96Å; W569-F707 HydrophobicContact CE3-CD2 4.37Å; W569-F707 HydrophobicContact CE3-CG 4.2Å; W569-F707 HydrophobicContact CG-CB 4.31Å; W569-F707 AromaticContact CG-CD2 3.41Å; W569-F707 HydrophobicContact CG-CD2 3.41Å; W569-F707 VanDerWaalsContact CG-CD2 3.41Å; W569-F707 HydrophobicContact CG-CE2 4.01Å; W569-F707 HydrophobicContact CG-CG 4.11Å; W569-F707 HydrophobicContact CH2-CB 4.19Å; W569-F707 HydrophobicContact CZ2-CB 3.97Å; W569-F707 HydrophobicContact CZ3-CB 4.18Å; W569-V714 HydrophobicContact CH2-CB 4.38Å; W569-V714 HydrophobicContact CH2-CG1 4.02Å; W569-V714 HydrophobicContact CZ3-CB 4.22Å; W569-V714 HydrophobicContact CZ3-CG1 3.92Å; W569-V714 HydrophobicContact CZ3-CG2 4.21Å
570	I	97.6	Very high	95.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.8	-48	176.5	-68.6	173.3	0	0	0	109.7	L566 M567 T572 T574 F580 I590 T594 R596	L566-I570 HydrophobicContact CD1-CD1 4Å; L566-I570 HydrophobicContact CD1-CG1 4.24Å; L566-I570 HydrophobicContact CG-CD1 3.99Å; L566-I570 VanDerWaalsContact O-CG1 3.31Å; L566-I570 WeakPolarHBondContact O-CG1 3.45Å; L566-I570 PolarHBondContact O-N 3.25Å; M567-I570 PolarHBondContact O-N 2.63Å; I570-T572 VanDerWaalsContact C-N 3.33Å; I570-T572 PolarHBondContact O-N 3.11Å; I570-T574 PolarHBondContact O-N 3.14Å; I570-T574 PolarHBondContact O-OG1 2.71Å; I570-F580 HydrophobicContact CB-CZ 4.26Å; I570-F580 HydrophobicContact CD1-CD1 4.27Å; I570-F580 HydrophobicContact CD1-CE1 3.8Å; I570-F580 HydrophobicContact CD1-CZ 4.14Å; I570-F580 HydrophobicContact CG1-CE1 3.79Å; I570-F580 HydrophobicContact CG1-CZ 3.8Å; I570-F580 HydrophobicContact CG2-CE1 4.38Å; I570-F580 HydrophobicContact CG2-CE2 3.86Å; I570-F580 HydrophobicContact CG2-CZ 3.65Å; I570-I590 HydrophobicContact CD1-CD1 3.63Å; I570-I590 HydrophobicContact CD1-CG1 3.8Å; I570-I590 HydrophobicContact CD1-CG2 4.15Å; I570-T594 HydrophobicContact CB-CG2 4.07Å; I570-T594 HydrophobicContact CG2-CG2 3.76Å; I570-R596 HydrophobicContact CG2-CG 4.01Å; I570-R596 PolarHBondContact O-NH2 2.82Å
571	S	95.9	Very high	95.9	Very high	49 Å²	49	51.8 Å²	51.8	34%	0.343	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-38.4	-178.3	-80.2	0	0	0	0	113.5	M567 T568 W569 T594 R596	M567-S571 WeakPolarHBondContact O-CB 3.33Å; M567-S571 PolarHBondContact O-N 3.46Å; M567-S571 PolarHBondContact O-OG 2.72Å; T568-S571 PolarHBondContact O-N 3.29Å; W569-S571 VanDerWaalsContact C-N 3.3Å; W569-S571 PolarHBondContact O-N 2.93Å; S571-T594 WeakPolarHBondContact OG-CG2 3.33Å; S571-R596 VanDerWaalsContact CA-NH2 3.32Å; S571-R596 PolarHBondContact O-NH2 3.18Å
572	T	96.1	Very high	95.9	Very high	94 Å²	94	49.1 Å²	49.1	58%	0.577	25%	0.253	S	S	*	.	H	α-helix	trans	-99.1	-27.5	-171.8	58	0	0	0	0	114.9	T568 W569 I570	T568-T572 WeakPolarHBondContact O-CB 3.23Å; T568-T572 WeakPolarHBondContact O-CG2 3.41Å; T568-T572 PolarHBondContact O-N 3.38Å; T568-T572 PolarHBondContact O-OG1 3.35Å; W569-T572 PolarHBondContact O-N 3.45Å; I570-T572 VanDerWaalsContact C-N 3.33Å; I570-T572 PolarHBondContact O-N 3.11Å
573	K	96.8	Very high	95.9	Very high	147 Å²	147	47.8 Å²	47.8	64%	0.639	25%	0.246	S	C	*	.	H	α-helix	trans	-113	-2.4	-171.7	-57	-59.1	-175.6	-179.5	0	114.3	W569	W569-K573 HydrophobicContact CD2-CB 4.37Å; W569-K573 HydrophobicContact CG-CB 4.33Å; W569-K573 HydrophobicContact CG-CG 4.28Å; W569-K573 HydrophobicContact CZ2-CB 4.44Å; W569-K573 WeakPolarHBondContact O-CA 3.37Å; W569-K573 VanDerWaalsContact O-CB 3.31Å; W569-K573 WeakPolarHBondContact O-CB 3.44Å; W569-K573 PolarHBondContact O-N 2.88Å
574	T	96.8	Very high	95.7	Very high	12 Å²	12	48.8 Å²	48.8	7%	0.074	25%	0.25	C	S	.	.	S	Bend	trans	-119.9	148.7	177.6	74	0	0	0	0	113.8	W569 I570 F580 R596 Y639	W569-T574 HydrophobicContact CE3-CG2 4.39Å; W569-T574 HydrophobicContact CH2-CG2 3.65Å; W569-T574 HydrophobicContact CZ2-CG2 4.25Å; W569-T574 HydrophobicContact CZ3-CG2 3.74Å; I570-T574 PolarHBondContact O-N 3.14Å; I570-T574 PolarHBondContact O-OG1 2.71Å; T574-F580 HydrophobicContact CG2-CZ 3.87Å; T574-R596 PolarHBondContact O-NH2 3.31Å; T574-Y639 HydrophobicContact CG2-CE1 4.21Å; T574-Y639 HydrophobicContact CG2-CE2 4.33Å
575	P	95.4	Very high	95.4	Very high	81 Å²	81	52.2 Å²	52.2	53%	0.526	26%	0.264	S	S	.	.			trans	-57.3	147.8	174.5	-23.2	32.9	0	0	0	112.8	Q577 A578	P575-Q577 PolarHBondContact O-N 2.79Å; P575-A578 HydrophobicContact CB-CB 4.35Å; P575-A578 WeakPolarHBondContact O-CB 3.27Å; P575-A578 PolarHBondContact O-N 3.32Å; P575-A578 VanDerWaalsContact O-N 3.08Å
576	K	92.2	Very high	95.3	Very high	181 Å²	181	48.6 Å²	48.6	79%	0.787	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-33	179	-68.5	-169.2	176.2	-173	0	113.6
577	Q	92.1	Very high	95.2	Very high	168 Å²	168	48.6 Å²	48.6	79%	0.785	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	9.6	179.8	-63.9	179.7	-5.6	0	0	113.4	P575	P575-Q577 PolarHBondContact O-N 2.79Å
578	A	95.3	Very high	95.1	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	25%	0.247	C	C	.	.			trans	-65	138.2	179.4	0	0	0	0	0	111	P575 F580 V597 Y639	P575-A578 HydrophobicContact CB-CB 4.35Å; P575-A578 WeakPolarHBondContact O-CB 3.27Å; P575-A578 PolarHBondContact O-N 3.32Å; P575-A578 VanDerWaalsContact O-N 3.08Å; A578-F580 HydrophobicContact CB-CE2 3.98Å; A578-V597 PolarHBondContact O-N 3.38Å; A578-Y639 HydrophobicContact CB-CD2 4.12Å; A578-Y639 HydrophobicContact CB-CE2 3.92Å
579	V	96.8	Very high	95	Very high	17 Å²	17	45.6 Å²	45.6	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.9	178.6	-176.4	0	0	0	0	110.7	S125 V597 T599 G636 D638 Y639	S125-V579 VanDerWaalsContact CB-CG1 3.49Å; V579-V597 WeakPolarHBondContact CA-O 3.23Å; V579-V597 HydrophobicContact CG2-CB 4.17Å; V579-V597 HydrophobicContact CG2-CG1 4.34Å; V579-T599 HydrophobicContact CG1-CG2 3.71Å; V579-G636 VanDerWaalsContact CB-O 3.27Å; V579-G636 WeakPolarHBondContact CB-O 3.23Å; V579-G636 WeakPolarHBondContact CG1-O 2.94Å; V579-D638 PolarHBondContact N-OD2 3.15Å; V579-D638 VanDerWaalsContact N-OD2 3.16Å; V579-D638 PolarHBondContact O-N 3.31Å; V579-Y639 PolarHBondContact O-N 3Å; V579-Y639 VanDerWaalsContact O-N 3.09Å
580	F	97.4	Very high	94.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.6	179.9	-77.5	-100.4	0	0	0	112.3	W569 I570 T574 A578 L587 I590 R596 V597 T599 Y639 V641 V714	W569-F580 HydrophobicContact CZ3-CE1 4.44Å; I570-F580 HydrophobicContact CB-CZ 4.26Å; I570-F580 HydrophobicContact CD1-CD1 4.27Å; I570-F580 HydrophobicContact CD1-CE1 3.8Å; I570-F580 HydrophobicContact CD1-CZ 4.14Å; I570-F580 HydrophobicContact CG1-CE1 3.79Å; I570-F580 HydrophobicContact CG1-CZ 3.8Å; I570-F580 HydrophobicContact CG2-CE1 4.38Å; I570-F580 HydrophobicContact CG2-CE2 3.86Å; I570-F580 HydrophobicContact CG2-CZ 3.65Å; T574-F580 HydrophobicContact CG2-CZ 3.87Å; A578-F580 HydrophobicContact CB-CE2 3.98Å; F580-L587 HydrophobicContact CB-CD2 3.93Å; F580-I590 HydrophobicContact CD1-CD1 4.37Å; F580-I590 HydrophobicContact CG-CG2 4.42Å; F580-R596 HydrophobicContact CD2-CB 3.89Å; F580-R596 HydrophobicContact CD2-CG 4.03Å; F580-R596 HydrophobicContact CE2-CB 4.16Å; F580-R596 HydrophobicContact CE2-CG 3.77Å; F580-V597 PolarHBondContact N-O 3.26Å; F580-T599 PolarHBondContact O-N 3.35Å; F580-T599 PolarHBondContact O-OG1 2.71Å; F580-Y639 HydrophobicContact CE1-CD2 4.46Å; F580-Y639 HydrophobicContact CE1-CG 4.04Å; F580-Y639 HydrophobicContact CE2-CD2 4.29Å; F580-Y639 HydrophobicContact CZ-CD2 4.13Å; F580-Y639 HydrophobicContact CZ-CG 4.12Å; F580-V641 HydrophobicContact CD1-CG2 3.91Å; F580-V641 HydrophobicContact CE1-CG2 4.48Å; F580-V714 HydrophobicContact CE1-CG1 4.44Å
581	A	97.1	Very high	94.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	146.5	169.9	0	0	0	0	0	111.4	T599 V616 L632 A637 Y639 V640 V641	A581-T599 VanDerWaalsContact CA-OG1 3.24Å; A581-T599 WeakPolarHBondContact CA-OG1 3.24Å; A581-T599 HydrophobicContact CB-CG2 3.9Å; A581-T599 WeakPolarHBondContact CB-OG1 3.39Å; A581-V616 HydrophobicContact CB-CG1 4.14Å; A581-L632 HydrophobicContact CB-CD2 3.76Å; A581-A637 HydrophobicContact CB-CB 3.84Å; A581-Y639 PolarHBondContact N-O 2.81Å; A581-V640 HydrophobicContact CB-CG2 4.46Å; A581-V640 CarbonylContact O-C 3.6Å; A581-V640 WeakPolarHBondContact O-CA 3.08Å; A581-V641 PolarHBondContact O-N 3.4Å
582	G	95.3	Very high	94.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	170.1	-163.5	-176.1	0	0	0	0	0	112.4	N600	G582-N600 PolarHBondContact O-ND2 2.75Å; G582-N600 PolarHBondContact O-OD1 3.41Å
583	S	93.8	Very high	94.7	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.014	19%	0.19	C	C	.	.			trans	-64.4	143.9	171.4	72.9	0	0	0	0	110.9	Q585 L586 L587 E643	S583-Q585 PolarHBondContact O-N 3.46Å; S583-L586 PolarHBondContact O-N 3.37Å; S583-L586 WeakPolarHBondContact OG-CB 3.09Å; S583-L586 PolarHBondContact OG-N 2.88Å; S583-L587 WeakPolarHBondContact O-CB 2.98Å; S583-L587 VanDerWaalsContact O-CG 3.29Å; S583-L587 WeakPolarHBondContact O-CG 3.22Å; S583-L587 PolarHBondContact O-N 2.82Å; S583-E643 WeakPolarHBondContact CB-OE1 3.27Å; S583-E643 PolarHBondContact OG-OE1 3.27Å; S583-E643 PolarHBondContact OG-OE2 3.45Å
584	M	91.1	Very high	94.6	Very high	32 Å²	32	32.1 Å²	32.1	16%	0.158	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-35.1	177.9	67.1	-165.8	168.2	0	0	111.9	A588 P602 Y604 Y617	M584-A588 PolarHBondContact O-N 3.37Å; M584-P602 HydrophobicContact CB-CG 4.22Å; M584-P602 HydrophobicContact CG-CG 4.36Å; M584-P602 WeakPolarHBondContact O-CD 3.34Å; M584-P602 WeakPolarHBondContact O-CG 3.23Å; M584-Y604 HydrophobicContact SD-CD2 4.48Å; M584-Y617 VanDerWaalsContact CG-OH 3.24Å; M584-Y617 WeakPolarHBondContact CG-OH 2.76Å; M584-Y617 PolarHBondContact N-OH 2.88Å
585	Q	90.4	Very high	94.4	Very high	104 Å²	104	33.3 Å²	33.3	49%	0.486	18%	0.178	S	C	.	.	H	α-helix	trans	-65.2	-48.2	-178.5	-61.9	-173.1	-13.7	0	0	111.9	T92 S583	T92-Q585 HydrophobicContact CG2-CB 3.88Å; T92-Q585 HydrophobicContact CG2-CG 3.64Å; S583-Q585 PolarHBondContact O-N 3.46Å
586	L	94.1	Very high	94.4	Very high	17 Å²	17	30.5 Å²	30.5	9%	0.089	16%	0.156	C	C	.	.	H	α-helix	trans	-70.3	-39.8	179.1	-179.5	63.8	0	0	0	112.1	L566 M567 S583 A588 G589 I590 V641 E643 F712	L566-L586 HydrophobicContact CD2-CD1 4.18Å; L566-L586 HydrophobicContact CD2-CD2 4.12Å; M567-L586 HydrophobicContact CE-CD1 4.04Å; S583-L586 PolarHBondContact O-N 3.37Å; S583-L586 WeakPolarHBondContact OG-CB 3.09Å; S583-L586 PolarHBondContact OG-N 2.88Å; L586-A588 VanDerWaalsContact C-N 3.26Å; L586-A588 PolarHBondContact O-N 2.91Å; L586-G589 WeakPolarHBondContact O-CA 3.27Å; L586-G589 PolarHBondContact O-N 2.78Å; L586-I590 HydrophobicContact CG-CD1 4.18Å; L586-I590 HydrophobicContact CG-CG1 4.44Å; L586-I590 PolarHBondContact O-N 2.85Å; L586-V641 HydrophobicContact CD2-CB 4.17Å; L586-V641 HydrophobicContact CD2-CG1 3.6Å; L586-E643 HydrophobicContact CD2-CG 4.14Å; L586-F712 HydrophobicContact CD1-CE1 3.96Å; L586-F712 HydrophobicContact CD1-CZ 4.17Å; L586-F712 HydrophobicContact CD2-CD1 3.89Å; L586-F712 HydrophobicContact CD2-CE1 3.68Å; L586-F712 HydrophobicContact CG-CE1 4.45Å
587	L	95.1	Very high	94.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.4	-35.1	-178.3	-75.6	-171.4	0	0	0	112.5	F580 S583 G589 I590 K591 L598 N600	F580-L587 HydrophobicContact CB-CD2 3.93Å; S583-L587 WeakPolarHBondContact O-CB 2.98Å; S583-L587 VanDerWaalsContact O-CG 3.29Å; S583-L587 WeakPolarHBondContact O-CG 3.22Å; S583-L587 PolarHBondContact O-N 2.82Å; L587-G589 VanDerWaalsContact C-N 3.33Å; L587-G589 PolarHBondContact O-N 2.79Å; L587-I590 HydrophobicContact CD2-CD1 4.09Å; L587-I590 PolarHBondContact O-N 3.41Å; L587-K591 PolarHBondContact O-N 3.4Å; L587-L598 HydrophobicContact CB-CD1 4.15Å; L587-L598 HydrophobicContact CB-CD2 4Å; L587-L598 HydrophobicContact CB-CG 4.49Å; L587-L598 HydrophobicContact CD1-CB 4.5Å; L587-L598 HydrophobicContact CD2-CD2 4.26Å; L587-L598 WeakPolarHBondContact O-CD1 3.29Å; L587-L598 WeakPolarHBondContact O-CD2 3.36Å; L587-N600 WeakPolarHBondContact CD1-O 3.34Å; L587-N600 WeakPolarHBondContact CD1-OD1 2.98Å
588	A	93.8	Very high	94.7	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-39.7	173.3	0	0	0	0	0	112.6	T92 L96 M584 L586 K591 L592 P602	T92-A588 WeakPolarHBondContact O-CB 3.18Å; L96-A588 HydrophobicContact CB-CB 4.24Å; M584-A588 PolarHBondContact O-N 3.37Å; L586-A588 VanDerWaalsContact C-N 3.26Å; L586-A588 PolarHBondContact O-N 2.91Å; A588-K591 PolarHBondContact O-N 2.88Å; A588-L592 PolarHBondContact O-N 3.09Å; A588-P602 HydrophobicContact CB-CG 3.95Å
589	G	94.3	Very high	94.6	Very high	9 Å²	9	14.3 Å²	14.3	9%	0.093	8%	0.084	C	C	.	.	H	α-helix	trans	-64.8	-40.7	172.6	0	0	0	0	0	112.4	L586 L587 K591 L592 C593	L586-G589 WeakPolarHBondContact O-CA 3.27Å; L586-G589 PolarHBondContact O-N 2.78Å; L587-G589 VanDerWaalsContact C-N 3.33Å; L587-G589 PolarHBondContact O-N 2.79Å; G589-K591 VanDerWaalsContact C-N 3.35Å; G589-K591 PolarHBondContact O-N 3.33Å; G589-L592 PolarHBondContact O-N 2.93Å; G589-C593 WeakPolarHBondContact O-CB 3.39Å; G589-C593 PolarHBondContact O-N 2.88Å; G589-C593 PolarHBondContact O-SG 3.41Å
590	I	95.8	Very high	94.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.7	-44.6	174.8	-68.5	177.2	0	0	0	110.5	M567 I570 F580 L586 L587 T594 G595 R596 V641	M567-I590 HydrophobicContact CE-CG1 3.75Å; M567-I590 HydrophobicContact SD-CB 4.39Å; M567-I590 HydrophobicContact SD-CG1 3.79Å; I570-I590 HydrophobicContact CD1-CD1 3.63Å; I570-I590 HydrophobicContact CD1-CG1 3.8Å; I570-I590 HydrophobicContact CD1-CG2 4.15Å; F580-I590 HydrophobicContact CD1-CD1 4.37Å; F580-I590 HydrophobicContact CG-CG2 4.42Å; L586-I590 HydrophobicContact CG-CD1 4.18Å; L586-I590 HydrophobicContact CG-CG1 4.44Å; L586-I590 PolarHBondContact O-N 2.85Å; L587-I590 HydrophobicContact CD2-CD1 4.09Å; L587-I590 PolarHBondContact O-N 3.41Å; I590-T594 WeakPolarHBondContact O-CA 3.24Å; I590-T594 WeakPolarHBondContact O-CB 3.02Å; I590-T594 PolarHBondContact O-N 3.49Å; I590-T594 PolarHBondContact O-OG1 3.25Å; I590-G595 PolarHBondContact O-N 2.76Å; I590-R596 HydrophobicContact CG2-CB 4.07Å; I590-V641 HydrophobicContact CD1-CG2 4.15Å
591	K	94.8	Very high	94.1	Very high	12 Å²	12	13.5 Å²	13.5	5%	0.052	8%	0.079	C	C	.	.	H	α-helix	trans	-61.4	-45.5	176.4	175.7	65.3	174.2	-178.3	0	111.7	L96 L122 L587 A588 G589 G595 R596 L598	L96-K591 HydrophobicContact CD1-CG 4.36Å; L122-K591 VanDerWaalsContact C-NZ 3.29Å; L122-K591 VanDerWaalsContact CB-NZ 3.35Å; L122-K591 PolarHBondContact O-NZ 3.41Å; L587-K591 PolarHBondContact O-N 3.4Å; A588-K591 PolarHBondContact O-N 2.88Å; G589-K591 VanDerWaalsContact C-N 3.35Å; G589-K591 PolarHBondContact O-N 3.33Å; K591-G595 WeakPolarHBondContact O-CA 3.39Å; K591-G595 PolarHBondContact O-N 3.29Å; K591-R596 WeakPolarHBondContact CD-O 3.22Å; K591-L598 HydrophobicContact CB-CD1 3.75Å; K591-L598 HydrophobicContact CB-CD2 3.97Å; K591-L598 HydrophobicContact CB-CG 4.02Å; K591-L598 HydrophobicContact CG-CD1 4.38Å
592	L	95.1	Very high	93.6	Very high	6 Å²	6	14 Å²	14	3%	0.031	8%	0.083	C	C	.	.	H	α-helix	trans	-65.3	-54.4	179.8	174.7	56.3	0	0	0	112.2	E87 F90 Y98 K102 A588 G589 T594	E87-L592 HydrophobicContact CB-CD2 3.84Å; E87-L592 HydrophobicContact CB-CG 3.96Å; E87-L592 HydrophobicContact CG-CD1 4.33Å; E87-L592 HydrophobicContact CG-CD2 4.1Å; E87-L592 HydrophobicContact CG-CG 4.05Å; E87-L592 WeakPolarHBondContact O-CD2 3.25Å; F90-L592 HydrophobicContact CB-CD2 3.85Å; F90-L592 HydrophobicContact CD2-CD2 4.39Å; F90-L592 HydrophobicContact CG-CD2 4.38Å; Y98-L592 HydrophobicContact CD1-CD1 3.43Å; Y98-L592 VanDerWaalsContact CD1-CD1 3.43Å; Y98-L592 HydrophobicContact CD1-CD2 3.81Å; Y98-L592 HydrophobicContact CD1-CG 4.26Å; Y98-L592 HydrophobicContact CE1-CD1 4.01Å; Y98-L592 HydrophobicContact CG-CD1 4.38Å; K102-L592 HydrophobicContact CD-CD1 4.41Å; A588-L592 PolarHBondContact O-N 3.09Å; G589-L592 PolarHBondContact O-N 2.93Å; L592-T594 VanDerWaalsContact C-N 3.33Å; L592-T594 PolarHBondContact O-N 3.33Å
593	C	94.8	Very high	93	Very high	18 Å²	18	14.2 Å²	14.2	12%	0.122	8%	0.084	C	C	.	.	H	α-helix	trans	-73.8	-26.8	-172	-58.1	0	0	0	0	112.9	E87 M567 G589	E87-C593 WeakPolarHBondContact OE2-CA 3.47Å; M567-C593 HydrophobicContact CB-CB 4.12Å; M567-C593 HydrophobicContact CG-CB 3.91Å; M567-C593 HydrophobicContact SD-CB 3.97Å; G589-C593 WeakPolarHBondContact O-CB 3.39Å; G589-C593 PolarHBondContact O-N 2.88Å; G589-C593 PolarHBondContact O-SG 3.41Å
594	T	94.7	Very high	92.1	Very high	13 Å²	13	14.5 Å²	14.5	8%	0.08	8%	0.084	C	C	.	.	H	α-helix	trans	-126.2	-19.2	-169.9	81.8	0	0	0	0	113	M567 I570 S571 I590 L592 R596	M567-T594 HydrophobicContact CB-CG2 4.39Å; M567-T594 HydrophobicContact SD-CG2 4.08Å; I570-T594 HydrophobicContact CB-CG2 4.07Å; I570-T594 HydrophobicContact CG2-CG2 3.76Å; S571-T594 WeakPolarHBondContact OG-CG2 3.33Å; I590-T594 WeakPolarHBondContact O-CA 3.24Å; I590-T594 WeakPolarHBondContact O-CB 3.02Å; I590-T594 PolarHBondContact O-N 3.49Å; I590-T594 PolarHBondContact O-OG1 3.25Å; L592-T594 VanDerWaalsContact C-N 3.33Å; L592-T594 PolarHBondContact O-N 3.33Å; T594-R596 WeakPolarHBondContact O-CD 3.23Å; T594-R596 PolarHBondContact O-N 3.07Å; T594-R596 PolarHBondContact O-NH1 3.48Å; T594-R596 VanDerWaalsContact OG1-CD 3.31Å; T594-R596 WeakPolarHBondContact OG1-CD 3.49Å; T594-R596 PolarHBondContact OG1-N 3.26Å
595	G	93.6	Very high	91.3	Very high	37 Å²	37	13.6 Å²	13.6	38%	0.381	8%	0.08	S	C	.	.			trans	71.8	11.1	-177.7	0	0	0	0	0	114.7	I590 K591	I590-G595 PolarHBondContact O-N 2.76Å; K591-G595 WeakPolarHBondContact O-CA 3.39Å; K591-G595 PolarHBondContact O-N 3.29Å
596	R	95	Very high	90.9	Very high	21 Å²	21	10.4 Å²	10.4	8%	0.079	7%	0.066	C	C	.	.	P	Polyproline II helix	trans	-72.8	154	-179.3	-82.7	42.2	172.2	-159.1	-0.8	111.3	I570 S571 T574 F580 I590 K591 T594	I570-R596 HydrophobicContact CG2-CG 4.01Å; I570-R596 PolarHBondContact O-NH2 2.82Å; S571-R596 VanDerWaalsContact CA-NH2 3.32Å; S571-R596 PolarHBondContact O-NH2 3.18Å; T574-R596 PolarHBondContact O-NH2 3.31Å; F580-R596 HydrophobicContact CD2-CB 3.89Å; F580-R596 HydrophobicContact CD2-CG 4.03Å; F580-R596 HydrophobicContact CE2-CB 4.16Å; F580-R596 HydrophobicContact CE2-CG 3.77Å; I590-R596 HydrophobicContact CG2-CB 4.07Å; K591-R596 WeakPolarHBondContact CD-O 3.22Å; T594-R596 WeakPolarHBondContact O-CD 3.23Å; T594-R596 PolarHBondContact O-N 3.07Å; T594-R596 PolarHBondContact O-NH1 3.48Å; T594-R596 VanDerWaalsContact OG1-CD 3.31Å; T594-R596 WeakPolarHBondContact OG1-CD 3.49Å; T594-R596 PolarHBondContact OG1-N 3.26Å
597	V	94.7	Very high	90.3	Very high	12 Å²	12	13.6 Å²	13.6	7%	0.073	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	138.9	-176.8	-173.9	0	0	0	0	110.2	L122 A578 V579 F580	L122-V597 HydrophobicContact CD2-CG2 4.36Å; L122-V597 WeakPolarHBondContact O-CA 3.24Å; A578-V597 PolarHBondContact O-N 3.38Å; V579-V597 WeakPolarHBondContact CA-O 3.23Å; V579-V597 HydrophobicContact CG2-CB 4.17Å; V579-V597 HydrophobicContact CG2-CG1 4.34Å; F580-V597 PolarHBondContact N-O 3.26Å
598	L	95.1	Very high	89.8	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	150	-174.8	-47.8	-177.6	0	0	0	111.9	L96 T123 S125 L587 K591 H601	L96-L598 HydrophobicContact CD1-CD1 4.49Å; T123-L598 VanDerWaalsContact O-CB 3.3Å; T123-L598 WeakPolarHBondContact O-CB 3.15Å; T123-L598 PolarHBondContact O-N 3.39Å; T123-L598 VanDerWaalsContact O-N 3.12Å; S125-L598 PolarHBondContact N-O 3.1Å; L587-L598 HydrophobicContact CB-CD1 4.15Å; L587-L598 HydrophobicContact CB-CD2 4Å; L587-L598 HydrophobicContact CB-CG 4.49Å; L587-L598 HydrophobicContact CD1-CB 4.5Å; L587-L598 HydrophobicContact CD2-CD2 4.26Å; L587-L598 WeakPolarHBondContact O-CD1 3.29Å; L587-L598 WeakPolarHBondContact O-CD2 3.36Å; K591-L598 HydrophobicContact CB-CD1 3.75Å; K591-L598 HydrophobicContact CB-CD2 3.97Å; K591-L598 HydrophobicContact CB-CG 4.02Å; K591-L598 HydrophobicContact CG-CD1 4.38Å; L598-H601 HydrophobicContact CD1-CB 4.03Å
599	T	93.4	Very high	89.6	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-82.3	-33.1	165.4	54.3	0	0	0	0	113	V579 F580 A581 R612 V635 A637	V579-T599 HydrophobicContact CG1-CG2 3.71Å; F580-T599 PolarHBondContact O-N 3.35Å; F580-T599 PolarHBondContact O-OG1 2.71Å; A581-T599 VanDerWaalsContact CA-OG1 3.24Å; A581-T599 WeakPolarHBondContact CA-OG1 3.24Å; A581-T599 HydrophobicContact CB-CG2 3.9Å; A581-T599 WeakPolarHBondContact CB-OG1 3.39Å; T599-R612 WeakPolarHBondContact O-CD 3.22Å; T599-R612 PolarHBondContact O-NE 3.2Å; T599-R612 PolarHBondContact O-NH1 3.16Å; T599-V635 HydrophobicContact CG2-CB 4.4Å; T599-V635 HydrophobicContact CG2-CG2 3.89Å; T599-A637 HydrophobicContact CG2-CB 4.01Å
600	N	93.6	Very high	89.3	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.			trans	-151.8	162.6	-177.4	55.8	-51.5	0	0	0	109.3	G582 L587 L609 T613	G582-N600 PolarHBondContact O-ND2 2.75Å; G582-N600 PolarHBondContact O-OD1 3.41Å; L587-N600 WeakPolarHBondContact CD1-O 3.34Å; L587-N600 WeakPolarHBondContact CD1-OD1 2.98Å; N600-L609 HydrophobicContact CB-CD1 4.47Å; N600-T613 WeakPolarHBondContact CB-OG1 3.21Å
601	H	91.4	Very high	89	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.119	C	C	.	.			trans	-155.4	165.9	-177.5	58.9	57.7	0	0	0	111.4	L96 E124 M135 L598 H603 L609	L96-H601 HydrophobicContact CD2-CB 4.17Å; E124-H601 IonicContact OE1-CE1 2.73Å; E124-H601 IonicContact OE1-NE2 3.6Å; E124-H601 PolarHBondContact OE1-NE2 3.23Å; M135-H601 VanDerWaalsContact CE-CE1 3.46Å; M135-H601 WeakPolarHBondContact CE-CE1 3.22Å; L598-H601 HydrophobicContact CD1-CB 4.03Å; H601-H603 VanDerWaalsContact C-N 3.25Å; H601-H603 PolarHBondContact ND1-N 2.58Å; H601-H603 PolarHBondContact O-N 3.07Å; H601-H603 VanDerWaalsContact O-N 3.14Å; H601-L609 WeakPolarHBondContact CE1-CD2 3.49Å; H601-L609 WeakPolarHBondContact ND1-CD2 3.34Å
602	P	86.3	Confident	88.8	Confident	12 Å²	12	22.7 Å²	22.7	8%	0.078	12%	0.12	C	C	.	.	S	Bend	trans	-64.1	-18.6	-170	-27.9	38.5	0	0	0	116.6	E93 M584 A588 Y604	E93-P602 HydrophobicContact CG-CB 3.59Å; M584-P602 HydrophobicContact CB-CG 4.22Å; M584-P602 HydrophobicContact CG-CG 4.36Å; M584-P602 WeakPolarHBondContact O-CD 3.34Å; M584-P602 WeakPolarHBondContact O-CG 3.23Å; A588-P602 HydrophobicContact CB-CG 3.95Å; P602-Y604 VanDerWaalsContact C-N 3.27Å; P602-Y604 PolarHBondContact O-N 2.88Å
603	H	82.2	Confident	88.7	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.019	12%	0.119	C	C	.	.			trans	-72.3	79.2	175.6	-174.2	88.6	0	0	0	111.7	R134 M135 Q262 H601 E605 L609	R134-H603 PolarHBondContact O-CE1 2.88Å; R134-H603 PolarHBondContact O-NE2 3.33Å; M135-H603 HydrophobicContact CE-CB 4.27Å; M135-H603 HydrophobicContact SD-CB 3.74Å; M135-H603 PolarHBondContact SD-CD2 3.09Å; Q262-H603 PolarHBondContact OE1-CE1 2.98Å; H601-H603 VanDerWaalsContact C-N 3.25Å; H601-H603 PolarHBondContact ND1-N 2.58Å; H601-H603 PolarHBondContact O-N 3.07Å; H601-H603 VanDerWaalsContact O-N 3.14Å; H603-E605 VanDerWaalsContact C-N 3.32Å; H603-E605 VanDerWaalsContact CA-OE2 3.26Å; H603-E605 WeakPolarHBondContact CA-OE2 3.45Å; H603-E605 IonicContact CD2-OE2 3.67Å; H603-E605 PolarHBondContact CD2-OE2 3.17Å; H603-E605 VanDerWaalsContact CD2-OE2 3.31Å; H603-E605 IonicContact CE1-OE2 2.82Å; H603-E605 PolarHBondContact CE1-OE2 3.42Å; H603-E605 IonicContact CG-OE2 3.81Å; H603-E605 IonicContact ND1-OE2 2.6Å; H603-E605 PolarHBondContact ND1-OE2 3.12Å; H603-E605 VanDerWaalsContact ND1-OE2 3.09Å; H603-E605 IonicContact NE2-OE2 2.63Å; H603-E605 PolarHBondContact O-N 2.98Å; H603-L609 WeakPolarHBondContact O-CD2 3.39Å
604	Y	75.7	Confident	88.6	Confident	7 Å²	7	24.4 Å²	24.4	3%	0.027	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	11	-167.9	-158	-109.8	0	0	0	115.1	D394 L397 Y398 M584 P602 R610 T613	D394-Y604 HydrophobicContact CB-CE1 4.47Å; D394-Y604 PolarHBondContact OD1-OH 3.12Å; L397-Y604 HydrophobicContact CD2-CE1 4.23Å; Y398-Y604 HydrophobicContact CE2-CD1 4.12Å; Y398-Y604 HydrophobicContact CE2-CE1 4.43Å; M584-Y604 HydrophobicContact SD-CD2 4.48Å; P602-Y604 VanDerWaalsContact C-N 3.27Å; P602-Y604 PolarHBondContact O-N 2.88Å; Y604-R610 HydrophobicContact CD1-CG 3.52Å; Y604-R610 HydrophobicContact CD2-CG 3.9Å; Y604-R610 HydrophobicContact CE1-CB 4.12Å; Y604-R610 HydrophobicContact CE1-CG 3.38Å; Y604-R610 HydrophobicContact CE2-CB 4.12Å; Y604-R610 HydrophobicContact CE2-CG 3.79Å; Y604-R610 HydrophobicContact CG-CG 3.77Å; Y604-R610 WeakPolarHBondContact O-CD 3.47Å; Y604-R610 WeakPolarHBondContact O-CG 3.43Å; Y604-T613 HydrophobicContact CD2-CG2 4.39Å; Y604-T613 HydrophobicContact CE2-CG2 3.76Å
605	E	74.6	Confident	88.6	Confident	13 Å²	13	26.9 Å²	26.9	6%	0.061	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-30.4	-171.1	-67.8	74.5	-170.2	0	0	112.8	Q262 F263 H603	Q262-E605 VanDerWaalsContact NE2-CD 3.32Å; Q262-E605 PolarHBondContact NE2-OE1 2.6Å; F263-E605 HydrophobicContact CE1-CG 4.43Å; F263-E605 HydrophobicContact CZ-CG 4.02Å; F263-E605 WeakPolarHBondContact CZ-OE1 3.16Å; H603-E605 VanDerWaalsContact C-N 3.32Å; H603-E605 VanDerWaalsContact CA-OE2 3.26Å; H603-E605 WeakPolarHBondContact CA-OE2 3.45Å; H603-E605 IonicContact CD2-OE2 3.67Å; H603-E605 PolarHBondContact CD2-OE2 3.17Å; H603-E605 VanDerWaalsContact CD2-OE2 3.31Å; H603-E605 IonicContact CE1-OE2 2.82Å; H603-E605 PolarHBondContact CE1-OE2 3.42Å; H603-E605 IonicContact CG-OE2 3.81Å; H603-E605 IonicContact ND1-OE2 2.6Å; H603-E605 PolarHBondContact ND1-OE2 3.12Å; H603-E605 VanDerWaalsContact ND1-OE2 3.09Å; H603-E605 IonicContact NE2-OE2 2.63Å; H603-E605 PolarHBondContact O-N 2.98Å
606	D	80.9	Confident	88.6	Confident	38 Å²	38	25.1 Å²	25.1	20%	0.203	12%	0.116	C	C	.	.	S	Bend	trans	-76.7	133.6	-179.5	-179.4	-97.5	0	0	0	112.3	R134 D608 L609 R610	R134-D606 VanDerWaalsContact CZ-CB 3.47Å; R134-D606 IonicContact NH2-OD1 3.37Å; D606-D608 PolarHBondContact O-N 3.29Å; D606-D608 WeakPolarHBondContact OD1-CB 3.46Å; D606-D608 PolarHBondContact OD1-N 3Å; D606-L609 HydrophobicContact CB-CB 4.05Å; D606-L609 PolarHBondContact O-N 2.85Å; D606-L609 PolarHBondContact OD1-N 3.43Å; D606-R610 WeakPolarHBondContact O-CG 3.34Å; D606-R610 PolarHBondContact O-N 3.12Å
607	K	81.6	Confident	88.7	Confident	84 Å²	84	24.4 Å²	24.4	37%	0.365	11%	0.114	S	C	.	.	H	α-helix	trans	-63.5	-42.9	-175.4	-178.9	176.5	178.1	168.4	0	112.8	R372 L609 R610 E611	R372-K607 HydrophobicContact CB-CD 4.24Å; K607-L609 VanDerWaalsContact C-N 3.32Å; K607-R610 PolarHBondContact O-N 2.79Å; K607-E611 PolarHBondContact O-N 2.91Å; K607-E611 VanDerWaalsContact O-N 3.11Å
608	D	85.5	Confident	88.7	Confident	84 Å²	84	24.1 Å²	24.1	45%	0.449	11%	0.112	S	C	.	.	H	α-helix	trans	-69.3	-37.3	-178	-72.5	-7.2	0	0	0	110.7	R127 D606 E611 R612	R127-D608 IonicContact CZ-OD2 2.98Å; R127-D608 IonicContact NH1-OD2 3.17Å; R127-D608 PolarHBondContact NH1-OD2 3.34Å; R127-D608 IonicContact NH2-OD2 3.53Å; R127-D608 PolarHBondContact NH2-OD2 3.4Å; D606-D608 PolarHBondContact O-N 3.29Å; D606-D608 WeakPolarHBondContact OD1-CB 3.46Å; D606-D608 PolarHBondContact OD1-N 3Å; D608-E611 PolarHBondContact O-N 3.04Å; D608-R612 VanDerWaalsContact O-CB 3.23Å; D608-R612 WeakPolarHBondContact O-CB 3.49Å; D608-R612 PolarHBondContact O-N 3.35Å
609	L	87.9	Confident	88.8	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-66.3	-37.6	175.4	-168.7	78.9	0	0	0	112.2	E124 N600 H601 H603 D606 K607 R612 T613	E124-L609 HydrophobicContact CG-CD1 4.5Å; N600-L609 HydrophobicContact CB-CD1 4.47Å; H601-L609 WeakPolarHBondContact CE1-CD2 3.49Å; H601-L609 WeakPolarHBondContact ND1-CD2 3.34Å; H603-L609 WeakPolarHBondContact O-CD2 3.39Å; D606-L609 HydrophobicContact CB-CB 4.05Å; D606-L609 PolarHBondContact O-N 2.85Å; D606-L609 PolarHBondContact OD1-N 3.43Å; K607-L609 VanDerWaalsContact C-N 3.32Å; L609-R612 PolarHBondContact O-N 3.34Å; L609-T613 WeakPolarHBondContact O-CB 3.35Å; L609-T613 PolarHBondContact O-N 2.82Å; L609-T613 PolarHBondContact O-OG1 2.94Å
610	R	88.6	Confident	88.9	Confident	13 Å²	13	24.3 Å²	24.3	5%	0.049	11%	0.113	C	C	.	.	H	α-helix	trans	-59.8	-50.6	173.5	-72.5	-168.2	-85.9	133.1	-8.4	111.8	S373 H376 D394 Y604 D606 K607 R612 T613 R614	S373-R610 PolarHBondContact O-NH2 2.84Å; H376-R610 VanDerWaalsContact CB-CZ 3.48Å; H376-R610 VanDerWaalsContact CB-NH1 3.27Å; H376-R610 PolarHBondContact ND1-NH2 2.91Å; D394-R610 IonicContact OD2-CZ 3.31Å; D394-R610 IonicContact OD2-NH1 3.07Å; D394-R610 PolarHBondContact OD2-NH1 3.33Å; Y604-R610 HydrophobicContact CD1-CG 3.52Å; Y604-R610 HydrophobicContact CD2-CG 3.9Å; Y604-R610 HydrophobicContact CE1-CB 4.12Å; Y604-R610 HydrophobicContact CE1-CG 3.38Å; Y604-R610 HydrophobicContact CE2-CB 4.12Å; Y604-R610 HydrophobicContact CE2-CG 3.79Å; Y604-R610 HydrophobicContact CG-CG 3.77Å; Y604-R610 WeakPolarHBondContact O-CD 3.47Å; Y604-R610 WeakPolarHBondContact O-CG 3.43Å; D606-R610 WeakPolarHBondContact O-CG 3.34Å; D606-R610 PolarHBondContact O-N 3.12Å; K607-R610 PolarHBondContact O-N 2.79Å; R610-R612 VanDerWaalsContact C-N 3.31Å; R610-R612 PolarHBondContact O-N 2.9Å; R610-T613 PolarHBondContact O-N 2.89Å; R610-T613 VanDerWaalsContact O-N 3.15Å; R610-R614 PolarHBondContact O-N 3.38Å
611	E	88.9	Confident	88.9	Confident	90 Å²	90	24.3 Å²	24.3	42%	0.421	11%	0.113	S	C	.	.	H	α-helix	trans	-59	-46.7	176.9	-176.9	54.6	-142.6	0	0	110.5	K607 D608 T613 R614 Q615	K607-E611 PolarHBondContact O-N 2.91Å; K607-E611 VanDerWaalsContact O-N 3.11Å; D608-E611 PolarHBondContact O-N 3.04Å; E611-T613 VanDerWaalsContact C-N 3.3Å; E611-T613 PolarHBondContact O-N 2.87Å; E611-R614 WeakPolarHBondContact O-CB 3.32Å; E611-R614 PolarHBondContact O-N 2.98Å; E611-Q615 VanDerWaalsContact O-CG 3.26Å; E611-Q615 WeakPolarHBondContact O-CG 3.44Å; E611-Q615 PolarHBondContact O-N 3.18Å; E611-Q615 PolarHBondContact OE1-NE2 3.38Å
612	R	91.5	Very high	89	Confident	23 Å²	23	27.4 Å²	27.4	9%	0.087	12%	0.124	C	C	.	.	H	α-helix	trans	-58.8	-40.7	176.9	-172	172	-173.7	-176.4	-3.4	112.9	S125 T599 D608 L609 R610 Q615 V616 V635	S125-R612 PolarHBondContact O-NH1 2.58Å; S125-R612 PolarHBondContact O-NH2 3.34Å; S125-R612 PolarHBondContact OG-NH2 2.94Å; T599-R612 WeakPolarHBondContact O-CD 3.22Å; T599-R612 PolarHBondContact O-NE 3.2Å; T599-R612 PolarHBondContact O-NH1 3.16Å; D608-R612 VanDerWaalsContact O-CB 3.23Å; D608-R612 WeakPolarHBondContact O-CB 3.49Å; D608-R612 PolarHBondContact O-N 3.35Å; L609-R612 PolarHBondContact O-N 3.34Å; R610-R612 VanDerWaalsContact C-N 3.31Å; R610-R612 PolarHBondContact O-N 2.9Å; R612-Q615 PolarHBondContact O-N 3.22Å; R612-V616 WeakPolarHBondContact O-CG2 3.41Å; R612-V616 PolarHBondContact O-N 2.88Å; R612-V635 HydrophobicContact CG-CB 4.38Å; R612-V635 HydrophobicContact CG-CG1 3.78Å; R612-V635 PolarHBondContact NH2-O 2.54Å
613	T	93	Very high	89.3	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.8	-44.8	177.4	-59.8	0	0	0	0	110.8	N600 Y604 L609 R610 E611 Q615 V616 Y617	N600-T613 WeakPolarHBondContact CB-OG1 3.21Å; Y604-T613 HydrophobicContact CD2-CG2 4.39Å; Y604-T613 HydrophobicContact CE2-CG2 3.76Å; L609-T613 WeakPolarHBondContact O-CB 3.35Å; L609-T613 PolarHBondContact O-N 2.82Å; L609-T613 PolarHBondContact O-OG1 2.94Å; R610-T613 PolarHBondContact O-N 2.89Å; R610-T613 VanDerWaalsContact O-N 3.15Å; E611-T613 VanDerWaalsContact C-N 3.3Å; E611-T613 PolarHBondContact O-N 2.87Å; T613-Q615 VanDerWaalsContact C-N 3.25Å; T613-Q615 PolarHBondContact O-N 3.11Å; T613-V616 PolarHBondContact O-N 3.3Å; T613-Y617 HydrophobicContact CG2-CD1 4.24Å; T613-Y617 HydrophobicContact CG2-CD2 4.12Å; T613-Y617 HydrophobicContact CG2-CE1 3.84Å; T613-Y617 HydrophobicContact CG2-CE2 3.75Å; T613-Y617 HydrophobicContact CG2-CG 4.38Å; T613-Y617 WeakPolarHBondContact O-CB 3.26Å; T613-Y617 PolarHBondContact O-N 3.47Å
614	R	92.2	Very high	89.9	Confident	61 Å²	61	30.2 Å²	30.2	23%	0.23	14%	0.136	C	C	.	.	H	α-helix	trans	-56.8	-40.3	173.4	179.7	-176.2	173.8	165.8	0.3	111.8	F393 R610 E611 Q618 A665	F393-R614 HydrophobicContact CD1-CB 4.12Å; F393-R614 HydrophobicContact CD1-CG 3.97Å; F393-R614 HydrophobicContact CE1-CB 4.23Å; F393-R614 HydrophobicContact CE1-CG 4.37Å; F393-R614 HydrophobicContact CG-CG 4.33Å; R610-R614 PolarHBondContact O-N 3.38Å; E611-R614 WeakPolarHBondContact O-CB 3.32Å; E611-R614 PolarHBondContact O-N 2.98Å; R614-Q618 PolarHBondContact O-NE2 3.3Å; R614-Q618 VanDerWaalsContact O-NE2 3.11Å; R614-A665 PolarHBondContact NH2-O 3.33Å
615	Q	93.9	Very high	90.9	Very high	64 Å²	64	30.2 Å²	30.2	30%	0.299	14%	0.137	S	C	.	.	H	α-helix	trans	-67.1	-48.7	175.5	-67.2	-62.2	-31.8	0	0	111.7	E611 R612 T613 Y617 Q618 I631	E611-Q615 VanDerWaalsContact O-CG 3.26Å; E611-Q615 WeakPolarHBondContact O-CG 3.44Å; E611-Q615 PolarHBondContact O-N 3.18Å; E611-Q615 PolarHBondContact OE1-NE2 3.38Å; R612-Q615 PolarHBondContact O-N 3.22Å; T613-Q615 VanDerWaalsContact C-N 3.25Å; T613-Q615 PolarHBondContact O-N 3.11Å; Q615-Y617 VanDerWaalsContact C-N 3.25Å; Q615-Y617 PolarHBondContact O-N 2.99Å; Q615-Q618 VanDerWaalsContact O-CB 3.25Å; Q615-Q618 WeakPolarHBondContact O-CB 3.48Å; Q615-Q618 VanDerWaalsContact O-CG 3.27Å; Q615-Q618 WeakPolarHBondContact O-CG 3.49Å; Q615-Q618 PolarHBondContact O-N 3.01Å; Q615-Q618 VanDerWaalsContact O-N 3.07Å; Q615-I631 HydrophobicContact CB-CG2 3.85Å; Q615-I631 WeakPolarHBondContact O-CG2 3.35Å
616	V	95.2	Very high	91.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-38	177.2	170.3	0	0	0	0	111.3	A581 R612 T613 Q618 V619 V635	A581-V616 HydrophobicContact CB-CG1 4.14Å; R612-V616 WeakPolarHBondContact O-CG2 3.41Å; R612-V616 PolarHBondContact O-N 2.88Å; T613-V616 PolarHBondContact O-N 3.3Å; V616-Q618 PolarHBondContact O-N 2.95Å; V616-V619 VanDerWaalsContact O-CG1 3.32Å; V616-V619 WeakPolarHBondContact O-CG1 3.13Å; V616-V619 VanDerWaalsContact O-CG2 3.31Å; V616-V619 WeakPolarHBondContact O-CG2 3.41Å; V616-V619 PolarHBondContact O-N 3.41Å; V616-V635 HydrophobicContact CG2-CG1 4.5Å; V616-V635 HydrophobicContact CG2-CG2 4.08Å
617	Y	95.8	Very high	92.5	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.027	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-68.9	-10.9	179.3	-73.9	3.8	0	0	0	114.1	F393 M584 T613 Q615 V619 Y620 L658 L662	F393-Y617 AromaticContact CZ-CD2 3.97Å; F393-Y617 HydrophobicContact CZ-CD2 3.97Å; M584-Y617 VanDerWaalsContact CG-OH 3.24Å; M584-Y617 WeakPolarHBondContact CG-OH 2.76Å; M584-Y617 PolarHBondContact N-OH 2.88Å; T613-Y617 HydrophobicContact CG2-CD1 4.24Å; T613-Y617 HydrophobicContact CG2-CD2 4.12Å; T613-Y617 HydrophobicContact CG2-CE1 3.84Å; T613-Y617 HydrophobicContact CG2-CE2 3.75Å; T613-Y617 HydrophobicContact CG2-CG 4.38Å; T613-Y617 WeakPolarHBondContact O-CB 3.26Å; T613-Y617 PolarHBondContact O-N 3.47Å; Q615-Y617 VanDerWaalsContact C-N 3.25Å; Q615-Y617 PolarHBondContact O-N 2.99Å; Y617-V619 PolarHBondContact O-N 3.2Å; Y617-Y620 PolarHBondContact O-N 3.15Å; Y617-L658 HydrophobicContact CD2-CD1 3.81Å; Y617-L658 HydrophobicContact CD2-CD2 3.91Å; Y617-L658 HydrophobicContact CD2-CG 4.42Å; Y617-L658 HydrophobicContact CE2-CD1 4.13Å; Y617-L658 HydrophobicContact CE2-CD2 4.06Å; Y617-L658 HydrophobicContact CG-CD2 4.36Å; Y617-L662 WeakPolarHBondContact O-CD1 3.39Å
618	Q	95.5	Very high	93.2	Very high	5 Å²	5	30.5 Å²	30.5	2%	0.023	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-59.6	-15.4	172.1	-61.5	-55.4	-49.2	0	0	113.2	R614 Q615 V616 Y620 A621 I631 N666	R614-Q618 PolarHBondContact O-NE2 3.3Å; R614-Q618 VanDerWaalsContact O-NE2 3.11Å; Q615-Q618 VanDerWaalsContact O-CB 3.25Å; Q615-Q618 WeakPolarHBondContact O-CB 3.48Å; Q615-Q618 VanDerWaalsContact O-CG 3.27Å; Q615-Q618 WeakPolarHBondContact O-CG 3.49Å; Q615-Q618 PolarHBondContact O-N 3.01Å; Q615-Q618 VanDerWaalsContact O-N 3.07Å; V616-Q618 PolarHBondContact O-N 2.95Å; Q618-Y620 PolarHBondContact O-N 3.46Å; Q618-A621 WeakPolarHBondContact O-CB 3.44Å; Q618-A621 PolarHBondContact O-N 3.24Å; Q618-I631 HydrophobicContact CB-CD1 4.1Å; Q618-I631 HydrophobicContact CG-CD1 4.12Å; Q618-N666 PolarHBondContact OE1-ND2 3.19Å
619	V	96.2	Very high	93.8	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.018	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.2	168.9	-58.4	0	0	0	0	113	V616 Y617 V628 L632 V640 L642 F688 C689	V616-V619 VanDerWaalsContact O-CG1 3.32Å; V616-V619 WeakPolarHBondContact O-CG1 3.13Å; V616-V619 VanDerWaalsContact O-CG2 3.31Å; V616-V619 WeakPolarHBondContact O-CG2 3.41Å; V616-V619 PolarHBondContact O-N 3.41Å; Y617-V619 PolarHBondContact O-N 3.2Å; V619-V628 HydrophobicContact CG1-CG1 3.73Å; V619-L632 HydrophobicContact CG1-CD1 4.18Å; V619-L632 HydrophobicContact CG1-CD2 4.26Å; V619-L632 HydrophobicContact CG1-CG 4.48Å; V619-V640 HydrophobicContact CG1-CG2 3.99Å; V619-L642 HydrophobicContact CB-CD2 3.82Å; V619-L642 HydrophobicContact CG2-CD2 3.76Å; V619-F688 HydrophobicContact CB-CD1 4.17Å; V619-F688 HydrophobicContact CB-CE1 4.39Å; V619-F688 WeakPolarHBondContact O-CB 3.41Å; V619-F688 VanDerWaalsContact O-CD1 3.31Å; V619-F688 WeakPolarHBondContact O-CD1 3.45Å; V619-C689 WeakPolarHBondContact O-CB 3.27Å; V619-C689 PolarHBondContact O-N 2.77Å; V619-C689 VanDerWaalsContact O-N 3.14Å
620	Y	95.6	Very high	94.2	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.008	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-97	-2.1	174.9	-61	-67.5	0	0	0	113.1	Y617 Q618 E643 I646 C647 L658 R687 C689	Y617-Y620 PolarHBondContact O-N 3.15Å; Q618-Y620 PolarHBondContact O-N 3.46Å; Y620-E643 PolarHBondContact OH-N 2.93Å; Y620-E643 VanDerWaalsContact OH-N 3.11Å; Y620-I646 HydrophobicContact CD1-CB 4.25Å; Y620-I646 HydrophobicContact CD1-CG2 3.69Å; Y620-I646 HydrophobicContact CD2-CG2 3.78Å; Y620-I646 HydrophobicContact CE1-CB 3.79Å; Y620-I646 HydrophobicContact CE1-CG2 3.67Å; Y620-I646 HydrophobicContact CE2-CB 4.36Å; Y620-I646 HydrophobicContact CE2-CD1 4.2Å; Y620-I646 HydrophobicContact CE2-CG2 3.75Å; Y620-I646 HydrophobicContact CG-CG2 3.75Å; Y620-C647 HydrophobicContact CD1-CB 4.28Å; Y620-C647 HydrophobicContact CE1-CB 4.35Å; Y620-L658 HydrophobicContact CD2-CD2 4.28Å; Y620-R687 WeakPolarHBondContact O-CD 3.31Å; Y620-R687 WeakPolarHBondContact O-CG 3.5Å; Y620-R687 PolarHBondContact O-NH1 2.99Å; Y620-C689 HydrophobicContact CD1-CB 3.87Å; Y620-C689 HydrophobicContact CE1-CB 4.3Å
621	A	94.4	Very high	94.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	-90.8	173.8	-179.5	0	0	0	0	0	112.7	Q618 R623 L662 F688	Q618-A621 WeakPolarHBondContact O-CB 3.44Å; Q618-A621 PolarHBondContact O-N 3.24Å; A621-R623 HydrophobicContact CB-CG 4.02Å; A621-R623 PolarHBondContact O-N 3.48Å; A621-L662 HydrophobicContact CB-CB 4.14Å; A621-L662 HydrophobicContact CB-CD1 4.42Å; A621-F688 PolarHBondContact O-N 2.99Å
622	R	93.1	Very high	94.9	Very high	64 Å²	64	26.6 Å²	26.6	24%	0.242	12%	0.121	C	C	.	.	S	Bend	trans	-87.3	82.9	172.9	-70.5	165.4	166.2	-88.4	5.7	110.2	H668 D671 A683 R687	R622-H668 PolarHBondContact O-CE1 3.37Å; R622-D671 IonicContact CZ-OD1 3.96Å; R622-D671 IonicContact NE-OD1 3.17Å; R622-D671 PolarHBondContact NE-OD1 3.39Å; R622-D671 IonicContact NH2-OD1 2.66Å; R622-D671 PolarHBondContact NH2-OD1 3.02Å; R622-A683 HydrophobicContact CB-CB 3.6Å; R622-A683 HydrophobicContact CG-CB 4.16Å; R622-R687 HydrophobicContact CG-CB 4.28Å
623	R	93.4	Very high	95.1	Very high	58 Å²	58	28 Å²	28	22%	0.219	13%	0.128	C	C	.	.			trans	-136.1	156.1	-172	-70.5	-72.3	-171.6	174	-2.9	111.3	A621 E627 V628 N666	A621-R623 HydrophobicContact CB-CG 4.02Å; A621-R623 PolarHBondContact O-N 3.48Å; R623-E627 VanDerWaalsContact CD-OE2 3.24Å; R623-E627 WeakPolarHBondContact CD-OE2 3.41Å; R623-E627 IonicContact CZ-OE1 3.12Å; R623-E627 VanDerWaalsContact CZ-OE1 3.22Å; R623-E627 IonicContact CZ-OE2 3.04Å; R623-E627 IonicContact NE-OE1 3.54Å; R623-E627 IonicContact NE-OE2 3.91Å; R623-E627 VanDerWaalsContact NH1-CD 3.27Å; R623-E627 IonicContact NH1-OE1 3.79Å; R623-E627 PolarHBondContact NH1-OE1 3Å; R623-E627 IonicContact NH1-OE2 3.45Å; R623-E627 PolarHBondContact NH1-OE2 3.29Å; R623-V628 HydrophobicContact CB-CG2 3.84Å; R623-N666 PolarHBondContact NH2-OD1 3.01Å
624	S	94.9	Very high	95.2	Very high	18 Å²	18	31.4 Å²	31.4	13%	0.126	16%	0.155	C	C	.	.			trans	-70.7	152.4	177.5	70.1	0	0	0	0	111.6	E626 E627 V628	S624-E626 VanDerWaalsContact C-N 3.28Å; S624-E626 PolarHBondContact O-N 2.79Å; S624-E627 PolarHBondContact O-N 2.89Å; S624-E627 VanDerWaalsContact OG-CB 3.31Å; S624-E627 WeakPolarHBondContact OG-CB 3.32Å; S624-E627 PolarHBondContact OG-N 2.91Å; S624-V628 WeakPolarHBondContact O-CG2 3.43Å; S624-V628 PolarHBondContact O-N 3.47Å
625	P	95.3	Very high	95.2	Very high	7 Å²	7	29.2 Å²	29.2	5%	0.045	15%	0.149	C	C	.	.	H	α-helix	trans	-65	-30.4	178.3	23.2	-30.1	0	0	0	113.4	Y629 F688 A698 Y699 L702 F703	P625-Y629 VanDerWaalsContact O-CB 3.22Å; P625-Y629 WeakPolarHBondContact O-CB 3.35Å; P625-Y629 PolarHBondContact O-N 3.44Å; P625-F688 HydrophobicContact CB-CE2 4.2Å; P625-A698 HydrophobicContact CG-CB 4.09Å; P625-Y699 HydrophobicContact CB-CD1 3.69Å; P625-Y699 HydrophobicContact CB-CE1 3.7Å; P625-Y699 HydrophobicContact CB-CG 4.22Å; P625-Y699 HydrophobicContact CG-CD1 4.31Å; P625-Y699 HydrophobicContact CG-CE1 4.09Å; P625-Y699 HydrophobicContact CG-CE2 4.34Å; P625-L702 HydrophobicContact CB-CD1 4.28Å; P625-F703 HydrophobicContact CB-CE2 4.47Å
626	E	95.4	Very high	95.3	Very high	68 Å²	68	26.9 Å²	26.9	32%	0.318	14%	0.142	S	C	.	.	H	α-helix	trans	-64.5	-46.5	174.8	-69.4	69.7	-153.5	0	0	111.9	S624 Y629 D630 R701 L702	S624-E626 VanDerWaalsContact C-N 3.28Å; S624-E626 PolarHBondContact O-N 2.79Å; E626-Y629 PolarHBondContact O-N 3.42Å; E626-D630 PolarHBondContact O-N 2.92Å; E626-R701 IonicContact OE1-CZ 3.77Å; E626-R701 IonicContact OE1-NH2 2.84Å; E626-R701 PolarHBondContact OE1-NH2 3.06Å; E626-L702 HydrophobicContact CG-CD1 4.22Å
627	E	95.1	Very high	95.3	Very high	70 Å²	70	26.9 Å²	26.9	33%	0.327	14%	0.142	S	C	.	.	H	α-helix	trans	-64.5	-46.9	-179.1	-171.8	180	170.2	0	0	111	R623 S624 Y629 D630 I631	R623-E627 VanDerWaalsContact CD-OE2 3.24Å; R623-E627 WeakPolarHBondContact CD-OE2 3.41Å; R623-E627 IonicContact CZ-OE1 3.12Å; R623-E627 VanDerWaalsContact CZ-OE1 3.22Å; R623-E627 IonicContact CZ-OE2 3.04Å; R623-E627 IonicContact NE-OE1 3.54Å; R623-E627 IonicContact NE-OE2 3.91Å; R623-E627 VanDerWaalsContact NH1-CD 3.27Å; R623-E627 IonicContact NH1-OE1 3.79Å; R623-E627 PolarHBondContact NH1-OE1 3Å; R623-E627 IonicContact NH1-OE2 3.45Å; R623-E627 PolarHBondContact NH1-OE2 3.29Å; S624-E627 PolarHBondContact O-N 2.89Å; S624-E627 VanDerWaalsContact OG-CB 3.31Å; S624-E627 WeakPolarHBondContact OG-CB 3.32Å; S624-E627 PolarHBondContact OG-N 2.91Å; E627-Y629 VanDerWaalsContact C-N 3.31Å; E627-Y629 PolarHBondContact O-N 2.9Å; E627-D630 PolarHBondContact O-N 2.84Å; E627-I631 HydrophobicContact CG-CD1 4.14Å; E627-I631 VanDerWaalsContact O-CG1 3.3Å; E627-I631 WeakPolarHBondContact O-CG1 3.36Å; E627-I631 PolarHBondContact O-N 3.11Å
628	V	96.4	Very high	95.4	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-39.4	176.9	176.2	0	0	0	0	111.3	V619 R623 S624 I631 L632 F688	V619-V628 HydrophobicContact CG1-CG1 3.73Å; R623-V628 HydrophobicContact CB-CG2 3.84Å; S624-V628 WeakPolarHBondContact O-CG2 3.43Å; S624-V628 PolarHBondContact O-N 3.47Å; V628-I631 PolarHBondContact O-N 2.97Å; V628-L632 HydrophobicContact CG1-CD1 3.91Å; V628-L632 HydrophobicContact CG1-CG 4.35Å; V628-L632 WeakPolarHBondContact O-CB 3.4Å; V628-L632 VanDerWaalsContact O-CG 3.27Å; V628-L632 WeakPolarHBondContact O-CG 3.43Å; V628-L632 PolarHBondContact O-N 3.45Å; V628-F688 HydrophobicContact CB-CD2 3.94Å; V628-F688 HydrophobicContact CB-CE2 3.77Å; V628-F688 HydrophobicContact CB-CG 4.46Å; V628-F688 HydrophobicContact CB-CZ 4.13Å; V628-F688 HydrophobicContact CG1-CD1 4.18Å; V628-F688 HydrophobicContact CG1-CD2 4.12Å; V628-F688 HydrophobicContact CG1-CE1 3.83Å; V628-F688 HydrophobicContact CG1-CE2 3.77Å; V628-F688 HydrophobicContact CG1-CG 4.31Å; V628-F688 HydrophobicContact CG1-CZ 3.6Å; V628-F688 HydrophobicContact CG2-CB 4.41Å; V628-F688 HydrophobicContact CG2-CD2 3.75Å; V628-F688 HydrophobicContact CG2-CE2 4.13Å; V628-F688 HydrophobicContact CG2-CG 4.02Å
629	Y	97	Very high	95.5	Very high	8 Å²	8	29.6 Å²	29.6	3%	0.031	16%	0.156	C	C	.	.	H	α-helix	trans	-62.4	-46	175.7	176.3	-86.8	0	0	0	112.1	P625 E626 E627 L632 K633 L702 F703 L717 K718 K720	P625-Y629 VanDerWaalsContact O-CB 3.22Å; P625-Y629 WeakPolarHBondContact O-CB 3.35Å; P625-Y629 PolarHBondContact O-N 3.44Å; E626-Y629 PolarHBondContact O-N 3.42Å; E627-Y629 VanDerWaalsContact C-N 3.31Å; E627-Y629 PolarHBondContact O-N 2.9Å; Y629-L632 PolarHBondContact O-N 2.99Å; Y629-K633 HydrophobicContact CD1-CG 4.21Å; Y629-K633 HydrophobicContact CE1-CG 3.67Å; Y629-K633 HydrophobicContact CE2-CG 4.3Å; Y629-K633 WeakPolarHBondContact O-CB 3.37Å; Y629-K633 WeakPolarHBondContact O-CG 3.33Å; Y629-K633 PolarHBondContact O-N 3.15Å; Y629-K633 WeakPolarHBondContact OH-CE 3.22Å; Y629-L702 HydrophobicContact CD1-CD2 4.27Å; Y629-L702 HydrophobicContact CD2-CB 3.78Å; Y629-L702 HydrophobicContact CD2-CD2 4.11Å; Y629-L702 HydrophobicContact CD2-CG 4.39Å; Y629-L702 HydrophobicContact CE2-CB 4.37Å; Y629-L702 HydrophobicContact CE2-CD2 4.33Å; Y629-L702 HydrophobicContact CG-CB 4.24Å; Y629-L702 HydrophobicContact CG-CD1 4.31Å; Y629-L702 HydrophobicContact CG-CD2 4.07Å; Y629-L702 HydrophobicContact CG-CG 4.44Å; Y629-F703 HydrophobicContact CD2-CE1 4.37Å; Y629-F703 HydrophobicContact CD2-CZ 4.15Å; Y629-F703 HydrophobicContact CG-CZ 4.48Å; Y629-L717 HydrophobicContact CD2-CD2 4.22Å; Y629-L717 HydrophobicContact CD2-CG 4.4Å; Y629-L717 HydrophobicContact CE2-CB 4.18Å; Y629-L717 HydrophobicContact CE2-CD2 4.34Å; Y629-L717 HydrophobicContact CE2-CG 4.45Å; Y629-K718 WeakPolarHBondContact CE2-O 3.47Å; Y629-K718 PolarHBondContact OH-O 3.32Å; Y629-K720 HydrophobicContact CE1-CD 4.38Å; Y629-K720 HydrophobicContact CE1-CG 4.23Å
630	D	96.7	Very high	95.6	Very high	77 Å²	77	29.5 Å²	29.5	41%	0.412	16%	0.155	S	C	.	.	H	α-helix	trans	-67	-38.6	-179.6	-74.4	-25.5	0	0	0	111.1	E626 E627 K633 A634 K720	E626-D630 PolarHBondContact O-N 2.92Å; E627-D630 PolarHBondContact O-N 2.84Å; D630-K633 PolarHBondContact O-N 2.8Å; D630-A634 WeakPolarHBondContact O-CB 3.45Å; D630-A634 PolarHBondContact O-N 3.02Å; D630-K720 IonicContact OD1-NZ 3.58Å; D630-K720 PolarHBondContact OD1-NZ 3.08Å
631	I	96.3	Very high	95.7	Very high	21 Å²	21	29.4 Å²	29.4	11%	0.108	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-53.3	171.4	-70.8	166.2	0	0	0	110.9	Q615 Q618 E627 V628 K633 A634 V635	Q615-I631 HydrophobicContact CB-CG2 3.85Å; Q615-I631 WeakPolarHBondContact O-CG2 3.35Å; Q618-I631 HydrophobicContact CB-CD1 4.1Å; Q618-I631 HydrophobicContact CG-CD1 4.12Å; E627-I631 HydrophobicContact CG-CD1 4.14Å; E627-I631 VanDerWaalsContact O-CG1 3.3Å; E627-I631 WeakPolarHBondContact O-CG1 3.36Å; E627-I631 PolarHBondContact O-N 3.11Å; V628-I631 PolarHBondContact O-N 2.97Å; I631-K633 VanDerWaalsContact C-N 3.28Å; I631-K633 PolarHBondContact O-N 3.03Å; I631-A634 WeakPolarHBondContact O-CB 3.3Å; I631-A634 PolarHBondContact O-N 3Å; I631-A634 VanDerWaalsContact O-N 3.12Å; I631-V635 PolarHBondContact O-N 3.07Å
632	L	96.8	Very high	95.8	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-62.7	-35.5	-178.1	-72.1	173.3	0	0	0	111.8	A581 V619 V628 Y629 V635 G636 A637 V640 F703 L717	A581-L632 HydrophobicContact CB-CD2 3.76Å; V619-L632 HydrophobicContact CG1-CD1 4.18Å; V619-L632 HydrophobicContact CG1-CD2 4.26Å; V619-L632 HydrophobicContact CG1-CG 4.48Å; V628-L632 HydrophobicContact CG1-CD1 3.91Å; V628-L632 HydrophobicContact CG1-CG 4.35Å; V628-L632 WeakPolarHBondContact O-CB 3.4Å; V628-L632 VanDerWaalsContact O-CG 3.27Å; V628-L632 WeakPolarHBondContact O-CG 3.43Å; V628-L632 PolarHBondContact O-N 3.45Å; Y629-L632 PolarHBondContact O-N 2.99Å; L632-V635 WeakPolarHBondContact O-CG2 3.29Å; L632-G636 PolarHBondContact O-N 2.94Å; L632-G636 VanDerWaalsContact O-N 3.14Å; L632-A637 HydrophobicContact CB-CB 4.24Å; L632-A637 HydrophobicContact CD2-CB 4.33Å; L632-A637 WeakPolarHBondContact O-CB 3.02Å; L632-A637 PolarHBondContact O-N 3.25Å; L632-V640 HydrophobicContact CD1-CB 4.03Å; L632-V640 HydrophobicContact CD1-CG1 4.12Å; L632-V640 HydrophobicContact CD1-CG2 4.24Å; L632-V640 HydrophobicContact CD2-CG2 4.41Å; L632-F703 HydrophobicContact CD1-CE1 3.98Å; L632-F703 HydrophobicContact CD1-CZ 4.42Å; L632-L717 HydrophobicContact CB-CD2 3.52Å; L632-L717 HydrophobicContact CD1-CD1 4.34Å; L632-L717 HydrophobicContact CD1-CD2 4.25Å
633	K	95.4	Very high	95.9	Very high	53 Å²	53	27.3 Å²	27.3	23%	0.23	15%	0.148	C	C	.	.	H	α-helix	trans	-71.1	-37	172.8	-75.3	-56.4	-177.7	-159	0	113.3	K126 Y629 D630 I631 V635 G636 A637 L717	K126-K633 PolarHBondContact NZ-O 3.46Å; Y629-K633 HydrophobicContact CD1-CG 4.21Å; Y629-K633 HydrophobicContact CE1-CG 3.67Å; Y629-K633 HydrophobicContact CE2-CG 4.3Å; Y629-K633 WeakPolarHBondContact O-CB 3.37Å; Y629-K633 WeakPolarHBondContact O-CG 3.33Å; Y629-K633 PolarHBondContact O-N 3.15Å; Y629-K633 WeakPolarHBondContact OH-CE 3.22Å; D630-K633 PolarHBondContact O-N 2.8Å; I631-K633 VanDerWaalsContact C-N 3.28Å; I631-K633 PolarHBondContact O-N 3.03Å; K633-V635 VanDerWaalsContact C-N 3.28Å; K633-V635 PolarHBondContact O-N 3.35Å; K633-G636 PolarHBondContact O-N 2.99Å; K633-A637 PolarHBondContact NZ-O 3.39Å; K633-L717 HydrophobicContact CD-CD2 4.05Å; K633-L717 HydrophobicContact CG-CD2 4.15Å
634	A	94.5	Very high	95.9	Very high	70 Å²	70	26.2 Å²	26.2	58%	0.579	15%	0.147	S	C	*	.	H	α-helix	trans	-59.7	-41.6	174.5	0	0	0	0	0	110.9	K126 D630 I631 G636	K126-A634 PolarHBondContact NZ-O 3.44Å; D630-A634 WeakPolarHBondContact O-CB 3.45Å; D630-A634 PolarHBondContact O-N 3.02Å; I631-A634 WeakPolarHBondContact O-CB 3.3Å; I631-A634 PolarHBondContact O-N 3Å; I631-A634 VanDerWaalsContact O-N 3.12Å; A634-G636 VanDerWaalsContact C-N 3.27Å; A634-G636 PolarHBondContact O-N 2.84Å
635	V	93.4	Very high	95.8	Very high	16 Å²	16	28.3 Å²	28.3	10%	0.097	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	1.3	174.2	-54.9	0	0	0	0	114	S125 T599 R612 V616 I631 L632 K633 A637	S125-V635 PolarHBondContact OG-O 3.19Å; T599-V635 HydrophobicContact CG2-CB 4.4Å; T599-V635 HydrophobicContact CG2-CG2 3.89Å; R612-V635 HydrophobicContact CG-CB 4.38Å; R612-V635 HydrophobicContact CG-CG1 3.78Å; R612-V635 PolarHBondContact NH2-O 2.54Å; V616-V635 HydrophobicContact CG2-CG1 4.5Å; V616-V635 HydrophobicContact CG2-CG2 4.08Å; I631-V635 PolarHBondContact O-N 3.07Å; L632-V635 WeakPolarHBondContact O-CG2 3.29Å; K633-V635 VanDerWaalsContact C-N 3.28Å; K633-V635 PolarHBondContact O-N 3.35Å; V635-A637 HydrophobicContact CG2-CB 4.45Å
636	G	94.3	Very high	95.6	Very high	15 Å²	15	28.9 Å²	28.9	16%	0.155	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	22.4	173.2	0	0	0	0	0	116.1	V579 L632 K633 A634	V579-G636 VanDerWaalsContact CB-O 3.27Å; V579-G636 WeakPolarHBondContact CB-O 3.23Å; V579-G636 WeakPolarHBondContact CG1-O 2.94Å; L632-G636 PolarHBondContact O-N 2.94Å; L632-G636 VanDerWaalsContact O-N 3.14Å; K633-G636 PolarHBondContact O-N 2.99Å; A634-G636 VanDerWaalsContact C-N 3.27Å; A634-G636 PolarHBondContact O-N 2.84Å
637	A	96.8	Very high	95.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.15	C	C	.	.			trans	-72.8	138.7	178.7	0	0	0	0	0	112.6	A581 T599 L632 K633 V635	A581-A637 HydrophobicContact CB-CB 3.84Å; T599-A637 HydrophobicContact CG2-CB 4.01Å; L632-A637 HydrophobicContact CB-CB 4.24Å; L632-A637 HydrophobicContact CD2-CB 4.33Å; L632-A637 WeakPolarHBondContact O-CB 3.02Å; L632-A637 PolarHBondContact O-N 3.25Å; K633-A637 PolarHBondContact NZ-O 3.39Å; V635-A637 HydrophobicContact CG2-CB 4.45Å
638	D	97	Very high	95.3	Very high	56 Å²	56	26.5 Å²	26.5	30%	0.299	15%	0.15	S	C	.	.	S	Bend	trans	-97.5	-36	167.1	-68.5	-50.1	0	0	0	111.4	V579 L717	V579-D638 PolarHBondContact N-OD2 3.15Å; V579-D638 VanDerWaalsContact N-OD2 3.16Å; V579-D638 PolarHBondContact O-N 3.31Å; D638-L717 WeakPolarHBondContact O-CD1 3.27Å; D638-L717 PolarHBondContact O-N 2.81Å
639	Y	97.9	Very high	94.8	Very high	13 Å²	13	28.2 Å²	28.2	5%	0.051	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.5	-179.7	-63.5	-95.3	0	0	0	110.5	W569 T574 A578 V579 F580 A581 V714 Y715 K716	W569-Y639 HydrophobicContact CH2-CD1 4.26Å; W569-Y639 HydrophobicContact CH2-CE1 4.08Å; T574-Y639 HydrophobicContact CG2-CE1 4.21Å; T574-Y639 HydrophobicContact CG2-CE2 4.33Å; A578-Y639 HydrophobicContact CB-CD2 4.12Å; A578-Y639 HydrophobicContact CB-CE2 3.92Å; V579-Y639 PolarHBondContact O-N 3Å; V579-Y639 VanDerWaalsContact O-N 3.09Å; F580-Y639 HydrophobicContact CE1-CD2 4.46Å; F580-Y639 HydrophobicContact CE1-CG 4.04Å; F580-Y639 HydrophobicContact CE2-CD2 4.29Å; F580-Y639 HydrophobicContact CZ-CD2 4.13Å; F580-Y639 HydrophobicContact CZ-CG 4.12Å; A581-Y639 PolarHBondContact N-O 2.81Å; Y639-V714 HydrophobicContact CD1-CG1 3.96Å; Y639-Y715 CarbonylContact C-O 3.6Å; Y639-Y715 WeakPolarHBondContact CA-O 3.35Å; Y639-K716 HydrophobicContact CD1-CB 3.9Å; Y639-K716 HydrophobicContact CD1-CG 4.25Å; Y639-K716 HydrophobicContact CE1-CB 3.72Å; Y639-K716 HydrophobicContact CE1-CD 3.97Å; Y639-K716 HydrophobicContact CE1-CG 3.83Å
640	V	97.7	Very high	94.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	169.3	60.9	0	0	0	0	109.5	A581 V619 L632 L642 V714 Y715 L717	A581-V640 HydrophobicContact CB-CG2 4.46Å; A581-V640 CarbonylContact O-C 3.6Å; A581-V640 WeakPolarHBondContact O-CA 3.08Å; V619-V640 HydrophobicContact CG1-CG2 3.99Å; L632-V640 HydrophobicContact CD1-CB 4.03Å; L632-V640 HydrophobicContact CD1-CG1 4.12Å; L632-V640 HydrophobicContact CD1-CG2 4.24Å; L632-V640 HydrophobicContact CD2-CG2 4.41Å; V640-L642 HydrophobicContact CG2-CD2 4.02Å; V640-V714 WeakPolarHBondContact O-CA 3.44Å; V640-Y715 PolarHBondContact N-O 3.16Å; V640-Y715 PolarHBondContact O-N 2.96Å; V640-L717 HydrophobicContact CB-CD1 4.48Å; V640-L717 HydrophobicContact CG1-CD1 4.25Å
641	V	97.9	Very high	93.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.1	175.4	-168.7	0	0	0	0	108.6	L566 F580 A581 L586 I590 F712 V714	L566-V641 HydrophobicContact CD2-CG1 4.27Å; F580-V641 HydrophobicContact CD1-CG2 3.91Å; F580-V641 HydrophobicContact CE1-CG2 4.48Å; A581-V641 PolarHBondContact O-N 3.4Å; L586-V641 HydrophobicContact CD2-CB 4.17Å; L586-V641 HydrophobicContact CD2-CG1 3.6Å; I590-V641 HydrophobicContact CD1-CG2 4.15Å; V641-F712 HydrophobicContact CG1-CB 4.33Å; V641-F712 HydrophobicContact CG1-CD1 4.16Å; V641-V714 HydrophobicContact CG1-CG2 4.21Å; V641-V714 HydrophobicContact CG2-CG1 4.42Å; V641-V714 HydrophobicContact CG2-CG2 4.14Å
642	L	96.8	Very high	92.9	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.7	176.4	-57.8	-179	0	0	0	109.9	V619 V640 F688 C689 I692 Y713 Y715	V619-L642 HydrophobicContact CB-CD2 3.82Å; V619-L642 HydrophobicContact CG2-CD2 3.76Å; V640-L642 HydrophobicContact CG2-CD2 4.02Å; L642-F688 HydrophobicContact CD1-CE1 4.49Å; L642-C689 HydrophobicContact CD1-CB 4.38Å; L642-I692 HydrophobicContact CD1-CG2 3.64Å; L642-Y713 PolarHBondContact N-O 3.24Å; L642-Y713 PolarHBondContact O-N 3.4Å; L642-Y715 HydrophobicContact CD1-CD2 4.01Å; L642-Y715 HydrophobicContact CD1-CE2 3.81Å; L642-Y715 HydrophobicContact CG-CD2 4.41Å
643	E	95.6	Very high	92.3	Very high	17 Å²	17	55.6 Å²	55.6	8%	0.079	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.7	-178.1	-68.9	163.8	-98.4	0	0	110.5	S583 L586 Y620 S645 I646 C647 F712	S583-E643 WeakPolarHBondContact CB-OE1 3.27Å; S583-E643 PolarHBondContact OG-OE1 3.27Å; S583-E643 PolarHBondContact OG-OE2 3.45Å; L586-E643 HydrophobicContact CD2-CG 4.14Å; Y620-E643 PolarHBondContact OH-N 2.93Å; Y620-E643 VanDerWaalsContact OH-N 3.11Å; E643-S645 VanDerWaalsContact C-N 3.28Å; E643-S645 PolarHBondContact O-N 3.49Å; E643-I646 HydrophobicContact CB-CB 4.33Å; E643-I646 HydrophobicContact CB-CD1 4.15Å; E643-I646 HydrophobicContact CB-CG1 4.1Å; E643-I646 PolarHBondContact O-N 3.41Å; E643-C647 WeakPolarHBondContact O-CB 3.25Å; E643-C647 PolarHBondContact O-N 3.02Å; E643-F712 HydrophobicContact CG-CD1 3.77Å; E643-F712 HydrophobicContact CG-CE1 3.78Å
644	N	93.4	Very high	91.9	Very high	35 Å²	35	56.1 Å²	56.1	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-36.2	175.8	-84.4	-12.8	0	0	0	112.1	I646 C647 Y648 K693 K710 T711 Y713	N644-I646 VanDerWaalsContact C-N 3.27Å; N644-I646 PolarHBondContact O-N 3.23Å; N644-C647 PolarHBondContact O-N 2.97Å; N644-Y648 HydrophobicContact CB-CD2 4.23Å; N644-Y648 WeakPolarHBondContact O-CD2 3.31Å; N644-Y648 PolarHBondContact O-N 3.07Å; N644-K693 PolarHBondContact OD1-NZ 3.36Å; N644-K710 PolarHBondContact ND2-O 3.31Å; N644-T711 PolarHBondContact N-O 2.78Å; N644-Y713 WeakPolarHBondContact OD1-CE2 3.38Å
645	S	91.3	Very high	91.4	Very high	62 Å²	62	53.9 Å²	53.9	43%	0.434	24%	0.24	S	C	.	.	H	α-helix	trans	-55	-43.1	176.6	49.9	0	0	0	0	111.6	E643 E649	E643-S645 VanDerWaalsContact C-N 3.28Å; E643-S645 PolarHBondContact O-N 3.49Å; S645-E649 WeakPolarHBondContact O-CA 3.49Å; S645-E649 WeakPolarHBondContact O-CB 3.42Å; S645-E649 PolarHBondContact O-N 2.99Å
646	I	92.7	Very high	91.2	Very high	19 Å²	19	55.1 Å²	55.1	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-79.8	-45.6	179.7	-58.8	179.2	0	0	0	111.5	Y620 E643 N644 Y648 E649 L658	Y620-I646 HydrophobicContact CD1-CB 4.25Å; Y620-I646 HydrophobicContact CD1-CG2 3.69Å; Y620-I646 HydrophobicContact CD2-CG2 3.78Å; Y620-I646 HydrophobicContact CE1-CB 3.79Å; Y620-I646 HydrophobicContact CE1-CG2 3.67Å; Y620-I646 HydrophobicContact CE2-CB 4.36Å; Y620-I646 HydrophobicContact CE2-CD1 4.2Å; Y620-I646 HydrophobicContact CE2-CG2 3.75Å; Y620-I646 HydrophobicContact CG-CG2 3.75Å; E643-I646 HydrophobicContact CB-CB 4.33Å; E643-I646 HydrophobicContact CB-CD1 4.15Å; E643-I646 HydrophobicContact CB-CG1 4.1Å; E643-I646 PolarHBondContact O-N 3.41Å; N644-I646 VanDerWaalsContact C-N 3.27Å; N644-I646 PolarHBondContact O-N 3.23Å; I646-Y648 VanDerWaalsContact C-N 3.25Å; I646-Y648 PolarHBondContact O-N 2.88Å; I646-E649 WeakPolarHBondContact O-CB 3.37Å; I646-E649 PolarHBondContact O-N 2.84Å; I646-L658 HydrophobicContact CG2-CB 4.47Å; I646-L658 HydrophobicContact CG2-CD2 3.68Å
647	C	92.5	Very high	91	Very high	4 Å²	4	55.8 Å²	55.8	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-61.9	-35.8	-176.7	-171	0	0	0	0	112.1	Y620 E643 N644 R659 C689	Y620-C647 HydrophobicContact CD1-CB 4.28Å; Y620-C647 HydrophobicContact CE1-CB 4.35Å; E643-C647 WeakPolarHBondContact O-CB 3.25Å; E643-C647 PolarHBondContact O-N 3.02Å; N644-C647 PolarHBondContact O-N 2.97Å; C647-R659 PolarHBondContact O-NH1 3.19Å; C647-C689 VanDerWaalsContact CA-SG 3.57Å; C647-C689 HydrophobicContact CB-CB 3.81Å; C647-C689 WeakPolarHBondContact CB-SG 3.14Å; C647-C689 WeakPolarHBondContact SG-CB 3.3Å; C647-C689 CovalentContact SG-SG 2.04Å; C647-C689 PolarHBondContact SG-SG 3.06Å
648	Y	90.6	Very high	90.7	Very high	84 Å²	84	57.2 Å²	57.2	33%	0.329	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	9.8	-178.2	-55.2	-67.3	0	0	0	114.3	N644 I646 R650 R659 E690 K693	N644-Y648 HydrophobicContact CB-CD2 4.23Å; N644-Y648 WeakPolarHBondContact O-CD2 3.31Å; N644-Y648 PolarHBondContact O-N 3.07Å; I646-Y648 VanDerWaalsContact C-N 3.25Å; I646-Y648 PolarHBondContact O-N 2.88Å; Y648-R650 WeakPolarHBondContact O-CG 3.44Å; Y648-R650 PolarHBondContact O-N 3.33Å; Y648-R659 PolarHBondContact O-NH2 2.85Å; Y648-E690 HydrophobicContact CE1-CG 4.42Å; Y648-K693 PolarHBondContact OH-NZ 2.97Å; Y648-K693 VanDerWaalsContact OH-NZ 3.14Å
649	E	86	Confident	90.4	Very high	38 Å²	38	55.8 Å²	55.8	18%	0.178	25%	0.245	C	C	.	.			trans	-36.1	113	-175.6	-178.4	73.7	-137.3	0	0	114.6	S645 I646 R651 H652 R657 R659	S645-E649 WeakPolarHBondContact O-CA 3.49Å; S645-E649 WeakPolarHBondContact O-CB 3.42Å; S645-E649 PolarHBondContact O-N 2.99Å; I646-E649 WeakPolarHBondContact O-CB 3.37Å; I646-E649 PolarHBondContact O-N 2.84Å; E649-R651 WeakPolarHBondContact OE1-CB 3.31Å; E649-H652 IonicContact OE1-CE1 2.87Å; E649-H652 IonicContact OE1-ND1 3.66Å; E649-H652 PolarHBondContact OE1-ND1 2.89Å; E649-R657 HydrophobicContact CG-CB 4.32Å; E649-R657 HydrophobicContact CG-CG 4.32Å; E649-R657 VanDerWaalsContact O-CD 3.29Å; E649-R657 WeakPolarHBondContact O-CD 3.18Å; E649-R659 PolarHBondContact O-NH2 2.89Å
650	R	82.7	Confident	90	Very high	222 Å²	222	55.2 Å²	55.2	84%	0.838	24%	0.242	S	C	*	.			trans	-114.8	-7.1	178	-56.8	-168	179.6	173.6	-2.6	114.6	Y648	Y648-R650 WeakPolarHBondContact O-CG 3.44Å; Y648-R650 PolarHBondContact O-N 3.33Å
651	R	82.5	Confident	89.7	Confident	193 Å²	193	55.5 Å²	55.5	73%	0.728	24%	0.244	S	C	*	.	S	Bend	trans	-67	-45.4	-174.9	-178	-177.3	171.5	175.6	-3.2	111.3	E649	E649-R651 WeakPolarHBondContact OE1-CB 3.31Å
652	H	84.5	Confident	89.5	Confident	46 Å²	46	55.5 Å²	55.5	21%	0.213	24%	0.244	C	C	.	.	S	Bend	trans	-80.1	146	-179.3	-62.8	86.2	0	0	0	111.7	E649 C656 R657	E649-H652 IonicContact OE1-CE1 2.87Å; E649-H652 IonicContact OE1-ND1 3.66Å; E649-H652 PolarHBondContact OE1-ND1 2.89Å; H652-C656 HydrophobicContact CB-CB 4.33Å; H652-R657 HydrophobicContact CB-CG 3.92Å; H652-R657 VanDerWaalsContact O-CG 3.29Å; H652-R657 WeakPolarHBondContact O-CG 3.25Å
653	R	85.2	Confident	89.2	Confident	222 Å²	222	55.4 Å²	55.4	84%	0.838	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-63.2	154.7	173.7	-62.9	-177.9	-177.4	-175.3	0.8	110.4	G655 C656	R653-G655 PolarHBondContact O-N 3.14Å; R653-C656 PolarHBondContact O-N 3.45Å
654	R	86.1	Confident	88.9	Confident	64 Å²	64	55.8 Å²	55.8	24%	0.242	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	132.2	172.7	-177.3	172.4	-171.8	-98	2.7	109.8	D660 M670 D671 G672 P673 G674 E675 N676	R654-D660 WeakPolarHBondContact CA-OD2 3.42Å; R654-M670 PolarHBondContact NH2-O 3.27Å; R654-D671 PolarHBondContact NE-O 3.35Å; R654-G672 PolarHBondContact NE-O 2.74Å; R654-P673 VanDerWaalsContact CD-O 3.23Å; R654-P673 WeakPolarHBondContact CD-O 3.5Å; R654-G674 VanDerWaalsContact NH1-CA 3.31Å; R654-G674 PolarHBondContact NH1-O 3.09Å; R654-E675 PolarHBondContact NH1-O 2.81Å; R654-N676 PolarHBondContact NH2-ND2 3.41Å; R654-N676 PolarHBondContact NH2-OD1 2.68Å
655	G	85.1	Confident	88.7	Confident	22 Å²	22	55.1 Å²	55.1	23%	0.227	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	-14.1	-172.1	0	0	0	0	0	114.4	R653 D660 L661	R653-G655 PolarHBondContact O-N 3.14Å; G655-D660 PolarHBondContact N-OD2 3.45Å; G655-L661 VanDerWaalsContact O-CD2 3.25Å; G655-L661 WeakPolarHBondContact O-CD2 3.29Å
656	C	88.1	Confident	88.7	Confident	43 Å²	43	53.8 Å²	53.8	29%	0.291	23%	0.233	S	C	.	.	S	Bend	trans	-123.8	4.7	178.7	-81.9	0	0	0	0	114.9	C400 H652 R653	C400-C656 VanDerWaalsContact CA-SG 3.55Å; C400-C656 HydrophobicContact CB-CB 3.43Å; C400-C656 VanDerWaalsContact CB-CB 3.43Å; C400-C656 WeakPolarHBondContact CB-SG 3.45Å; C400-C656 WeakPolarHBondContact SG-CA 3.24Å; C400-C656 WeakPolarHBondContact SG-CB 3.48Å; C400-C656 CovalentContact SG-SG 2.05Å; C400-C656 PolarHBondContact SG-SG 3.33Å; H652-C656 HydrophobicContact CB-CB 4.33Å; R653-C656 PolarHBondContact O-N 3.45Å
657	R	90.6	Very high	88.5	Confident	29 Å²	29	53.5 Å²	53.5	11%	0.109	24%	0.235	C	C	.	.	S	Bend	trans	-77.8	141.6	169.6	-57.9	170	-64.5	-171.2	3.5	108.4	E649 H652 R659 D660 L661 D671	E649-R657 HydrophobicContact CG-CB 4.32Å; E649-R657 HydrophobicContact CG-CG 4.32Å; E649-R657 VanDerWaalsContact O-CD 3.29Å; E649-R657 WeakPolarHBondContact O-CD 3.18Å; H652-R657 HydrophobicContact CB-CG 3.92Å; H652-R657 VanDerWaalsContact O-CG 3.29Å; H652-R657 WeakPolarHBondContact O-CG 3.25Å; R657-R659 HydrophobicContact CB-CG 3.89Å; R657-R659 PolarHBondContact O-N 3.07Å; R657-R659 VanDerWaalsContact O-N 3.09Å; R657-D660 HydrophobicContact CB-CB 4.43Å; R657-D660 IonicContact CZ-OD1 3.72Å; R657-D660 IonicContact CZ-OD2 3.96Å; R657-D660 VanDerWaalsContact CZ-OD2 3.23Å; R657-D660 VanDerWaalsContact NE-CG 3.31Å; R657-D660 IonicContact NE-OD1 3.47Å; R657-D660 PolarHBondContact NE-OD1 3.42Å; R657-D660 IonicContact NE-OD2 2.62Å; R657-D660 PolarHBondContact NE-OD2 3.4Å; R657-D660 IonicContact NH2-OD1 3.96Å; R657-D660 PolarHBondContact NH2-OD1 3.34Å; R657-D660 IonicContact NH2-OD2 2.78Å; R657-D660 PolarHBondContact NH2-OD2 3.29Å; R657-D660 WeakPolarHBondContact O-CA 3.05Å; R657-D660 WeakPolarHBondContact O-CB 3.43Å; R657-D660 PolarHBondContact O-N 2.98Å; R657-L661 PolarHBondContact O-N 2.95Å; R657-L661 VanDerWaalsContact O-N 3.07Å; R657-D671 PolarHBondContact NH2-O 3.04Å
658	L	90.7	Very high	88.5	Confident	29 Å²	29	54.5 Å²	54.5	15%	0.152	24%	0.239	C	C	.	.	H	α-helix	trans	-51.9	-40.9	-179.7	180	62	0	0	0	112.6	F393 L397 Y617 Y620 I646 D660 L661 L662	F393-L658 HydrophobicContact CE2-CD1 3.9Å; F393-L658 HydrophobicContact CZ-CD1 3.8Å; L397-L658 HydrophobicContact CD1-CD1 4.16Å; Y617-L658 HydrophobicContact CD2-CD1 3.81Å; Y617-L658 HydrophobicContact CD2-CD2 3.91Å; Y617-L658 HydrophobicContact CD2-CG 4.42Å; Y617-L658 HydrophobicContact CE2-CD1 4.13Å; Y617-L658 HydrophobicContact CE2-CD2 4.06Å; Y617-L658 HydrophobicContact CG-CD2 4.36Å; Y620-L658 HydrophobicContact CD2-CD2 4.28Å; I646-L658 HydrophobicContact CG2-CB 4.47Å; I646-L658 HydrophobicContact CG2-CD2 3.68Å; L658-D660 VanDerWaalsContact C-N 3.35Å; L658-D660 PolarHBondContact O-N 3.3Å; L658-L661 WeakPolarHBondContact O-CB 3.01Å; L658-L661 PolarHBondContact O-N 3.38Å; L658-L662 HydrophobicContact CG-CD1 4.23Å; L658-L662 VanDerWaalsContact O-CG 3.31Å; L658-L662 WeakPolarHBondContact O-CG 3.49Å; L658-L662 PolarHBondContact O-N 3.39Å
659	R	90.7	Very high	88.4	Confident	27 Å²	27	53.2 Å²	53.2	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-38.9	174.2	54.1	177.4	166.8	-171.6	1.3	114.3	C647 Y648 E649 R657 L662 D663	C647-R659 PolarHBondContact O-NH1 3.19Å; Y648-R659 PolarHBondContact O-NH2 2.85Å; E649-R659 PolarHBondContact O-NH2 2.89Å; R657-R659 HydrophobicContact CB-CG 3.89Å; R657-R659 PolarHBondContact O-N 3.07Å; R657-R659 VanDerWaalsContact O-N 3.09Å; R659-L662 PolarHBondContact O-N 3.31Å; R659-D663 WeakPolarHBondContact O-CB 3.26Å; R659-D663 PolarHBondContact O-N 2.05Å
660	D	90.5	Very high	88.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-41.5	177.6	-62.2	-16.5	0	0	0	110.4	R654 G655 R657 L658 L662 D663 L664 M670	R654-D660 WeakPolarHBondContact CA-OD2 3.42Å; G655-D660 PolarHBondContact N-OD2 3.45Å; R657-D660 HydrophobicContact CB-CB 4.43Å; R657-D660 IonicContact CZ-OD1 3.72Å; R657-D660 IonicContact CZ-OD2 3.96Å; R657-D660 VanDerWaalsContact CZ-OD2 3.23Å; R657-D660 VanDerWaalsContact NE-CG 3.31Å; R657-D660 IonicContact NE-OD1 3.47Å; R657-D660 PolarHBondContact NE-OD1 3.42Å; R657-D660 IonicContact NE-OD2 2.62Å; R657-D660 PolarHBondContact NE-OD2 3.4Å; R657-D660 IonicContact NH2-OD1 3.96Å; R657-D660 PolarHBondContact NH2-OD1 3.34Å; R657-D660 IonicContact NH2-OD2 2.78Å; R657-D660 PolarHBondContact NH2-OD2 3.29Å; R657-D660 WeakPolarHBondContact O-CA 3.05Å; R657-D660 WeakPolarHBondContact O-CB 3.43Å; R657-D660 PolarHBondContact O-N 2.98Å; L658-D660 VanDerWaalsContact C-N 3.35Å; L658-D660 PolarHBondContact O-N 3.3Å; D660-L662 VanDerWaalsContact C-N 3.26Å; D660-L662 PolarHBondContact O-N 2.69Å; D660-D663 PolarHBondContact O-N 2.99Å; D660-L664 WeakPolarHBondContact O-CB 3.41Å; D660-L664 WeakPolarHBondContact O-CG 3.06Å; D660-L664 PolarHBondContact O-N 3.03Å; D660-M670 HydrophobicContact CB-CG 4.07Å; D660-M670 HydrophobicContact CB-SD 3.93Å
661	L	91.1	Very high	88.6	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-40.1	176.4	-59.8	-175.3	0	0	0	111.1	F393 L397 G655 R657 L658 A665	F393-L661 HydrophobicContact CD2-CB 3.94Å; F393-L661 HydrophobicContact CE2-CB 3.89Å; L397-L661 HydrophobicContact CD1-CD1 4.34Å; G655-L661 VanDerWaalsContact O-CD2 3.25Å; G655-L661 WeakPolarHBondContact O-CD2 3.29Å; R657-L661 PolarHBondContact O-N 2.95Å; R657-L661 VanDerWaalsContact O-N 3.07Å; L658-L661 WeakPolarHBondContact O-CB 3.01Å; L658-L661 PolarHBondContact O-N 3.38Å; L661-A665 WeakPolarHBondContact O-CB 3.29Å; L661-A665 PolarHBondContact O-N 3.37Å
662	L	92.1	Very high	88.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.3	-40.5	175.2	-67.5	166.5	0	0	0	112.2	F393 Y617 A621 L658 R659 D660 A665 N666	F393-L662 HydrophobicContact CD2-CD2 4.24Å; F393-L662 HydrophobicContact CE2-CD2 3.71Å; F393-L662 HydrophobicContact CE2-CG 4.03Å; F393-L662 HydrophobicContact CZ-CD2 4.24Å; Y617-L662 WeakPolarHBondContact O-CD1 3.39Å; A621-L662 HydrophobicContact CB-CB 4.14Å; A621-L662 HydrophobicContact CB-CD1 4.42Å; L658-L662 HydrophobicContact CG-CD1 4.23Å; L658-L662 VanDerWaalsContact O-CG 3.31Å; L658-L662 WeakPolarHBondContact O-CG 3.49Å; L658-L662 PolarHBondContact O-N 3.39Å; R659-L662 PolarHBondContact O-N 3.31Å; D660-L662 VanDerWaalsContact C-N 3.26Å; D660-L662 PolarHBondContact O-N 2.69Å; L662-A665 PolarHBondContact O-N 3.14Å; L662-N666 VanDerWaalsContact O-CB 3.29Å; L662-N666 WeakPolarHBondContact O-CB 3.35Å; L662-N666 VanDerWaalsContact O-CG 3.23Å; L662-N666 PolarHBondContact O-N 2.9Å; L662-N666 PolarHBondContact O-ND2 2.99Å
663	D	90.9	Very high	88.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-48.2	177.5	-66.8	-23.5	0	0	0	110	R659 D660 A665 N666 G667 H668 R687	R659-D663 WeakPolarHBondContact O-CB 3.26Å; R659-D663 PolarHBondContact O-N 2.05Å; D660-D663 PolarHBondContact O-N 2.99Å; D663-A665 PolarHBondContact O-N 3.18Å; D663-N666 CarbonylContact O-C 3.5Å; D663-N666 PolarHBondContact O-N 3.04Å; D663-N666 VanDerWaalsContact O-N 3.12Å; D663-G667 PolarHBondContact O-N 2.85Å; D663-H668 CarbonylContact C-O 3.53Å; D663-H668 HydrophobicContact CB-CB 4.12Å; D663-H668 PolarHBondContact O-N 3.25Å; D663-R687 IonicContact OD1-NH1 2.68Å; D663-R687 PolarHBondContact OD1-NH1 3.47Å; D663-R687 IonicContact OD1-NH2 3.53Å; D663-R687 IonicContact OD2-CZ 2.71Å; D663-R687 IonicContact OD2-NH1 3.1Å; D663-R687 IonicContact OD2-NH2 3.69Å; D663-R687 PolarHBondContact OD2-NH2 2.66Å
664	L	89.6	Confident	87.8	Confident	26 Å²	26	32.7 Å²	32.7	14%	0.136	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-44.5	175.1	-71.9	174.2	0	0	0	112.9	R391 D660 N666 G667 M670 L680	R391-L664 PolarHBondContact NE-O 2.9Å; R391-L664 PolarHBondContact NH2-O 3.08Å; D660-L664 WeakPolarHBondContact O-CB 3.41Å; D660-L664 WeakPolarHBondContact O-CG 3.06Å; D660-L664 PolarHBondContact O-N 3.03Å; L664-N666 PolarHBondContact O-N 3.11Å; L664-G667 PolarHBondContact O-N 3.38Å; L664-G667 VanDerWaalsContact O-N 3.13Å; L664-M670 HydrophobicContact CD1-SD 3.75Å; L664-M670 HydrophobicContact CD2-CE 3.99Å; L664-M670 HydrophobicContact CD2-CG 4.07Å; L664-M670 HydrophobicContact CD2-SD 3.89Å; L664-M670 HydrophobicContact CG-CG 3.96Å; L664-M670 HydrophobicContact CG-SD 3.75Å; L664-L680 HydrophobicContact CD2-CD1 3.71Å; L664-L680 HydrophobicContact CD2-CD2 4.34Å
665	A	89.4	Confident	87.3	Confident	21 Å²	21	38.7 Å²	38.7	17%	0.174	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-22.1	178.9	0	0	0	0	0	113.2	F393 R614 L661 L662 D663	F393-A665 HydrophobicContact CB-CB 4.05Å; F393-A665 HydrophobicContact CD2-CB 4.4Å; R614-A665 PolarHBondContact NH2-O 3.33Å; L661-A665 WeakPolarHBondContact O-CB 3.29Å; L661-A665 PolarHBondContact O-N 3.37Å; L662-A665 PolarHBondContact O-N 3.14Å; D663-A665 PolarHBondContact O-N 3.18Å
666	N	90.8	Very high	87.1	Confident	34 Å²	34	40.6 Å²	40.6	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-96.1	-5.1	174.5	-72.2	-40.4	0	0	0	113.2	Q618 R623 L662 D663 L664	Q618-N666 PolarHBondContact OE1-ND2 3.19Å; R623-N666 PolarHBondContact NH2-OD1 3.01Å; L662-N666 VanDerWaalsContact O-CB 3.29Å; L662-N666 WeakPolarHBondContact O-CB 3.35Å; L662-N666 VanDerWaalsContact O-CG 3.23Å; L662-N666 PolarHBondContact O-N 2.9Å; L662-N666 PolarHBondContact O-ND2 2.99Å; D663-N666 CarbonylContact O-C 3.5Å; D663-N666 PolarHBondContact O-N 3.04Å; D663-N666 VanDerWaalsContact O-N 3.12Å; L664-N666 PolarHBondContact O-N 3.11Å
667	G	89.2	Confident	86.6	Confident	12 Å²	12	42.1 Å²	42.1	12%	0.124	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	21.1	-176.8	0	0	0	0	0	115.2	R391 D663 L664 V681	R391-G667 VanDerWaalsContact NH2-CA 3.25Å; D663-G667 PolarHBondContact O-N 2.85Å; L664-G667 PolarHBondContact O-N 3.38Å; L664-G667 VanDerWaalsContact O-N 3.13Å; G667-V681 WeakPolarHBondContact O-CG2 3.24Å; G667-V681 PolarHBondContact O-N 3.18Å
668	H	91.4	Very high	86.1	Confident	25 Å²	25	47.4 Å²	47.4	12%	0.116	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-96.9	150.5	178.7	-59.5	159.5	0	0	0	112.7	R622 D663 V681 A683	R622-H668 PolarHBondContact O-CE1 3.37Å; D663-H668 CarbonylContact C-O 3.53Å; D663-H668 HydrophobicContact CB-CB 4.12Å; D663-H668 PolarHBondContact O-N 3.25Å; H668-V681 CarbonylContact C-O 3.57Å; H668-V681 VanDerWaalsContact CA-O 3.26Å; H668-V681 WeakPolarHBondContact CA-O 3.1Å; H668-A683 HydrophobicContact CB-CB 4.24Å
669	I	89.1	Confident	85.9	Confident	58 Å²	58	50.5 Å²	50.5	30%	0.297	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-63.6	134.7	170.6	-67.3	170.3	0	0	0	110.6	N676 L680 V681 P682	I669-N676 WeakPolarHBondContact CG2-ND2 3.2Å; I669-L680 HydrophobicContact CG1-CB 3.86Å; I669-V681 PolarHBondContact N-O 3.21Å; I669-P682 HydrophobicContact CD1-CG 3.91Å
670	M	89	Confident	85.7	Confident	21 Å²	21	49.9 Å²	49.9	10%	0.103	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-78.6	148.4	179.2	-60.7	173.8	-76.1	0	0	112.7	R654 D660 L664	R654-M670 PolarHBondContact NH2-O 3.27Å; D660-M670 HydrophobicContact CB-CG 4.07Å; D660-M670 HydrophobicContact CB-SD 3.93Å; L664-M670 HydrophobicContact CD1-SD 3.75Å; L664-M670 HydrophobicContact CD2-CE 3.99Å; L664-M670 HydrophobicContact CD2-CG 4.07Å; L664-M670 HydrophobicContact CD2-SD 3.89Å; L664-M670 HydrophobicContact CG-CG 3.96Å; L664-M670 HydrophobicContact CG-SD 3.75Å
671	D	83.3	Confident	85.7	Confident	37 Å²	37	53.8 Å²	53.8	20%	0.198	32%	0.324	C	S	.	.	S	Bend	trans	-66	146.5	178.3	-67.1	-20.3	0	0	0	113.5	R622 R654 R657 R687	R622-D671 IonicContact CZ-OD1 3.96Å; R622-D671 IonicContact NE-OD1 3.17Å; R622-D671 PolarHBondContact NE-OD1 3.39Å; R622-D671 IonicContact NH2-OD1 2.66Å; R622-D671 PolarHBondContact NH2-OD1 3.02Å; R654-D671 PolarHBondContact NE-O 3.35Å; R657-D671 PolarHBondContact NH2-O 3.04Å; D671-R687 IonicContact OD1-NH2 3.7Å; D671-R687 IonicContact OD2-CZ 2.72Å; D671-R687 IonicContact OD2-NE 2.78Å; D671-R687 IonicContact OD2-NH2 2.72Å; D671-R687 PolarHBondContact OD2-NH2 3.13Å
672	G	80.5	Confident	85.5	Confident	50 Å²	50	58.5 Å²	58.5	52%	0.515	36%	0.355	S	S	.	.	S	Bend	trans	86.1	172.7	172.5	0	0	0	0	0	114.8	R654	R654-G672 PolarHBondContact NE-O 2.74Å
673	P	76.3	Confident	85.4	Confident	131 Å²	131	59.6 Å²	59.6	85%	0.851	37%	0.365	S	S	*	.	S	Bend	trans	-69	138.8	-175.7	28.8	-34.4	0	0	0	111.7	R654	R654-P673 VanDerWaalsContact CD-O 3.23Å; R654-P673 WeakPolarHBondContact CD-O 3.5Å
674	G	79.4	Confident	85.3	Confident	51 Å²	51	64.6 Å²	64.6	53%	0.526	40%	0.4	S	S	.	.	S	Bend	trans	147.9	167.6	173.6	0	0	0	0	0	112.3	R654	R654-G674 VanDerWaalsContact NH1-CA 3.31Å; R654-G674 PolarHBondContact NH1-O 3.09Å
675	E	75.8	Confident	85.5	Confident	189 Å²	189	67 Å²	67	88%	0.883	41%	0.41	S	S	*	.			trans	-69.6	146.6	178.5	-64	-178.8	175.2	0	0	111	R654	R654-E675 PolarHBondContact NH1-O 2.81Å
676	N	80.4	Confident	85.6	Confident	62 Å²	62	69.4 Å²	69.4	33%	0.332	42%	0.424	S	S	.	.			trans	-118.9	149.2	174.7	-69.7	-63.6	0	0	0	108.1	R654 I669 L680	R654-N676 PolarHBondContact NH2-ND2 3.41Å; R654-N676 PolarHBondContact NH2-OD1 2.68Å; I669-N676 WeakPolarHBondContact CG2-ND2 3.2Å; N676-L680 HydrophobicContact CB-CD1 4.21Å
677	E	78.8	Confident	85.8	Confident	75 Å²	75	68.2 Å²	68.2	35%	0.35	42%	0.416	S	S	.	.			trans	-59	138.7	168.1	-63.8	-176.5	172.1	0	0	109.1	R391 D679 L680	R391-E677 IonicContact NH1-OE2 3.31Å; E677-D679 WeakPolarHBondContact CB-OD1 3.31Å; E677-D679 PolarHBondContact O-N 2.98Å; E677-D679 VanDerWaalsContact O-N 3.11Å; E677-L680 HydrophobicContact CB-CD1 4.1Å; E677-L680 HydrophobicContact CB-CG 4.12Å; E677-L680 PolarHBondContact O-N 2.97Å
678	P	79	Confident	86.1	Confident	141 Å²	141	67.6 Å²	67.6	92%	0.916	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.5	-168.4	26.3	-35.4	0	0	0	114.1
679	D	85.9	Confident	86.2	Confident	93 Å²	93	66.4 Å²	66.4	50%	0.497	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	0	-179.4	69.3	-43.7	0	0	0	113.6	R391 E677	R391-D679 IonicContact CZ-OD2 2.97Å; R391-D679 IonicContact NH1-OD1 3.5Å; R391-D679 IonicContact NH1-OD2 3.46Å; R391-D679 PolarHBondContact NH1-OD2 3.47Å; E677-D679 WeakPolarHBondContact CB-OD1 3.31Å; E677-D679 PolarHBondContact O-N 2.98Å; E677-D679 VanDerWaalsContact O-N 3.11Å
680	L	86.5	Confident	86.5	Confident	14 Å²	14	68.6 Å²	68.6	7%	0.073	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-79.7	135.2	177.5	-62.8	175.8	0	0	0	111.7	L664 I669 N676 E677	L664-L680 HydrophobicContact CD2-CD1 3.71Å; L664-L680 HydrophobicContact CD2-CD2 4.34Å; I669-L680 HydrophobicContact CG1-CB 3.86Å; N676-L680 HydrophobicContact CB-CD1 4.21Å; E677-L680 HydrophobicContact CB-CD1 4.1Å; E677-L680 HydrophobicContact CB-CG 4.12Å; E677-L680 PolarHBondContact O-N 2.97Å
681	V	90.4	Very high	86.7	Confident	83 Å²	83	68.1 Å²	68.1	50%	0.503	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-103.8	150.7	-179	-64	0	0	0	0	112.4	G667 H668 I669 A683	G667-V681 WeakPolarHBondContact O-CG2 3.24Å; G667-V681 PolarHBondContact O-N 3.18Å; H668-V681 CarbonylContact C-O 3.57Å; H668-V681 VanDerWaalsContact CA-O 3.26Å; H668-V681 WeakPolarHBondContact CA-O 3.1Å; I669-V681 PolarHBondContact N-O 3.21Å; V681-A683 PolarHBondContact O-N 3.33Å
682	P	87.9	Confident	87.3	Confident	105 Å²	105	66.5 Å²	66.5	68%	0.682	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-62.3	134.4	168.3	-18.4	30.2	0	0	0	110.8	I669	I669-P682 HydrophobicContact CD1-CG 3.91Å
683	A	89.9	Confident	87.9	Confident	24 Å²	24	66 Å²	66	20%	0.198	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-71.7	141	177.1	0	0	0	0	0	111.6	R622 H668 V681 H685	R622-A683 HydrophobicContact CB-CB 3.6Å; R622-A683 HydrophobicContact CG-CB 4.16Å; H668-A683 HydrophobicContact CB-CB 4.24Å; V681-A683 PolarHBondContact O-N 3.33Å; A683-H685 VanDerWaalsContact C-N 3.34Å
684	S	89.7	Confident	88.4	Confident	105 Å²	105	64.5 Å²	64.5	73%	0.734	38%	0.377	S	S	*	.	S	Bend	trans	-75.6	-19.6	178.6	55.4	0	0	0	0	114.3
685	H	92.2	Very high	88.5	Confident	76 Å²	76	65.7 Å²	65.7	35%	0.352	37%	0.371	S	S	.	.	S	Bend	trans	-117.9	150.5	-175.7	-64.8	-68.1	0	0	0	111.7	A683	A683-H685 VanDerWaalsContact C-N 3.34Å
686	P	92.8	Very high	89.2	Confident	71 Å²	71	58.7 Å²	58.7	46%	0.461	35%	0.346	S	S	.	.			trans	-66.4	166.8	169.1	31.5	-36.2	0	0	0	110.6	F688 A691	P686-F688 PolarHBondContact O-N 3.33Å; P686-A691 HydrophobicContact CB-CB 4.07Å; P686-A691 HydrophobicContact CG-CB 3.71Å
687	R	93.7	Very high	89.7	Confident	9 Å²	9	63.6 Å²	63.6	3%	0.034	37%	0.366	C	S	.	.			trans	-67	126.3	176.6	-168.2	173.4	-63	-69.5	-0.5	110	Y620 R622 D663 D671 C689 E690 A691	Y620-R687 WeakPolarHBondContact O-CD 3.31Å; Y620-R687 WeakPolarHBondContact O-CG 3.5Å; Y620-R687 PolarHBondContact O-NH1 2.99Å; R622-R687 HydrophobicContact CG-CB 4.28Å; D663-R687 IonicContact OD1-NH1 2.68Å; D663-R687 PolarHBondContact OD1-NH1 3.47Å; D663-R687 IonicContact OD1-NH2 3.53Å; D663-R687 IonicContact OD2-CZ 2.71Å; D663-R687 IonicContact OD2-NH1 3.1Å; D663-R687 IonicContact OD2-NH2 3.69Å; D663-R687 PolarHBondContact OD2-NH2 2.66Å; D671-R687 IonicContact OD1-NH2 3.7Å; D671-R687 IonicContact OD2-CZ 2.72Å; D671-R687 IonicContact OD2-NE 2.78Å; D671-R687 IonicContact OD2-NH2 2.72Å; D671-R687 PolarHBondContact OD2-NH2 3.13Å; R687-C689 PolarHBondContact O-N 2.8Å; R687-E690 PolarHBondContact O-N 2.95Å; R687-A691 WeakPolarHBondContact O-CB 3.24Å; R687-A691 PolarHBondContact O-N 3.01Å
688	F	95.6	Very high	90.3	Very high	0 Å²	0	62 Å²	62	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.7	-46.6	-171	177.2	-87.1	0	0	0	112.6	V619 A621 P625 V628 L642 P686 E690 A691 I692 Y699 F703	V619-F688 HydrophobicContact CB-CD1 4.17Å; V619-F688 HydrophobicContact CB-CE1 4.39Å; V619-F688 WeakPolarHBondContact O-CB 3.41Å; V619-F688 VanDerWaalsContact O-CD1 3.31Å; V619-F688 WeakPolarHBondContact O-CD1 3.45Å; A621-F688 PolarHBondContact O-N 2.99Å; P625-F688 HydrophobicContact CB-CE2 4.2Å; V628-F688 HydrophobicContact CB-CD2 3.94Å; V628-F688 HydrophobicContact CB-CE2 3.77Å; V628-F688 HydrophobicContact CB-CG 4.46Å; V628-F688 HydrophobicContact CB-CZ 4.13Å; V628-F688 HydrophobicContact CG1-CD1 4.18Å; V628-F688 HydrophobicContact CG1-CD2 4.12Å; V628-F688 HydrophobicContact CG1-CE1 3.83Å; V628-F688 HydrophobicContact CG1-CE2 3.77Å; V628-F688 HydrophobicContact CG1-CG 4.31Å; V628-F688 HydrophobicContact CG1-CZ 3.6Å; V628-F688 HydrophobicContact CG2-CB 4.41Å; V628-F688 HydrophobicContact CG2-CD2 3.75Å; V628-F688 HydrophobicContact CG2-CE2 4.13Å; V628-F688 HydrophobicContact CG2-CG 4.02Å; L642-F688 HydrophobicContact CD1-CE1 4.49Å; P686-F688 PolarHBondContact O-N 3.33Å; F688-E690 PolarHBondContact O-N 3.12Å; F688-E690 VanDerWaalsContact O-N 3.1Å; F688-A691 PolarHBondContact O-N 3.42Å; F688-I692 HydrophobicContact CE1-CB 4.4Å; F688-I692 HydrophobicContact CE1-CD1 3.81Å; F688-I692 HydrophobicContact CE2-CD1 4.45Å; F688-I692 HydrophobicContact CZ-CB 4.46Å; F688-I692 HydrophobicContact CZ-CD1 3.59Å; F688-I692 HydrophobicContact CZ-CG1 4.47Å; F688-I692 WeakPolarHBondContact O-CB 3.27Å; F688-I692 VanDerWaalsContact O-CG2 3.27Å; F688-I692 WeakPolarHBondContact O-CG2 3.29Å; F688-I692 PolarHBondContact O-N 2.85Å; F688-Y699 HydrophobicContact CD2-CD1 4.38Å; F688-Y699 AromaticContact CD2-CE1 3.78Å; F688-Y699 HydrophobicContact CD2-CE1 3.78Å; F688-Y699 HydrophobicContact CE2-CD1 4.02Å; F688-Y699 AromaticContact CE2-CE1 3.88Å; F688-Y699 HydrophobicContact CE2-CE1 3.88Å; F688-F703 AromaticContact CE2-CE2 3.9Å; F688-F703 HydrophobicContact CE2-CE2 3.9Å; F688-F703 HydrophobicContact CE2-CZ 4.15Å; F688-F703 HydrophobicContact CZ-CD2 4.34Å; F688-F703 HydrophobicContact CZ-CE1 4.26Å; F688-F703 AromaticContact CZ-CE2 3.77Å; F688-F703 HydrophobicContact CZ-CE2 3.77Å; F688-F703 AromaticContact CZ-CZ 3.72Å; F688-F703 HydrophobicContact CZ-CZ 3.72Å
689	C	94.8	Very high	91	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.5	-21.1	-177.5	66.4	0	0	0	0	114.5	V619 Y620 L642 C647 R687 K693	V619-C689 WeakPolarHBondContact O-CB 3.27Å; V619-C689 PolarHBondContact O-N 2.77Å; V619-C689 VanDerWaalsContact O-N 3.14Å; Y620-C689 HydrophobicContact CD1-CB 3.87Å; Y620-C689 HydrophobicContact CE1-CB 4.3Å; L642-C689 HydrophobicContact CD1-CB 4.38Å; C647-C689 VanDerWaalsContact CA-SG 3.57Å; C647-C689 HydrophobicContact CB-CB 3.81Å; C647-C689 WeakPolarHBondContact CB-SG 3.14Å; C647-C689 WeakPolarHBondContact SG-CB 3.3Å; C647-C689 CovalentContact SG-SG 2.04Å; C647-C689 PolarHBondContact SG-SG 3.06Å; R687-C689 PolarHBondContact O-N 2.8Å; C689-K693 WeakPolarHBondContact O-CE 3.44Å
690	E	94.1	Very high	91.4	Very high	104 Å²	104	54.2 Å²	54.2	49%	0.486	32%	0.317	S	S	.	.	H	α-helix	trans	-93.2	-49	174.5	-176.6	173.1	-162.8	0	0	110.9	Y648 R687 F688 I692 K693	Y648-E690 HydrophobicContact CE1-CG 4.42Å; R687-E690 PolarHBondContact O-N 2.95Å; F688-E690 PolarHBondContact O-N 3.12Å; F688-E690 VanDerWaalsContact O-N 3.1Å; E690-I692 VanDerWaalsContact C-N 3.32Å; E690-I692 PolarHBondContact O-N 3.37Å; E690-K693 WeakPolarHBondContact O-CB 3.41Å; E690-K693 PolarHBondContact O-N 3.1Å; E690-K693 VanDerWaalsContact O-N 3.15Å
691	A	94.2	Very high	91.7	Very high	10 Å²	10	60.5 Å²	60.5	8%	0.083	34%	0.34	C	S	.	.	H	α-helix	trans	-64	-34	-175.3	0	0	0	0	0	113.3	P686 R687 F688 K693 T694 Y699	P686-A691 HydrophobicContact CB-CB 4.07Å; P686-A691 HydrophobicContact CG-CB 3.71Å; R687-A691 WeakPolarHBondContact O-CB 3.24Å; R687-A691 PolarHBondContact O-N 3.01Å; F688-A691 PolarHBondContact O-N 3.42Å; A691-K693 PolarHBondContact O-N 2.96Å; A691-K693 VanDerWaalsContact O-N 3.12Å; A691-T694 WeakPolarHBondContact O-CB 3.37Å; A691-T694 PolarHBondContact O-N 2.95Å; A691-T694 VanDerWaalsContact O-N 3.08Å; A691-T694 PolarHBondContact O-OG1 3.2Å; A691-Y699 HydrophobicContact CB-CE1 4.17Å; A691-Y699 HydrophobicContact CB-CE2 4.16Å; A691-Y699 WeakPolarHBondContact CB-OH 3.43Å
692	I	95.4	Very high	92	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.015	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-60.8	-23.1	177.9	-169.2	168.3	0	0	0	113.1	L642 F688 E690 T694 Y699 F703 Y715	L642-I692 HydrophobicContact CD1-CG2 3.64Å; F688-I692 HydrophobicContact CE1-CB 4.4Å; F688-I692 HydrophobicContact CE1-CD1 3.81Å; F688-I692 HydrophobicContact CE2-CD1 4.45Å; F688-I692 HydrophobicContact CZ-CB 4.46Å; F688-I692 HydrophobicContact CZ-CD1 3.59Å; F688-I692 HydrophobicContact CZ-CG1 4.47Å; F688-I692 WeakPolarHBondContact O-CB 3.27Å; F688-I692 VanDerWaalsContact O-CG2 3.27Å; F688-I692 WeakPolarHBondContact O-CG2 3.29Å; F688-I692 PolarHBondContact O-N 2.85Å; E690-I692 VanDerWaalsContact C-N 3.32Å; E690-I692 PolarHBondContact O-N 3.37Å; I692-T694 VanDerWaalsContact C-N 3.3Å; I692-T694 PolarHBondContact O-N 3.25Å; I692-Y699 HydrophobicContact CB-CD1 3.76Å; I692-Y699 HydrophobicContact CB-CE1 4.21Å; I692-Y699 HydrophobicContact CB-CG 4.49Å; I692-Y699 HydrophobicContact CG1-CD1 3.93Å; I692-Y699 HydrophobicContact CG1-CG 4.47Å; I692-F703 HydrophobicContact CD1-CB 4.05Å; I692-F703 HydrophobicContact CD1-CD1 4.33Å; I692-F703 HydrophobicContact CD1-CD2 4.11Å; I692-F703 HydrophobicContact CD1-CG 3.9Å; I692-Y715 HydrophobicContact CD1-CD1 3.7Å; I692-Y715 HydrophobicContact CD1-CD2 3.9Å; I692-Y715 HydrophobicContact CD1-CE1 3.88Å; I692-Y715 HydrophobicContact CD1-CE2 4.08Å; I692-Y715 HydrophobicContact CD1-CG 3.71Å; I692-Y715 HydrophobicContact CG1-CD1 4.03Å; I692-Y715 HydrophobicContact CG1-CE1 3.71Å; I692-Y715 HydrophobicContact CG1-CE2 4.29Å; I692-Y715 HydrophobicContact CG1-CG 4.46Å; I692-Y715 HydrophobicContact CG2-CE2 4.07Å
693	K	92.3	Very high	92.4	Very high	40 Å²	40	52.6 Å²	52.6	17%	0.174	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-78.4	-14	179.6	-59.7	175.1	-179.3	174.7	0	113.3	N644 Y648 C689 E690 A691 D695 Y713	N644-K693 PolarHBondContact OD1-NZ 3.36Å; Y648-K693 PolarHBondContact OH-NZ 2.97Å; Y648-K693 VanDerWaalsContact OH-NZ 3.14Å; C689-K693 WeakPolarHBondContact O-CE 3.44Å; E690-K693 WeakPolarHBondContact O-CB 3.41Å; E690-K693 PolarHBondContact O-N 3.1Å; E690-K693 VanDerWaalsContact O-N 3.15Å; A691-K693 PolarHBondContact O-N 2.96Å; A691-K693 VanDerWaalsContact O-N 3.12Å; K693-D695 PolarHBondContact O-N 2.79Å; K693-Y713 HydrophobicContact CD-CE1 4.29Å; K693-Y713 HydrophobicContact CG-CD1 4.48Å; K693-Y713 HydrophobicContact CG-CE1 4.44Å
694	T	87.4	Confident	92.7	Very high	99 Å²	99	54.2 Å²	54.2	61%	0.607	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-77.8	-1.7	-178.5	65.8	0	0	0	0	113.5	A691 I692 A696	A691-T694 WeakPolarHBondContact O-CB 3.37Å; A691-T694 PolarHBondContact O-N 2.95Å; A691-T694 VanDerWaalsContact O-N 3.08Å; A691-T694 PolarHBondContact O-OG1 3.2Å; I692-T694 VanDerWaalsContact C-N 3.3Å; I692-T694 PolarHBondContact O-N 3.25Å; T694-A696 PolarHBondContact O-N 3.18Å
695	D	81.9	Confident	93	Very high	76 Å²	76	53.6 Å²	53.6	41%	0.406	28%	0.278	S	S	.	.			trans	54.2	23.6	179.4	-67.5	-39.3	0	0	0	114	K693 T700 R705	K693-D695 PolarHBondContact O-N 2.79Å; D695-T700 HydrophobicContact CB-CG2 4.21Å; D695-T700 VanDerWaalsContact O-CG2 3.3Å; D695-T700 WeakPolarHBondContact O-CG2 3.48Å; D695-R705 IonicContact OD1-CZ 3.23Å; D695-R705 IonicContact OD1-NH1 2.73Å; D695-R705 PolarHBondContact OD1-NH1 3.37Å; D695-R705 VanDerWaalsContact OD1-NH1 3.12Å; D695-R705 IonicContact OD1-NH2 3.33Å; D695-R705 IonicContact OD2-CZ 2.69Å; D695-R705 IonicContact OD2-NH1 2.93Å; D695-R705 PolarHBondContact OD2-NH1 2.73Å; D695-R705 IonicContact OD2-NH2 3.23Å; D695-R705 PolarHBondContact OD2-NH2 2.91Å
696	A	91.2	Very high	93.2	Very high	43 Å²	43	52.5 Å²	52.5	36%	0.355	28%	0.277	S	S	.	.			trans	-62.5	148.1	175.8	0	0	0	0	0	112.4	T694 A698 Y699 T700	T694-A696 PolarHBondContact O-N 3.18Å; A696-A698 VanDerWaalsContact C-N 3.27Å; A696-A698 PolarHBondContact O-N 3.12Å; A696-A698 VanDerWaalsContact O-N 3.16Å; A696-Y699 HydrophobicContact CB-CD2 4.1Å; A696-Y699 PolarHBondContact O-N 3.12Å; A696-T700 PolarHBondContact O-N 3.15Å; A696-T700 PolarHBondContact O-OG1 3.48Å
697	E	90.5	Very high	93.4	Very high	164 Å²	164	49.9 Å²	49.9	77%	0.766	26%	0.258	S	S	*	.	H	α-helix	trans	-55.8	-38.9	-171.1	-168.1	-177	170.3	0	0	113.3	Y699 T700 R701	E697-Y699 PolarHBondContact O-N 2.83Å; E697-T700 WeakPolarHBondContact CA-OG1 3.35Å; E697-T700 PolarHBondContact O-N 2.95Å; E697-T700 PolarHBondContact O-OG1 3.04Å; E697-R701 VanDerWaalsContact O-CB 3.24Å; E697-R701 WeakPolarHBondContact O-CB 3.35Å; E697-R701 PolarHBondContact O-N 3.32Å
698	A	91.4	Very high	93.5	Very high	42 Å²	42	54.1 Å²	54.1	35%	0.347	28%	0.279	S	S	.	.	H	α-helix	trans	-57.3	-36.8	178	0	0	0	0	0	112.7	P625 A696	P625-A698 HydrophobicContact CG-CB 4.09Å; A696-A698 VanDerWaalsContact C-N 3.27Å; A696-A698 PolarHBondContact O-N 3.12Å; A696-A698 VanDerWaalsContact O-N 3.16Å
699	Y	93.8	Very high	93.6	Very high	19 Å²	19	54.9 Å²	54.9	8%	0.075	28%	0.283	C	S	.	.	H	α-helix	trans	-84.2	-47.1	179.6	-64.2	-94.1	0	0	0	111.5	P625 F688 A691 I692 A696 E697 R701 L702 F703	P625-Y699 HydrophobicContact CB-CD1 3.69Å; P625-Y699 HydrophobicContact CB-CE1 3.7Å; P625-Y699 HydrophobicContact CB-CG 4.22Å; P625-Y699 HydrophobicContact CG-CD1 4.31Å; P625-Y699 HydrophobicContact CG-CE1 4.09Å; P625-Y699 HydrophobicContact CG-CE2 4.34Å; F688-Y699 HydrophobicContact CD2-CD1 4.38Å; F688-Y699 AromaticContact CD2-CE1 3.78Å; F688-Y699 HydrophobicContact CD2-CE1 3.78Å; F688-Y699 HydrophobicContact CE2-CD1 4.02Å; F688-Y699 AromaticContact CE2-CE1 3.88Å; F688-Y699 HydrophobicContact CE2-CE1 3.88Å; A691-Y699 HydrophobicContact CB-CE1 4.17Å; A691-Y699 HydrophobicContact CB-CE2 4.16Å; A691-Y699 WeakPolarHBondContact CB-OH 3.43Å; I692-Y699 HydrophobicContact CB-CD1 3.76Å; I692-Y699 HydrophobicContact CB-CE1 4.21Å; I692-Y699 HydrophobicContact CB-CG 4.49Å; I692-Y699 HydrophobicContact CG1-CD1 3.93Å; I692-Y699 HydrophobicContact CG1-CG 4.47Å; A696-Y699 HydrophobicContact CB-CD2 4.1Å; A696-Y699 PolarHBondContact O-N 3.12Å; E697-Y699 PolarHBondContact O-N 2.83Å; Y699-R701 PolarHBondContact O-N 2.04Å; Y699-L702 PolarHBondContact O-N 2.71Å; Y699-F703 PolarHBondContact O-N 2.69Å
700	T	93.2	Very high	93.4	Very high	51 Å²	51	63.3 Å²	63.3	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-66.6	-21.4	-177.9	59.2	0	0	0	0	112.4	D695 A696 E697 L702 F703 K718	D695-T700 HydrophobicContact CB-CG2 4.21Å; D695-T700 VanDerWaalsContact O-CG2 3.3Å; D695-T700 WeakPolarHBondContact O-CG2 3.48Å; A696-T700 PolarHBondContact O-N 3.15Å; A696-T700 PolarHBondContact O-OG1 3.48Å; E697-T700 WeakPolarHBondContact CA-OG1 3.35Å; E697-T700 PolarHBondContact O-N 2.95Å; E697-T700 PolarHBondContact O-OG1 3.04Å; T700-L702 VanDerWaalsContact C-N 3.3Å; T700-L702 PolarHBondContact O-N 2.93Å; T700-F703 CarbonylContact C-O 3.54Å; T700-F703 VanDerWaalsContact O-O 3.09Å; T700-K718 VanDerWaalsContact O-CE 3.23Å; T700-K718 WeakPolarHBondContact O-CE 3.36Å; T700-K718 PolarHBondContact O-NZ 2.67Å
701	R	94.3	Very high	93.4	Very high	147 Å²	147	60.5 Å²	60.5	56%	0.555	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.3	169.9	-175.9	177.7	69.7	167.3	-0.1	113.4	E626 E697 Y699 K718	E626-R701 IonicContact OE1-CZ 3.77Å; E626-R701 IonicContact OE1-NH2 2.84Å; E626-R701 PolarHBondContact OE1-NH2 3.06Å; E697-R701 VanDerWaalsContact O-CB 3.24Å; E697-R701 WeakPolarHBondContact O-CB 3.35Å; E697-R701 PolarHBondContact O-N 3.32Å; Y699-R701 PolarHBondContact O-N 2.04Å; R701-K718 VanDerWaalsContact O-CD 3.27Å; R701-K718 WeakPolarHBondContact O-CD 3.23Å
702	L	95.3	Very high	93.6	Very high	18 Å²	18	60.3 Å²	60.3	9%	0.094	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-31	-172.8	-64.6	175.2	0	0	0	112.9	P625 E626 Y629 Y699 T700 K718	P625-L702 HydrophobicContact CB-CD1 4.28Å; E626-L702 HydrophobicContact CG-CD1 4.22Å; Y629-L702 HydrophobicContact CD1-CD2 4.27Å; Y629-L702 HydrophobicContact CD2-CB 3.78Å; Y629-L702 HydrophobicContact CD2-CD2 4.11Å; Y629-L702 HydrophobicContact CD2-CG 4.39Å; Y629-L702 HydrophobicContact CE2-CB 4.37Å; Y629-L702 HydrophobicContact CE2-CD2 4.33Å; Y629-L702 HydrophobicContact CG-CB 4.24Å; Y629-L702 HydrophobicContact CG-CD1 4.31Å; Y629-L702 HydrophobicContact CG-CD2 4.07Å; Y629-L702 HydrophobicContact CG-CG 4.44Å; Y699-L702 PolarHBondContact O-N 2.71Å; T700-L702 VanDerWaalsContact C-N 3.3Å; T700-L702 PolarHBondContact O-N 2.93Å; L702-K718 WeakPolarHBondContact O-CB 3.19Å; L702-K718 PolarHBondContact O-N 3.03Å
703	F	96.6	Very high	93.6	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	154.4	-174	-58.8	-83.3	0	0	0	111.2	P625 Y629 L632 F688 I692 Y699 T700 Y715 K716 L717	P625-F703 HydrophobicContact CB-CE2 4.47Å; Y629-F703 HydrophobicContact CD2-CE1 4.37Å; Y629-F703 HydrophobicContact CD2-CZ 4.15Å; Y629-F703 HydrophobicContact CG-CZ 4.48Å; L632-F703 HydrophobicContact CD1-CE1 3.98Å; L632-F703 HydrophobicContact CD1-CZ 4.42Å; F688-F703 AromaticContact CE2-CE2 3.9Å; F688-F703 HydrophobicContact CE2-CE2 3.9Å; F688-F703 HydrophobicContact CE2-CZ 4.15Å; F688-F703 HydrophobicContact CZ-CD2 4.34Å; F688-F703 HydrophobicContact CZ-CE1 4.26Å; F688-F703 AromaticContact CZ-CE2 3.77Å; F688-F703 HydrophobicContact CZ-CE2 3.77Å; F688-F703 AromaticContact CZ-CZ 3.72Å; F688-F703 HydrophobicContact CZ-CZ 3.72Å; I692-F703 HydrophobicContact CD1-CB 4.05Å; I692-F703 HydrophobicContact CD1-CD1 4.33Å; I692-F703 HydrophobicContact CD1-CD2 4.11Å; I692-F703 HydrophobicContact CD1-CG 3.9Å; Y699-F703 PolarHBondContact O-N 2.69Å; T700-F703 CarbonylContact C-O 3.54Å; T700-F703 VanDerWaalsContact O-O 3.09Å; F703-Y715 HydrophobicContact CB-CD1 4.24Å; F703-K716 CarbonylContact C-O 3.31Å; F703-K716 WeakPolarHBondContact CA-O 3.46Å; F703-L717 HydrophobicContact CD1-CD1 4.4Å; F703-L717 HydrophobicContact CD1-CG 4.15Å; F703-L717 HydrophobicContact CE1-CD1 4.26Å; F703-L717 HydrophobicContact CE1-CD2 4.46Å; F703-L717 HydrophobicContact CE1-CG 3.9Å
704	T	96.3	Very high	93.9	Very high	58 Å²	58	59.9 Å²	59.9	36%	0.356	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	119.9	172.8	-56.4	0	0	0	0	108.3	T706 Y715 K716 K718	T704-T706 PolarHBondContact O-N 2.79Å; T704-Y715 CarbonylContact O-C 3.59Å; T704-Y715 WeakPolarHBondContact O-CA 3.26Å; T704-K716 PolarHBondContact N-O 2.73Å; T704-K716 PolarHBondContact O-N 3.46Å; T704-K718 WeakPolarHBondContact OG1-CE 3.45Å
705	R	96.4	Very high	94.4	Very high	92 Å²	92	55.3 Å²	55.3	35%	0.347	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	122.9	174.9	-170.8	163.4	64.1	-131.3	-1.5	108.7	D695 Y715	D695-R705 IonicContact OD1-CZ 3.23Å; D695-R705 IonicContact OD1-NH1 2.73Å; D695-R705 PolarHBondContact OD1-NH1 3.37Å; D695-R705 VanDerWaalsContact OD1-NH1 3.12Å; D695-R705 IonicContact OD1-NH2 3.33Å; D695-R705 IonicContact OD2-CZ 2.69Å; D695-R705 IonicContact OD2-NH1 2.93Å; D695-R705 PolarHBondContact OD2-NH1 2.73Å; D695-R705 IonicContact OD2-NH2 3.23Å; D695-R705 PolarHBondContact OD2-NH2 2.91Å; R705-Y715 HydrophobicContact CB-CD1 3.91Å; R705-Y715 HydrophobicContact CB-CE1 3.65Å; R705-Y715 HydrophobicContact CG-CD1 4.49Å; R705-Y715 HydrophobicContact CG-CE1 4.03Å
706	T	96.3	Very high	95.1	Very high	52 Å²	52	56.3 Å²	56.3	32%	0.319	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-18.6	-177.3	54.9	0	0	0	0	113.6	W569 T704 V714 K716	W569-T706 WeakPolarHBondContact CH2-OG1 3.23Å; T704-T706 PolarHBondContact O-N 2.79Å; T706-V714 PolarHBondContact N-O 3.47Å; T706-V714 PolarHBondContact OG1-O 3Å; T706-K716 HydrophobicContact CG2-CB 3.71Å; T706-K716 HydrophobicContact CG2-CD 4.47Å
707	F	97.3	Very high	95.4	Very high	17 Å²	17	54.6 Å²	54.6	8%	0.075	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.2	174.5	177.7	-92.6	0	0	0	109.7	E565 L566 W569 N709 F712 V714	E565-F707 HydrophobicContact CB-CZ 4.36Å; E565-F707 HydrophobicContact CG-CE2 3.92Å; E565-F707 HydrophobicContact CG-CZ 3.86Å; L566-F707 HydrophobicContact CB-CE1 4.15Å; L566-F707 HydrophobicContact CB-CZ 4.32Å; L566-F707 HydrophobicContact CD1-CD1 3.85Å; L566-F707 HydrophobicContact CD1-CE1 3.83Å; W569-F707 HydrophobicContact CB-CD2 3.74Å; W569-F707 HydrophobicContact CB-CE2 3.8Å; W569-F707 AromaticContact CD1-CD2 3.62Å; W569-F707 HydrophobicContact CD2-CB 3.76Å; W569-F707 AromaticContact CD2-CD2 3.77Å; W569-F707 HydrophobicContact CD2-CD2 3.77Å; W569-F707 AromaticContact CD2-CG 3.97Å; W569-F707 HydrophobicContact CD2-CG 3.97Å; W569-F707 HydrophobicContact CE3-CB 3.96Å; W569-F707 HydrophobicContact CE3-CD2 4.37Å; W569-F707 HydrophobicContact CE3-CG 4.2Å; W569-F707 HydrophobicContact CG-CB 4.31Å; W569-F707 AromaticContact CG-CD2 3.41Å; W569-F707 HydrophobicContact CG-CD2 3.41Å; W569-F707 VanDerWaalsContact CG-CD2 3.41Å; W569-F707 HydrophobicContact CG-CE2 4.01Å; W569-F707 HydrophobicContact CG-CG 4.11Å; W569-F707 HydrophobicContact CH2-CB 4.19Å; W569-F707 HydrophobicContact CZ2-CB 3.97Å; W569-F707 HydrophobicContact CZ3-CB 4.18Å; F707-N709 HydrophobicContact CE1-CB 4.09Å; F707-N709 HydrophobicContact CZ-CB 4.03Å; F707-N709 WeakPolarHBondContact CZ-ND2 3.46Å; F707-F712 HydrophobicContact CE1-CB 4.38Å; F707-V714 HydrophobicContact CB-CB 3.89Å; F707-V714 HydrophobicContact CB-CG2 3.89Å; F707-V714 HydrophobicContact CD1-CG2 3.87Å; F707-V714 HydrophobicContact CG-CG2 4.27Å; F707-V714 PolarHBondContact N-O 3.43Å; F707-V714 PolarHBondContact O-N 3.4Å
708	Q	95.9	Very high	95.5	Very high	98 Å²	98	51 Å²	51	46%	0.458	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	132.2	173.7	172.9	178.9	-11.1	0	0	109	F712 Y713	Q708-F712 WeakPolarHBondContact CA-O 3.42Å; Q708-Y713 HydrophobicContact CB-CD1 4.22Å; Q708-Y713 HydrophobicContact CB-CE1 4.38Å; Q708-Y713 HydrophobicContact CG-CD1 3.77Å; Q708-Y713 HydrophobicContact CG-CE1 3.47Å; Q708-Y713 VanDerWaalsContact CG-CE1 3.47Å; Q708-Y713 HydrophobicContact CG-CG 4.47Å; Q708-Y713 VanDerWaalsContact NE2-CE1 3.33Å; Q708-Y713 PolarHBondContact NE2-OH 3.44Å
709	N	96.1	Very high	95.1	Very high	16 Å²	16	57.9 Å²	57.9	9%	0.086	27%	0.265	C	S	.	.			trans	-135.2	-163.2	161.2	68.5	10.7	0	0	0	110	D562 E565 F707 T711 F712	D562-N709 WeakPolarHBondContact CA-ND2 3.34Å; D562-N709 PolarHBondContact O-ND2 3.23Å; E565-N709 WeakPolarHBondContact OE2-CB 3.39Å; E565-N709 PolarHBondContact OE2-ND2 2.78Å; F707-N709 HydrophobicContact CE1-CB 4.09Å; F707-N709 HydrophobicContact CZ-CB 4.03Å; F707-N709 WeakPolarHBondContact CZ-ND2 3.46Å; N709-T711 VanDerWaalsContact C-N 3.27Å; N709-T711 PolarHBondContact O-N 2.73Å; N709-T711 PolarHBondContact OD1-N 3.13Å; N709-T711 VanDerWaalsContact OD1-N 3.15Å; N709-F712 PolarHBondContact N-O 2.62Å; N709-F712 PolarHBondContact OD1-N 3.18Å; N709-F712 PolarHBondContact OD1-O 3.21Å
710	K	92.3	Very high	93.9	Very high	176 Å²	176	63.6 Å²	63.6	77%	0.765	29%	0.29	S	S	*	.	S	Bend	trans	-65.6	-31.9	-175.9	-64.5	175.5	-179	174.1	0	112.4	D562 N644	D562-K710 WeakPolarHBondContact OD2-CB 3.22Å; N644-K710 PolarHBondContact ND2-O 3.31Å
711	T	93.9	Very high	91.8	Very high	45 Å²	45	72.8 Å²	72.8	28%	0.276	32%	0.319	S	S	.	.	S	Bend	trans	-103.4	-39.2	-173.1	-61	0	0	0	0	113	D562 N644 N709	D562-T711 WeakPolarHBondContact OD2-CB 3.18Å; D562-T711 PolarHBondContact OD2-N 2.89Å; D562-T711 PolarHBondContact OD2-OG1 3.23Å; N644-T711 PolarHBondContact N-O 2.78Å; N709-T711 VanDerWaalsContact C-N 3.27Å; N709-T711 PolarHBondContact O-N 2.73Å; N709-T711 PolarHBondContact OD1-N 3.13Å; N709-T711 VanDerWaalsContact OD1-N 3.15Å
712	F	96.8	Very high	89.3	Confident	7 Å²	7	75.5 Å²	75.5	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.4	-168.3	-52.9	-74.9	0	0	0	113.2	D562 T563 L566 L586 V641 E643 F707 Q708 N709	D562-F712 HydrophobicContact CB-CD2 4.42Å; D562-F712 HydrophobicContact CB-CE2 4.19Å; T563-F712 WeakPolarHBondContact OG1-CE2 3.35Å; T563-F712 WeakPolarHBondContact OG1-CZ 3.38Å; L566-F712 HydrophobicContact CB-CD2 4.13Å; L566-F712 HydrophobicContact CD2-CB 4.19Å; L566-F712 HydrophobicContact CD2-CD1 3.94Å; L566-F712 HydrophobicContact CD2-CD2 3.84Å; L566-F712 HydrophobicContact CD2-CE1 4.26Å; L566-F712 HydrophobicContact CD2-CE2 4.17Å; L566-F712 HydrophobicContact CD2-CG 3.72Å; L566-F712 HydrophobicContact CD2-CZ 4.36Å; L586-F712 HydrophobicContact CD1-CE1 3.96Å; L586-F712 HydrophobicContact CD1-CZ 4.17Å; L586-F712 HydrophobicContact CD2-CD1 3.89Å; L586-F712 HydrophobicContact CD2-CE1 3.68Å; L586-F712 HydrophobicContact CG-CE1 4.45Å; V641-F712 HydrophobicContact CG1-CB 4.33Å; V641-F712 HydrophobicContact CG1-CD1 4.16Å; E643-F712 HydrophobicContact CG-CD1 3.77Å; E643-F712 HydrophobicContact CG-CE1 3.78Å; F707-F712 HydrophobicContact CE1-CB 4.38Å; Q708-F712 WeakPolarHBondContact CA-O 3.42Å; N709-F712 PolarHBondContact N-O 2.62Å; N709-F712 PolarHBondContact OD1-N 3.18Å; N709-F712 PolarHBondContact OD1-O 3.21Å
713	Y	97.1	Very high	86.6	Confident	33 Å²	33	84.4 Å²	84.4	13%	0.129	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.7	170.4	-66.8	-108.3	0	0	0	109.1	L642 N644 K693 Q708	L642-Y713 PolarHBondContact N-O 3.24Å; L642-Y713 PolarHBondContact O-N 3.4Å; N644-Y713 WeakPolarHBondContact OD1-CE2 3.38Å; K693-Y713 HydrophobicContact CD-CE1 4.29Å; K693-Y713 HydrophobicContact CG-CD1 4.48Å; K693-Y713 HydrophobicContact CG-CE1 4.44Å; Q708-Y713 HydrophobicContact CB-CD1 4.22Å; Q708-Y713 HydrophobicContact CB-CE1 4.38Å; Q708-Y713 HydrophobicContact CG-CD1 3.77Å; Q708-Y713 HydrophobicContact CG-CE1 3.47Å; Q708-Y713 VanDerWaalsContact CG-CE1 3.47Å; Q708-Y713 HydrophobicContact CG-CG 4.47Å; Q708-Y713 VanDerWaalsContact NE2-CE1 3.33Å; Q708-Y713 PolarHBondContact NE2-OH 3.44Å
714	V	97.7	Very high	83.7	Confident	0 Å²	0	89.5 Å²	89.5	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.5	178.6	-170.3	0	0	0	0	110.2	L566 W569 F580 Y639 V640 V641 T706 F707	L566-V714 HydrophobicContact CD1-CG2 3.61Å; W569-V714 HydrophobicContact CH2-CB 4.38Å; W569-V714 HydrophobicContact CH2-CG1 4.02Å; W569-V714 HydrophobicContact CZ3-CB 4.22Å; W569-V714 HydrophobicContact CZ3-CG1 3.92Å; W569-V714 HydrophobicContact CZ3-CG2 4.21Å; F580-V714 HydrophobicContact CE1-CG1 4.44Å; Y639-V714 HydrophobicContact CD1-CG1 3.96Å; V640-V714 WeakPolarHBondContact O-CA 3.44Å; V641-V714 HydrophobicContact CG1-CG2 4.21Å; V641-V714 HydrophobicContact CG2-CG1 4.42Å; V641-V714 HydrophobicContact CG2-CG2 4.14Å; T706-V714 PolarHBondContact N-O 3.47Å; T706-V714 PolarHBondContact OG1-O 3Å; F707-V714 HydrophobicContact CB-CB 3.89Å; F707-V714 HydrophobicContact CB-CG2 3.89Å; F707-V714 HydrophobicContact CD1-CG2 3.87Å; F707-V714 HydrophobicContact CG-CG2 4.27Å; F707-V714 PolarHBondContact N-O 3.43Å; F707-V714 PolarHBondContact O-N 3.4Å
715	Y	97.6	Very high	80.8	Confident	4 Å²	4	89.9 Å²	89.9	2%	0.016	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.3	176.4	-63.7	-93.1	0	0	0	110.7	Y639 V640 L642 I692 F703 T704 R705	Y639-Y715 CarbonylContact C-O 3.6Å; Y639-Y715 WeakPolarHBondContact CA-O 3.35Å; V640-Y715 PolarHBondContact N-O 3.16Å; V640-Y715 PolarHBondContact O-N 2.96Å; L642-Y715 HydrophobicContact CD1-CD2 4.01Å; L642-Y715 HydrophobicContact CD1-CE2 3.81Å; L642-Y715 HydrophobicContact CG-CD2 4.41Å; I692-Y715 HydrophobicContact CD1-CD1 3.7Å; I692-Y715 HydrophobicContact CD1-CD2 3.9Å; I692-Y715 HydrophobicContact CD1-CE1 3.88Å; I692-Y715 HydrophobicContact CD1-CE2 4.08Å; I692-Y715 HydrophobicContact CD1-CG 3.71Å; I692-Y715 HydrophobicContact CG1-CD1 4.03Å; I692-Y715 HydrophobicContact CG1-CE1 3.71Å; I692-Y715 HydrophobicContact CG1-CE2 4.29Å; I692-Y715 HydrophobicContact CG1-CG 4.46Å; I692-Y715 HydrophobicContact CG2-CE2 4.07Å; F703-Y715 HydrophobicContact CB-CD1 4.24Å; T704-Y715 CarbonylContact O-C 3.59Å; T704-Y715 WeakPolarHBondContact O-CA 3.26Å; R705-Y715 HydrophobicContact CB-CD1 3.91Å; R705-Y715 HydrophobicContact CB-CE1 3.65Å; R705-Y715 HydrophobicContact CG-CD1 4.49Å; R705-Y715 HydrophobicContact CG-CE1 4.03Å
716	K	97.3	Very high	77.9	Confident	97 Å²	97	95.2 Å²	95.2	42%	0.422	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.9	170.2	-174.6	175.9	-175.9	170.6	0	110.2	Y639 F703 T704 T706	Y639-K716 HydrophobicContact CD1-CB 3.9Å; Y639-K716 HydrophobicContact CD1-CG 4.25Å; Y639-K716 HydrophobicContact CE1-CB 3.72Å; Y639-K716 HydrophobicContact CE1-CD 3.97Å; Y639-K716 HydrophobicContact CE1-CG 3.83Å; F703-K716 CarbonylContact C-O 3.31Å; F703-K716 WeakPolarHBondContact CA-O 3.46Å; T704-K716 PolarHBondContact N-O 2.73Å; T704-K716 PolarHBondContact O-N 3.46Å; T706-K716 HydrophobicContact CG2-CB 3.71Å; T706-K716 HydrophobicContact CG2-CD 4.47Å
717	L	96.6	Very high	75.1	Confident	6 Å²	6	97.2 Å²	97.2	3%	0.031	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.2	176	-76.5	77.3	0	0	0	110.5	Y629 L632 K633 D638 V640 F703	Y629-L717 HydrophobicContact CD2-CD2 4.22Å; Y629-L717 HydrophobicContact CD2-CG 4.4Å; Y629-L717 HydrophobicContact CE2-CB 4.18Å; Y629-L717 HydrophobicContact CE2-CD2 4.34Å; Y629-L717 HydrophobicContact CE2-CG 4.45Å; L632-L717 HydrophobicContact CB-CD2 3.52Å; L632-L717 HydrophobicContact CD1-CD1 4.34Å; L632-L717 HydrophobicContact CD1-CD2 4.25Å; K633-L717 HydrophobicContact CD-CD2 4.05Å; K633-L717 HydrophobicContact CG-CD2 4.15Å; D638-L717 WeakPolarHBondContact O-CD1 3.27Å; D638-L717 PolarHBondContact O-N 2.81Å; V640-L717 HydrophobicContact CB-CD1 4.48Å; V640-L717 HydrophobicContact CG1-CD1 4.25Å; F703-L717 HydrophobicContact CD1-CD1 4.4Å; F703-L717 HydrophobicContact CD1-CG 4.15Å; F703-L717 HydrophobicContact CE1-CD1 4.26Å; F703-L717 HydrophobicContact CE1-CD2 4.46Å; F703-L717 HydrophobicContact CE1-CG 3.9Å
718	K	93.6	Very high	71.9	Confident	89 Å²	89	101.5 Å²	101.5	39%	0.387	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-65.7	144.4	175.3	-70	-177.9	174	-177.2	0	110	Y629 T700 R701 L702 T704	Y629-K718 WeakPolarHBondContact CE2-O 3.47Å; Y629-K718 PolarHBondContact OH-O 3.32Å; T700-K718 VanDerWaalsContact O-CE 3.23Å; T700-K718 WeakPolarHBondContact O-CE 3.36Å; T700-K718 PolarHBondContact O-NZ 2.67Å; R701-K718 VanDerWaalsContact O-CD 3.27Å; R701-K718 WeakPolarHBondContact O-CD 3.23Å; L702-K718 WeakPolarHBondContact O-CB 3.19Å; L702-K718 PolarHBondContact O-N 3.03Å; T704-K718 WeakPolarHBondContact OG1-CE 3.45Å
719	K	83.4	Confident	69	Low	186 Å²	186	102.2 Å²	102.2	81%	0.809	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-76.1	130.9	171.6	-66	-176.5	178.5	-178	0	108.3	R721	K719-R721 PolarHBondContact O-N 2.66Å; K719-R721 VanDerWaalsContact O-N 3.07Å
720	K	67.5	Low	66	Low	140 Å²	140	110.1 Å²	110.1	61%	0.609	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-54.3	118.5	170.1	-83.5	179.4	179	163.8	0	107.3	Y629 D630 K722	Y629-K720 HydrophobicContact CE1-CD 4.38Å; Y629-K720 HydrophobicContact CE1-CG 4.23Å; D630-K720 IonicContact OD1-NZ 3.58Å; D630-K720 PolarHBondContact OD1-NZ 3.08Å; K720-K722 PolarHBondContact O-N 3.17Å
721	R	50.3	Low	63.4	Low	243 Å²	243	107.3 Å²	107.3	92%	0.917	56%	0.556	S	S	*	*			trans	-57.5	113.1	170.5	-98.8	179.6	161.1	171.9	-5.4	106.2	K719 K723	K719-R721 PolarHBondContact O-N 2.66Å; K719-R721 VanDerWaalsContact O-N 3.07Å; R721-K723 PolarHBondContact O-N 3.22Å
722	K	40.3	Very low	60.5	Low	205 Å²	205	108.9 Å²	108.9	89%	0.891	58%	0.581	S	S	*	*			trans	-54.9	114.6	162.5	-87.3	-175.4	174.6	-178.1	0	105.2	K720 S724	K720-K722 PolarHBondContact O-N 3.17Å; K722-S724 VanDerWaalsContact C-N 3.26Å; K722-S724 PolarHBondContact O-N 3.07Å
723	K	38.8	Very low	57.5	Low	205 Å²	205	115.3 Å²	115.3	89%	0.891	62%	0.621	S	S	*	*			trans	-58.5	101.7	164	-90.1	-177.7	174.4	178.8	0	105	R721 G725	R721-K723 PolarHBondContact O-N 3.22Å; K723-G725 PolarHBondContact O-N 3.3Å
724	S	36.1	Very low	54.6	Low	110 Å²	110	123 Å²	123	77%	0.769	66%	0.655	S	S	*	*			trans	-52	112	159.3	176	0	0	0	0	105.1	K722 K726	K722-S724 VanDerWaalsContact C-N 3.26Å; K722-S724 PolarHBondContact O-N 3.07Å; S724-K726 PolarHBondContact O-N 3.47Å
725	G	36.5	Very low	51.5	Low	66 Å²	66	136 Å²	136	68%	0.68	72%	0.716	S	S	*	*			trans	-53.3	114.8	169.4	0	0	0	0	0	106.7	K723 A727	K723-G725 PolarHBondContact O-N 3.3Å; G725-A727 PolarHBondContact O-N 3.18Å
726	K	35.8	Very low	49.2	Very low	204 Å²	204	142.6 Å²	142.6	89%	0.887	75%	0.751	S	S	*	*			trans	-60	109.4	159.6	-94.5	-178.5	170.8	-177.7	0	104.5	S724 S728	S724-K726 PolarHBondContact O-N 3.47Å; K726-S728 PolarHBondContact O-N 2.98Å; K726-S728 VanDerWaalsContact O-N 3.11Å
727	A	35.6	Very low	46.7	Very low	95 Å²	95	144.9 Å²	144.9	79%	0.785	77%	0.768	S	S	*	*			trans	-50.4	117.8	159	0	0	0	0	0	106.4	G725 S729	G725-A727 PolarHBondContact O-N 3.18Å; A727-S729 PolarHBondContact O-N 3.11Å
728	S	31.7	Very low	43.9	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	81%	0.809	S	S	*	*			trans	-57.7	117.5	166.4	46.8	0	0	0	0	107	K726 E730	K726-S728 PolarHBondContact O-N 2.98Å; K726-S728 VanDerWaalsContact O-N 3.11Å; S728-E730 PolarHBondContact O-N 3.33Å; S728-E730 VanDerWaalsContact O-N 3.13Å
729	S	34.2	Very low	41	Very low	112 Å²	112	156.4 Å²	156.4	78%	0.783	83%	0.834	S	S	*	*			trans	-51.8	112	164	46.7	0	0	0	0	109.3	A727	A727-S729 PolarHBondContact O-N 3.11Å
730	E	32.2	Very low	38.4	Very low	182 Å²	182	154.6 Å²	154.6	85%	0.85	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-62.5	131.3	159.1	-78.7	179.1	152.9	0	0	108.4	S728	S728-E730 PolarHBondContact O-N 3.33Å; S728-E730 VanDerWaalsContact O-N 3.13Å
731	P	37.7	Very low	36.4	Very low	117 Å²	117	155.5 Å²	155.5	76%	0.76	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-75	128.2	168.8	30.6	-27.9	0	0	0	108.2
732	G	33.9	Very low	35.4	Very low	79 Å²	79	149.3 Å²	149.3	81%	0.814	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-58.5	142.7	177	0	0	0	0	0	112.5
733	V	33.7	Very low	35.1	Very low	142 Å²	142	145 Å²	145	86%	0.861	84%	0.842	S	S	*	*			trans	-118.7	122.7	157.6	176.8	0	0	0	0	107
734	K	36.3	Very low	34.7	Very low	194 Å²	194	140 Å²	140	84%	0.843	84%	0.838	S	S	*	*			trans	-77.5	148.4	171.9	-75.3	178.1	173.4	179.2	0	109.7
735	Q	33.3	Very low	34.6	Very low	272 Å²	272	142.7 Å²	142.7	100%	1.271	84%	0.844	S	S	*	*			trans	78.2	0	169.3	-73.2	-177.5	-22.2	0	0	116.9

Retrieved 735 of 735 residues in 1756.8 ms (Link to these results)

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