A0A087YM35_POEFO Loading...

Tryptophan 2,3-dioxygenase

Heme-dependent dioxygenase that catalyzes the oxidative cleavage of the L-tryptophan (L-Trp) pyrrole ring and converts L-tryptophan to N-formyl-L-kynurenine. Catalyzes the oxidative cleavage of the indole moiety.

AlphaFold DB , UniProt , Accession A0A087YM35, Species POEFO (Poecilia formosa, Amazon molly), Gene TDO2, Length 404 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	27.9	Very low	242 Å²	242	171.3 Å²	171.3	100%	1.192	82%	0.817	S	S	*	*				0	90.8	0	-69.1	175.5	172.2	0	0	106.6
2	S	29.2	Very low	28	Very low	104 Å²	104	169.3 Å²	169.3	73%	0.727	81%	0.813	S	S	*	*				93.6	104.1	92	-159.1	0	0	0	0	112
3	R	24.7	Very low	28.1	Very low	240 Å²	240	168.8 Å²	168.8	91%	0.906	82%	0.817	S	S	*	*			trans	63.4	140	149.7	-63.5	-177.9	-176.8	-167.2	1.1	118.3
4	C	25.1	Very low	28.6	Very low	110 Å²	110	170.6 Å²	170.6	74%	0.743	82%	0.819	S	S	*	*			cis	-171.8	132.6	-4.9	-174.9	0	0	0	0	106.5
5	P	29	Very low	28.7	Very low	116 Å²	116	171.9 Å²	171.9	75%	0.753	82%	0.819	S	S	*	*			trans	-111	122.3	168.6	33.9	-21	0	0	0	110.3
6	Y	28	Very low	28.8	Very low	220 Å²	220	171.3 Å²	171.3	86%	0.863	82%	0.822	S	S	*	*			trans	-146.9	81.3	161.6	-121.3	-85.7	0	0	0	110.4
7	F	27.1	Very low	28.8	Very low	206 Å²	206	173 Å²	173	90%	0.904	83%	0.825	S	S	*	*			trans	-107.6	123.6	148.7	-111.5	-85.5	0	0	0	105.7
8	E	25.1	Very low	29.4	Very low	133 Å²	133	170.5 Å²	170.5	62%	0.621	83%	0.826	S	S	*	*			trans	146.4	133.7	136.3	-84.6	-163.2	165.2	0	0	114.4
9	K	27.7	Very low	29.3	Very low	158 Å²	158	167.8 Å²	167.8	69%	0.687	83%	0.826	S	S	*	*			trans	77.8	144.7	154.2	-68.4	160.6	-179.2	141.3	0	116.4
10	K	28.5	Very low	29.4	Very low	177 Å²	177	165.5 Å²	165.5	77%	0.77	82%	0.822	S	S	*	*			cis	-170.6	156	-9.6	-116.4	173.3	-177.5	-175.4	0	105.1
11	H	30.4	Very low	29.5	Very low	178 Å²	178	165.5 Å²	165.5	82%	0.824	82%	0.82	S	S	*	*			trans	-21.6	133	158.6	-75.4	-91.4	0	0	0	115.8
12	L	28.5	Very low	29.4	Very low	147 Å²	147	161.5 Å²	161.5	77%	0.77	80%	0.798	S	S	*	*			trans	167.7	86.9	136.6	-88.9	155.1	0	0	0	109.1
13	L	29.4	Very low	29.3	Very low	164 Å²	164	161.8 Å²	161.8	86%	0.859	80%	0.8	S	S	*	*			trans	-118.2	137.1	158.4	-79.3	163.3	0	0	0	106.6
14	F	35.7	Very low	29.6	Very low	193 Å²	193	158.7 Å²	158.7	85%	0.846	80%	0.796	S	S	*	*			trans	85.5	74.4	-166.5	-53.4	-74.7	0	0	0	116.1
15	K	29.2	Very low	29.8	Very low	190 Å²	190	161.5 Å²	161.5	83%	0.826	80%	0.804	S	S	*	*			trans	-128.4	104.1	142.3	-93.1	-174.4	175.6	177.1	0	108.6
16	N	30.8	Very low	30.3	Very low	162 Å²	162	160.6 Å²	160.6	87%	0.866	81%	0.806	S	S	*	*			trans	-88.4	124.8	161.5	-82.7	-12.3	0	0	0	108.5
17	K	29.1	Very low	30.6	Very low	201 Å²	201	155.2 Å²	155.2	87%	0.874	80%	0.8	S	S	*	*			trans	-136.2	136.9	155	-113.9	-172.5	178.5	-173.4	0	107.1
18	P	38.8	Very low	31	Very low	128 Å²	128	154.9 Å²	154.9	83%	0.831	80%	0.802	S	S	*	*			trans	-85.5	141.8	-179	34.2	-30.2	0	0	0	110
19	S	28.6	Very low	31.8	Very low	120 Å²	120	154 Å²	154	84%	0.839	82%	0.817	S	S	*	*			trans	-128.9	127.7	162.5	55.7	0	0	0	0	109.3
20	T	30.6	Very low	32	Very low	121 Å²	121	150.5 Å²	150.5	74%	0.742	83%	0.826	S	S	*	*			trans	-68.7	157.5	-178.1	-0.9	0	0	0	0	113.7
21	E	30.8	Very low	32.2	Very low	166 Å²	166	145.8 Å²	145.8	78%	0.776	83%	0.828	S	S	*	*			trans	70.5	137.4	154.5	-67.1	166.4	-162.5	0	0	117.4
22	E	31	Very low	32.9	Very low	157 Å²	157	147.1 Å²	147.1	73%	0.734	83%	0.834	S	S	*	*			cis	-171.7	158.8	-2	-122.4	-178.5	-178.6	0	0	108.5
23	S	28	Very low	33.5	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	83%	0.83	S	S	*	*			trans	137.6	82.7	154.4	58.7	0	0	0	0	110.6
24	Q	31.5	Very low	34.3	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.822	83%	0.831	S	S	*	*				58.5	96.5	95.8	-72.9	-172	2.5	0	0	113.1
25	D	29	Very low	35.3	Very low	169 Å²	169	141.3 Å²	141.3	90%	0.904	83%	0.83	S	S	*	*			trans	-139.5	118.6	131.4	-135.2	-11.4	0	0	0	109
26	A	38.4	Very low	36.8	Very low	96 Å²	96	135.4 Å²	135.4	79%	0.793	82%	0.823	S	S	*	*			trans	-108.3	104.2	-173.1	0	0	0	0	0	109.1
27	S	35.6	Very low	38.8	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	82%	0.824	S	S	*	*			trans	-162.1	92.2	154.6	61.4	0	0	0	0	111.3
28	Q	33.8	Very low	41.5	Very low	199 Å²	199	135.7 Å²	135.7	93%	0.93	82%	0.815	S	S	*	*				166.6	101.6	128.3	-91.1	177.3	-2.7	0	0	109.2
29	A	43.6	Very low	44.1	Very low	115 Å²	115	134.6 Å²	134.6	95%	0.95	80%	0.801	S	S	*	*			trans	-90.1	124.5	162.1	0	0	0	0	0	108.3
30	G	31.9	Very low	47.2	Very low	84 Å²	84	136.6 Å²	136.6	87%	0.866	79%	0.791	S	S	*	*			trans	160	99.8	168.9	0	0	0	0	0	113.1
31	G	32.4	Very low	50.3	Low	79 Å²	79	132 Å²	132	81%	0.814	77%	0.767	S	S	*	*			trans	136.5	110.9	162.5	0	0	0	0	0	114.3
32	E	44.8	Very low	53.4	Low	206 Å²	206	129.4 Å²	129.4	96%	0.963	76%	0.759	S	S	*	*			trans	-48	138	174.4	-65.8	162.3	137.3	0	0	113.7
33	G	40.8	Very low	56.5	Low	65 Å²	65	129.9 Å²	129.9	67%	0.67	76%	0.755	S	S	*	*			trans	131.5	47.6	159.8	0	0	0	0	0	117.8	K35	G33-K35 PolarHBondContact O-N 3.22Å
34	S	46.7	Very low	59.8	Low	126 Å²	126	127.6 Å²	127.6	88%	0.881	73%	0.734	S	S	*	*			trans	-70.3	69.2	153.1	-178.6	0	0	0	0	109	G36	S34-G36 PolarHBondContact O-N 2.84Å
35	K	56.9	Low	62.9	Low	191 Å²	191	123.6 Å²	123.6	83%	0.83	72%	0.716	S	S	*	*			trans	-66.9	113.7	164.3	-80.4	-178.3	176.1	177.6	0	105.9	G33 R37	G33-K35 PolarHBondContact O-N 3.22Å; K35-R37 PolarHBondContact O-N 3.21Å
36	G	59	Low	66.2	Low	65 Å²	65	117.9 Å²	117.9	67%	0.67	69%	0.685	S	S	*	*			trans	-42.2	121.7	-174	0	0	0	0	0	112.5	S34 I38	S34-G36 PolarHBondContact O-N 2.84Å; G36-I38 PolarHBondContact O-N 3.36Å; G36-I38 VanDerWaalsContact O-N 3.13Å
37	R	74.2	Confident	68.9	Low	236 Å²	236	118.2 Å²	118.2	89%	0.891	67%	0.673	S	S	*	*			trans	-67.9	110.1	179.4	-171.7	179.1	-173.7	-174.7	2.5	108.6	K35 I39	K35-R37 PolarHBondContact O-N 3.21Å; R37-I39 PolarHBondContact O-N 3.13Å
38	I	84.6	Confident	71.9	Confident	134 Å²	134	119.2 Å²	119.2	69%	0.687	66%	0.664	S	S	*	*			trans	-65.6	124.6	172.5	-61.3	175.3	0	0	0	108.3	G36 Y43	G36-I38 PolarHBondContact O-N 3.36Å; G36-I38 VanDerWaalsContact O-N 3.13Å; I38-Y43 HydrophobicContact CG2-CD2 4.17Å; I38-Y43 HydrophobicContact CG2-CG 4.2Å
39	I	93.7	Very high	74.9	Confident	104 Å²	104	113.3 Å²	113.3	53%	0.533	64%	0.638	S	S	.	*			trans	-91.1	136.5	178.6	-58	175.7	0	0	0	108.8	R37 G41 D42 Y43	R37-I39 PolarHBondContact O-N 3.13Å; I39-G41 VanDerWaalsContact C-N 3.33Å; I39-G41 PolarHBondContact O-N 2.94Å; I39-D42 PolarHBondContact O-N 3.43Å; I39-D42 VanDerWaalsContact O-N 3.16Å; I39-Y43 PolarHBondContact O-N 3.47Å
40	Y	94.6	Very high	77.5	Confident	162 Å²	162	112.1 Å²	112.1	64%	0.635	62%	0.619	S	S	*	*	H	α-helix	trans	-53	-45.6	-176.3	178.1	-98.2	0	0	0	113.6	D42 Y43 L44 L46	Y40-D42 PolarHBondContact O-N 3.28Å; Y40-Y43 PolarHBondContact O-N 3.35Å; Y40-L44 HydrophobicContact CD1-CD1 4.4Å; Y40-L44 HydrophobicContact CD2-CD1 4.08Å; Y40-L44 HydrophobicContact CE1-CD1 3.78Å; Y40-L44 HydrophobicContact CE2-CD1 3.39Å; Y40-L44 HydrophobicContact CE2-CG 4.29Å; Y40-L44 PolarHBondContact O-N 3.47Å; Y40-L44 VanDerWaalsContact O-N 3.1Å; Y40-L44 VanDerWaalsContact OH-CD1 3.28Å; Y40-L44 WeakPolarHBondContact OH-CD1 3.5Å; Y40-L46 HydrophobicContact CD1-CD1 3.93Å; Y40-L46 HydrophobicContact CE1-CD1 3.69Å
41	G	95.6	Very high	80.6	Confident	24 Å²	24	112.9 Å²	112.9	25%	0.247	61%	0.607	C	S	.	*	H	α-helix	trans	-61.7	-41.7	179.9	0	0	0	0	0	113	I39 Q45 L46	I39-G41 VanDerWaalsContact C-N 3.33Å; I39-G41 PolarHBondContact O-N 2.94Å; G41-Q45 WeakPolarHBondContact O-CA 3.28Å; G41-Q45 PolarHBondContact O-N 3.27Å; G41-L46 PolarHBondContact O-N 2.94Å
42	D	94.9	Very high	83.7	Confident	113 Å²	113	111.4 Å²	111.4	60%	0.604	59%	0.587	S	S	*	*	H	α-helix	trans	-73.1	-40.2	179.9	-58.5	-22.1	0	0	0	111.3	I39 Y40 L44 Q45	I39-D42 PolarHBondContact O-N 3.43Å; I39-D42 VanDerWaalsContact O-N 3.16Å; Y40-D42 PolarHBondContact O-N 3.28Å; D42-L44 PolarHBondContact O-N 3.1Å; D42-Q45 PolarHBondContact O-N 3.16Å
43	Y	96.4	Very high	86.3	Confident	167 Å²	167	103.8 Å²	103.8	66%	0.655	55%	0.552	S	S	*	*	H	α-helix	trans	-60.5	-44.8	177.8	176.2	-110	0	0	0	112.4	I38 I39 Y40	I38-Y43 HydrophobicContact CG2-CD2 4.17Å; I38-Y43 HydrophobicContact CG2-CG 4.2Å; I39-Y43 PolarHBondContact O-N 3.47Å; Y40-Y43 PolarHBondContact O-N 3.35Å
44	L	97.1	Very high	89	Confident	61 Å²	61	104.6 Å²	104.6	32%	0.319	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.4	179.5	-62.8	-175.3	0	0	0	113.7	Y40 D42 L46 I49	Y40-L44 HydrophobicContact CD1-CD1 4.4Å; Y40-L44 HydrophobicContact CD2-CD1 4.08Å; Y40-L44 HydrophobicContact CE1-CD1 3.78Å; Y40-L44 HydrophobicContact CE2-CD1 3.39Å; Y40-L44 HydrophobicContact CE2-CG 4.29Å; Y40-L44 PolarHBondContact O-N 3.47Å; Y40-L44 VanDerWaalsContact O-N 3.1Å; Y40-L44 VanDerWaalsContact OH-CD1 3.28Å; Y40-L44 WeakPolarHBondContact OH-CD1 3.5Å; D42-L44 PolarHBondContact O-N 3.1Å; L44-L46 VanDerWaalsContact C-N 3.27Å; L44-L46 HydrophobicContact CB-CD2 3.71Å; L44-L46 HydrophobicContact CB-CG 3.98Å; L44-L46 HydrophobicContact CD1-CD2 4.19Å; L44-L46 PolarHBondContact O-N 3.21Å; L44-I49 VanDerWaalsContact O-CD1 3.28Å; L44-I49 WeakPolarHBondContact O-CD1 3.4Å
45	Q	97.6	Very high	91.4	Very high	93 Å²	93	99 Å²	99	44%	0.435	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	48.4	-175.2	-54.2	-177	22.1	0	0	111.8	G41 D42 D47 K48 I49	G41-Q45 WeakPolarHBondContact O-CA 3.28Å; G41-Q45 PolarHBondContact O-N 3.27Å; D42-Q45 PolarHBondContact O-N 3.16Å; Q45-D47 VanDerWaalsContact C-OD1 3.3Å; Q45-D47 WeakPolarHBondContact CA-OD1 3.18Å; Q45-D47 PolarHBondContact O-N 3.34Å; Q45-K48 HydrophobicContact CB-CD 4.34Å; Q45-K48 PolarHBondContact O-N 3.02Å; Q45-I49 PolarHBondContact O-N 3.18Å
46	L	97.1	Very high	93.4	Very high	49 Å²	49	93.9 Å²	93.9	26%	0.257	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-27.2	-175.7	-63.7	-176.1	0	0	0	112.2	Y40 G41 L44 K48 I49 T50	Y40-L46 HydrophobicContact CD1-CD1 3.93Å; Y40-L46 HydrophobicContact CE1-CD1 3.69Å; G41-L46 PolarHBondContact O-N 2.94Å; L44-L46 VanDerWaalsContact C-N 3.27Å; L44-L46 HydrophobicContact CB-CD2 3.71Å; L44-L46 HydrophobicContact CB-CG 3.98Å; L44-L46 HydrophobicContact CD1-CD2 4.19Å; L44-L46 PolarHBondContact O-N 3.21Å; L46-K48 PolarHBondContact O-N 2.54Å; L46-I49 PolarHBondContact O-N 2.87Å; L46-T50 HydrophobicContact CB-CG2 4.45Å; L46-T50 HydrophobicContact CD2-CG2 4.48Å; L46-T50 PolarHBondContact O-N 3Å; L46-T50 PolarHBondContact O-OG1 2.94Å
47	D	96.6	Very high	95.2	Very high	102 Å²	102	90.8 Å²	90.8	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-56.4	-31.5	172.1	68.2	-59.8	0	0	0	112.3	Q45 T51	Q45-D47 VanDerWaalsContact C-OD1 3.3Å; Q45-D47 WeakPolarHBondContact CA-OD1 3.18Å; Q45-D47 PolarHBondContact O-N 3.34Å; D47-T51 WeakPolarHBondContact O-CB 3.36Å; D47-T51 WeakPolarHBondContact O-CG2 3.28Å; D47-T51 PolarHBondContact O-OG1 3.22Å
48	K	97	Very high	96.3	Very high	128 Å²	128	83.9 Å²	83.9	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-86.5	-41.9	174.8	-59.9	-178.7	-171.6	168.1	0	112.1	Q45 L46 A52	Q45-K48 HydrophobicContact CB-CD 4.34Å; Q45-K48 PolarHBondContact O-N 3.02Å; L46-K48 PolarHBondContact O-N 2.54Å; K48-A52 WeakPolarHBondContact O-CB 3.47Å
49	I	97.3	Very high	96.9	Very high	76 Å²	76	82.8 Å²	82.8	39%	0.39	42%	0.423	S	S	.	.	H	α-helix	trans	-71.6	-49.5	-174.7	-62	179.1	0	0	0	111.1	L44 Q45 L46 T51 Q53	L44-I49 VanDerWaalsContact O-CD1 3.28Å; L44-I49 WeakPolarHBondContact O-CD1 3.4Å; Q45-I49 PolarHBondContact O-N 3.18Å; L46-I49 PolarHBondContact O-N 2.87Å; I49-T51 VanDerWaalsContact C-N 3.3Å; I49-T51 PolarHBondContact O-N 3.28Å; I49-Q53 PolarHBondContact O-NE2 3.41Å
50	T	97.6	Very high	97	Very high	89 Å²	89	84.2 Å²	84.2	55%	0.546	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	11.3	-172.9	69.6	0	0	0	0	113.7	L46 Q53	L46-T50 HydrophobicContact CB-CG2 4.45Å; L46-T50 HydrophobicContact CD2-CG2 4.48Å; L46-T50 PolarHBondContact O-N 3Å; L46-T50 PolarHBondContact O-OG1 2.94Å; T50-Q53 PolarHBondContact O-OE1 2.82Å; T50-Q53 VanDerWaalsContact O-OE1 3.1Å
51	T	97.9	Very high	97	Very high	100 Å²	100	80 Å²	80	61%	0.613	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	3.9	172.2	74	0	0	0	0	113.1	D47 I49 Q53	D47-T51 WeakPolarHBondContact O-CB 3.36Å; D47-T51 WeakPolarHBondContact O-CG2 3.28Å; D47-T51 PolarHBondContact O-OG1 3.22Å; I49-T51 VanDerWaalsContact C-N 3.3Å; I49-T51 PolarHBondContact O-N 3.28Å; T51-Q53 VanDerWaalsContact C-N 3.26Å; T51-Q53 PolarHBondContact O-N 3.25Å
52	A	98.2	Very high	97.1	Very high	49 Å²	49	82.3 Å²	82.3	41%	0.405	44%	0.44	S	S	.	.			trans	-82.1	7	179	0	0	0	0	0	114.1	K48 V54 Q75	K48-A52 WeakPolarHBondContact O-CB 3.47Å; A52-V54 PolarHBondContact O-N 3.34Å; A52-Q75 PolarHBondContact O-NE2 2.8Å
53	Q	98.3	Very high	97.2	Very high	45 Å²	45	82.9 Å²	82.9	21%	0.21	44%	0.437	C	S	.	.			trans	-93.2	82.2	-174	-63.3	71.4	42.1	0	0	111.5	I49 T50 T51 I71 V72	I49-Q53 PolarHBondContact O-NE2 3.41Å; T50-Q53 PolarHBondContact O-OE1 2.82Å; T50-Q53 VanDerWaalsContact O-OE1 3.1Å; T51-Q53 VanDerWaalsContact C-N 3.26Å; T51-Q53 PolarHBondContact O-N 3.25Å; Q53-I71 HydrophobicContact CG-CG2 4.37Å; Q53-V72 HydrophobicContact CG-CG2 3.97Å
54	V	97.8	Very high	97.3	Very high	83 Å²	83	76 Å²	76	50%	0.503	41%	0.412	S	S	.	.			trans	-103.2	113.2	179.7	-177.2	0	0	0	0	110.8	A52 L59 I71	A52-V54 PolarHBondContact O-N 3.34Å; V54-L59 HydrophobicContact CG1-CD1 3.69Å; V54-L59 HydrophobicContact CG1-CD2 4.45Å; V54-L59 HydrophobicContact CG1-CG 4.14Å; V54-I71 WeakPolarHBondContact O-CD1 3.35Å
55	L	97.9	Very high	97.4	Very high	9 Å²	9	80.6 Å²	80.6	5%	0.047	43%	0.431	C	S	.	.			trans	-81.6	120.7	179	-80.8	69.9	0	0	0	110.6	S57 E58 L59 K63 E67 H68 I71	L55-S57 VanDerWaalsContact C-N 3.29Å; L55-S57 PolarHBondContact O-N 3.1Å; L55-E58 HydrophobicContact CB-CB 3.76Å; L55-E58 PolarHBondContact O-N 2.87Å; L55-L59 WeakPolarHBondContact O-CG 3.46Å; L55-L59 PolarHBondContact O-N 3.14Å; L55-L59 VanDerWaalsContact O-N 3.14Å; L55-K63 HydrophobicContact CD2-CG 4.26Å; L55-E67 WeakPolarHBondContact CB-OE2 3.43Å; L55-E67 HydrophobicContact CD2-CB 4.17Å; L55-E67 HydrophobicContact CG-CB 4.14Å; L55-E67 HydrophobicContact CG-CG 4.13Å; L55-H68 HydrophobicContact CD1-CB 4.13Å; L55-H68 HydrophobicContact CD2-CB 4.36Å; L55-I71 HydrophobicContact CD1-CD1 3.97Å; L55-I71 HydrophobicContact CG-CD1 4.12Å
56	Q	97.4	Very high	97.4	Very high	82 Å²	82	77.5 Å²	77.5	38%	0.383	42%	0.418	S	S	.	.	H	α-helix	trans	-66.1	-35.2	175.9	-65.5	-61	-42.4	0	0	111.2	E58 L59 Q60 E67	Q56-E58 VanDerWaalsContact C-N 3.3Å; Q56-E58 PolarHBondContact O-N 2.89Å; Q56-L59 PolarHBondContact O-N 3.35Å; Q56-Q60 VanDerWaalsContact O-CG 3.29Å; Q56-Q60 WeakPolarHBondContact O-CG 3.39Å; Q56-Q60 PolarHBondContact O-N 3.46Å; Q56-Q60 VanDerWaalsContact O-N 3.09Å; Q56-E67 WeakPolarHBondContact CB-OE1 3.37Å; Q56-E67 PolarHBondContact N-OE1 3.08Å; Q56-E67 PolarHBondContact N-OE2 2.84Å
57	S	97.2	Very high	97.5	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-62.4	-38.6	176.4	73	0	0	0	0	112.4	L55 Q60 G61 N62 I64 E67	L55-S57 VanDerWaalsContact C-N 3.29Å; L55-S57 PolarHBondContact O-N 3.1Å; S57-Q60 CarbonylContact O-C 3.43Å; S57-Q60 PolarHBondContact O-N 3.3Å; S57-G61 PolarHBondContact O-N 3.35Å; S57-N62 CarbonylContact C-O 3.59Å; S57-N62 WeakPolarHBondContact CB-O 3.49Å; S57-N62 CarbonylContact O-C 3.58Å; S57-N62 PolarHBondContact O-N 3.32Å; S57-N62 PolarHBondContact OG-O 3.09Å; S57-I64 PolarHBondContact OG-N 3.5Å; S57-E67 WeakPolarHBondContact CB-OE2 3.32Å; S57-E67 PolarHBondContact N-OE1 3.31Å; S57-E67 PolarHBondContact N-OE2 2.99Å; S57-E67 PolarHBondContact OG-OE2 2.77Å
58	E	97.6	Very high	97.6	Very high	91 Å²	91	74.8 Å²	74.8	43%	0.425	40%	0.4	S	S	.	.	H	α-helix	trans	-69.1	-41.6	177.3	-174.5	161.6	-154.5	0	0	111.6	L55 Q56 Q60 G61 K63	L55-E58 HydrophobicContact CB-CB 3.76Å; L55-E58 PolarHBondContact O-N 2.87Å; Q56-E58 VanDerWaalsContact C-N 3.3Å; Q56-E58 PolarHBondContact O-N 2.89Å; E58-Q60 PolarHBondContact O-N 3.48Å; E58-G61 PolarHBondContact O-N 3.47Å; E58-K63 HydrophobicContact CB-CB 4.07Å; E58-K63 HydrophobicContact CB-CG 4.14Å; E58-K63 HydrophobicContact CG-CB 4.24Å; E58-K63 HydrophobicContact CG-CD 4.3Å; E58-K63 HydrophobicContact CG-CG 4.34Å; E58-K63 IonicContact OE1-NZ 2.84Å; E58-K63 PolarHBondContact OE1-NZ 3.33Å; E58-K63 WeakPolarHBondContact OE2-CE 3.32Å; E58-K63 IonicContact OE2-NZ 2.87Å; E58-K63 PolarHBondContact OE2-NZ 3.35Å
59	L	96.4	Very high	97.7	Very high	111 Å²	111	70.7 Å²	70.7	58%	0.581	38%	0.384	S	S	*	.	H	α-helix	trans	-60.8	-31.5	174	-67.5	-179.7	0	0	0	112.8	V54 L55 Q56 G61	V54-L59 HydrophobicContact CG1-CD1 3.69Å; V54-L59 HydrophobicContact CG1-CD2 4.45Å; V54-L59 HydrophobicContact CG1-CG 4.14Å; L55-L59 WeakPolarHBondContact O-CG 3.46Å; L55-L59 PolarHBondContact O-N 3.14Å; L55-L59 VanDerWaalsContact O-N 3.14Å; Q56-L59 PolarHBondContact O-N 3.35Å; L59-G61 VanDerWaalsContact C-N 3.26Å; L59-G61 PolarHBondContact O-N 3.3Å
60	Q	95.8	Very high	97.7	Very high	135 Å²	135	69 Å²	69	63%	0.631	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	9.4	176.3	-61.4	-63.8	-29.6	0	0	113.1	Q56 S57 E58 N62 Y144	Q56-Q60 VanDerWaalsContact O-CG 3.29Å; Q56-Q60 WeakPolarHBondContact O-CG 3.39Å; Q56-Q60 PolarHBondContact O-N 3.46Å; Q56-Q60 VanDerWaalsContact O-N 3.09Å; S57-Q60 CarbonylContact O-C 3.43Å; S57-Q60 PolarHBondContact O-N 3.3Å; E58-Q60 PolarHBondContact O-N 3.48Å; Q60-N62 PolarHBondContact O-N 2.99Å; Q60-Y144 HydrophobicContact CB-CD1 4.14Å; Q60-Y144 HydrophobicContact CB-CE1 3.82Å; Q60-Y144 HydrophobicContact CG-CD1 3.92Å; Q60-Y144 HydrophobicContact CG-CE1 4.11Å
61	G	96.6	Very high	97.7	Very high	72 Å²	72	66.1 Å²	66.1	74%	0.742	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	11.5	175.3	0	0	0	0	0	115.3	S57 E58 L59	S57-G61 PolarHBondContact O-N 3.35Å; E58-G61 PolarHBondContact O-N 3.47Å; L59-G61 VanDerWaalsContact C-N 3.26Å; L59-G61 PolarHBondContact O-N 3.3Å
62	N	96.7	Very high	97.7	Very high	74 Å²	74	64.1 Å²	64.1	40%	0.396	34%	0.342	S	S	.	.			trans	-136.6	74	179.5	179.7	33.8	0	0	0	110.7	S57 Q60 I64 Y144	S57-N62 CarbonylContact C-O 3.59Å; S57-N62 WeakPolarHBondContact CB-O 3.49Å; S57-N62 CarbonylContact O-C 3.58Å; S57-N62 PolarHBondContact O-N 3.32Å; S57-N62 PolarHBondContact OG-O 3.09Å; Q60-N62 PolarHBondContact O-N 2.99Å; N62-I64 PolarHBondContact O-N 2.98Å; N62-Y144 WeakPolarHBondContact CB-OH 3.49Å; N62-Y144 PolarHBondContact ND2-OH 3.01Å
63	K	97.7	Very high	97.7	Very high	124 Å²	124	62.1 Å²	62.1	54%	0.539	33%	0.325	S	S	.	.			trans	-60.2	121.7	-177	-177.5	178.5	-167.3	140	0	112.1	L55 E58	L55-K63 HydrophobicContact CD2-CG 4.26Å; E58-K63 HydrophobicContact CB-CB 4.07Å; E58-K63 HydrophobicContact CB-CG 4.14Å; E58-K63 HydrophobicContact CG-CB 4.24Å; E58-K63 HydrophobicContact CG-CD 4.3Å; E58-K63 HydrophobicContact CG-CG 4.34Å; E58-K63 IonicContact OE1-NZ 2.84Å; E58-K63 PolarHBondContact OE1-NZ 3.33Å; E58-K63 WeakPolarHBondContact OE2-CE 3.32Å; E58-K63 IonicContact OE2-NZ 2.87Å; E58-K63 PolarHBondContact OE2-NZ 3.35Å
64	I	98.3	Very high	97.7	Very high	24 Å²	24	63.9 Å²	63.9	12%	0.123	33%	0.333	C	S	.	.			trans	-106.7	127.5	172.6	-52.5	-56.1	0	0	0	109.3	S57 N62 E67 D140 F141 Y144	S57-I64 PolarHBondContact OG-N 3.5Å; N62-I64 PolarHBondContact O-N 2.98Å; I64-E67 PolarHBondContact O-N 2.91Å; I64-D140 HydrophobicContact CD1-CB 4.07Å; I64-D140 HydrophobicContact CG1-CB 4.31Å; I64-D140 HydrophobicContact CG2-CB 4.35Å; I64-F141 HydrophobicContact CB-CB 3.93Å; I64-F141 HydrophobicContact CB-CD1 4.43Å; I64-F141 HydrophobicContact CG1-CB 3.93Å; I64-F141 HydrophobicContact CG2-CB 4.14Å; I64-F141 HydrophobicContact CG2-CD1 3.82Å; I64-F141 HydrophobicContact CG2-CG 4.44Å; I64-Y144 HydrophobicContact CG1-CE2 4.4Å
65	H	98.4	Very high	97.7	Very high	156 Å²	156	62.7 Å²	62.7	72%	0.722	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-49.8	-172	-176.9	75.8	0	0	0	113	E67 H68	H65-E67 PolarHBondContact O-N 3.39Å; H65-H68 PolarHBondContact O-N 2.61Å; H65-H68 VanDerWaalsContact O-N 3.14Å
66	D	98.4	Very high	97.7	Very high	29 Å²	29	63.7 Å²	63.7	16%	0.155	33%	0.332	C	S	.	.	H	α-helix	trans	-70.3	-11.5	-174	-79.5	19.3	0	0	0	113.9	H68 L69 F70 M133 D137 F141	D66-H68 PolarHBondContact O-N 3.37Å; D66-L69 WeakPolarHBondContact O-CB 3.43Å; D66-L69 PolarHBondContact O-N 3.12Å; D66-F70 PolarHBondContact O-N 2.98Å; D66-M133 HydrophobicContact CB-CG 3.98Å; D66-M133 HydrophobicContact CB-SD 3.82Å; D66-M133 WeakPolarHBondContact OD2-CG 3.45Å; D66-D137 HydrophobicContact CB-CB 4.38Å; D66-F141 HydrophobicContact CB-CE1 4.27Å
67	E	98.4	Very high	97.8	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.019	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-33.2	170.8	-171.3	-176.6	-169.8	0	0	111.2	L55 Q56 S57 I64 H65 F70 I71 F141	L55-E67 WeakPolarHBondContact CB-OE2 3.43Å; L55-E67 HydrophobicContact CD2-CB 4.17Å; L55-E67 HydrophobicContact CG-CB 4.14Å; L55-E67 HydrophobicContact CG-CG 4.13Å; Q56-E67 WeakPolarHBondContact CB-OE1 3.37Å; Q56-E67 PolarHBondContact N-OE1 3.08Å; Q56-E67 PolarHBondContact N-OE2 2.84Å; S57-E67 WeakPolarHBondContact CB-OE2 3.32Å; S57-E67 PolarHBondContact N-OE1 3.31Å; S57-E67 PolarHBondContact N-OE2 2.99Å; S57-E67 PolarHBondContact OG-OE2 2.77Å; I64-E67 PolarHBondContact O-N 2.91Å; H65-E67 PolarHBondContact O-N 3.39Å; E67-F70 WeakPolarHBondContact O-CB 3.35Å; E67-F70 PolarHBondContact O-N 2.92Å; E67-I71 HydrophobicContact CG-CD1 4.12Å; E67-I71 WeakPolarHBondContact O-CG1 3.29Å; E67-I71 PolarHBondContact O-N 3.5Å; E67-F141 HydrophobicContact CB-CB 4.34Å; E67-F141 HydrophobicContact CB-CD1 4.26Å; E67-F141 HydrophobicContact CB-CD2 4.04Å; E67-F141 HydrophobicContact CB-CE2 4.35Å; E67-F141 HydrophobicContact CB-CG 3.98Å; E67-F141 HydrophobicContact CG-CD2 3.91Å; E67-F141 HydrophobicContact CG-CE2 4.24Å; E67-F141 HydrophobicContact CG-CG 4.3Å
68	H	98.6	Very high	97.8	Very high	90 Å²	90	63.2 Å²	63.2	42%	0.417	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-42.7	175.4	-171.7	-78.5	0	0	0	111.7	L55 H65 D66 F70 I71 V72	L55-H68 HydrophobicContact CD1-CB 4.13Å; L55-H68 HydrophobicContact CD2-CB 4.36Å; H65-H68 PolarHBondContact O-N 2.61Å; H65-H68 VanDerWaalsContact O-N 3.14Å; D66-H68 PolarHBondContact O-N 3.37Å; H68-F70 VanDerWaalsContact C-N 3.32Å; H68-F70 PolarHBondContact O-N 2.7Å; H68-I71 PolarHBondContact O-N 2.96Å; H68-V72 VanDerWaalsContact CE1-CG2 3.49Å; H68-V72 WeakPolarHBondContact CE1-CG2 3.45Å; H68-V72 WeakPolarHBondContact O-CG2 3.27Å; H68-V72 PolarHBondContact O-N 2.95Å
69	L	98.5	Very high	97.9	Very high	41 Å²	41	63.6 Å²	63.6	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-43.3	174.8	175.1	62.8	0	0	0	110.9	D66 T73 V129 M133	D66-L69 WeakPolarHBondContact O-CB 3.43Å; D66-L69 PolarHBondContact O-N 3.12Å; L69-T73 VanDerWaalsContact O-CB 3.27Å; L69-T73 WeakPolarHBondContact O-CB 3.45Å; L69-T73 PolarHBondContact O-N 3.38Å; L69-T73 PolarHBondContact O-OG1 3.18Å; L69-V129 HydrophobicContact CD1-CG1 3.92Å; L69-M133 HydrophobicContact CD2-CB 4.28Å
70	F	97.7	Very high	98	Very high	41 Å²	41	62.7 Å²	62.7	18%	0.18	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-49.1	176	-175.8	-91.4	0	0	0	111.3	D66 E67 H68 H74 L130 M133 F138 F141 L145	D66-F70 PolarHBondContact O-N 2.98Å; E67-F70 WeakPolarHBondContact O-CB 3.35Å; E67-F70 PolarHBondContact O-N 2.92Å; H68-F70 VanDerWaalsContact C-N 3.32Å; H68-F70 PolarHBondContact O-N 2.7Å; F70-H74 AromaticContact CD1-ND1 3.94Å; F70-H74 AromaticContact CD2-CE1 3.66Å; F70-H74 AromaticContact CE1-CE1 3.75Å; F70-H74 AromaticContact CE1-ND1 3.87Å; F70-H74 AromaticContact CE2-CE1 3.28Å; F70-H74 WeakPolarHBondContact CE2-CE1 3.41Å; F70-H74 AromaticContact CZ-CE1 3.32Å; F70-H74 WeakPolarHBondContact CZ-CE1 3.36Å; F70-H74 AromaticContact CZ-ND1 3.92Å; F70-H74 AromaticContact CZ-NE2 3.84Å; F70-H74 PolarHBondContact O-N 3.16Å; F70-H74 PolarHBondContact O-ND1 2.72Å; F70-L130 HydrophobicContact CD2-CD1 4.47Å; F70-M133 HydrophobicContact CD2-CE 4.23Å; F70-F138 HydrophobicContact CD2-CE2 4.27Å; F70-F138 AromaticContact CE2-CE2 3.95Å; F70-F138 HydrophobicContact CE2-CE2 3.95Å; F70-F141 HydrophobicContact CB-CE2 4.02Å; F70-F141 HydrophobicContact CB-CZ 3.79Å; F70-F141 HydrophobicContact CD1-CE2 4.23Å; F70-F141 HydrophobicContact CD2-CE2 4.19Å; F70-F141 HydrophobicContact CD2-CZ 4.12Å; F70-F141 AromaticContact CG-CE2 3.89Å; F70-F141 HydrophobicContact CG-CE2 3.89Å; F70-F141 HydrophobicContact CG-CZ 4Å; F70-L145 HydrophobicContact CE1-CD1 4.19Å; F70-L145 HydrophobicContact CE1-CD2 4.04Å; F70-L145 HydrophobicContact CZ-CD1 4.01Å
71	I	97.9	Very high	98.1	Very high	28 Å²	28	56.6 Å²	56.6	14%	0.144	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-53.6	179.2	-68.9	163.3	0	0	0	111.2	Q53 V54 L55 E67 H68 T73 H74 Q75	Q53-I71 HydrophobicContact CG-CG2 4.37Å; V54-I71 WeakPolarHBondContact O-CD1 3.35Å; L55-I71 HydrophobicContact CD1-CD1 3.97Å; L55-I71 HydrophobicContact CG-CD1 4.12Å; E67-I71 HydrophobicContact CG-CD1 4.12Å; E67-I71 WeakPolarHBondContact O-CG1 3.29Å; E67-I71 PolarHBondContact O-N 3.5Å; H68-I71 PolarHBondContact O-N 2.96Å; I71-T73 VanDerWaalsContact C-N 3.28Å; I71-T73 PolarHBondContact O-N 3.33Å; I71-H74 PolarHBondContact O-N 2.83Å; I71-H74 VanDerWaalsContact O-N 3.17Å; I71-Q75 HydrophobicContact CG2-CG 4.23Å; I71-Q75 WeakPolarHBondContact O-CG 3.49Å; I71-Q75 PolarHBondContact O-N 3.43Å
72	V	98.5	Very high	98.2	Very high	58 Å²	58	59.7 Å²	59.7	35%	0.352	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-38.4	-176.7	170.7	0	0	0	0	111.4	Q53 H68 H74 Q75 A76	Q53-V72 HydrophobicContact CG-CG2 3.97Å; H68-V72 VanDerWaalsContact CE1-CG2 3.49Å; H68-V72 WeakPolarHBondContact CE1-CG2 3.45Å; H68-V72 WeakPolarHBondContact O-CG2 3.27Å; H68-V72 PolarHBondContact O-N 2.95Å; V72-H74 PolarHBondContact O-N 3.48Å; V72-Q75 PolarHBondContact O-N 3.19Å; V72-A76 WeakPolarHBondContact O-CB 3.25Å; V72-A76 PolarHBondContact O-N 2.99Å
73	T	98.2	Very high	98.3	Very high	7 Å²	7	59.6 Å²	59.6	4%	0.043	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-47.3	176.3	-60.8	0	0	0	0	111.4	L69 I71 A76 Y77 Q126 L130	L69-T73 VanDerWaalsContact O-CB 3.27Å; L69-T73 WeakPolarHBondContact O-CB 3.45Å; L69-T73 PolarHBondContact O-N 3.38Å; L69-T73 PolarHBondContact O-OG1 3.18Å; I71-T73 VanDerWaalsContact C-N 3.28Å; I71-T73 PolarHBondContact O-N 3.33Å; T73-A76 PolarHBondContact O-N 3.41Å; T73-Y77 HydrophobicContact CG2-CD2 3.95Å; T73-Y77 HydrophobicContact CG2-CE2 3.63Å; T73-Y77 WeakPolarHBondContact O-CD2 3.34Å; T73-Y77 PolarHBondContact O-N 2.97Å; T73-Y77 VanDerWaalsContact O-N 3.07Å; T73-Q126 PolarHBondContact O-NE2 3.29Å; T73-Q126 VanDerWaalsContact O-NE2 3.1Å; T73-L130 HydrophobicContact CG2-CB 4.16Å; T73-L130 HydrophobicContact CG2-CD1 4.37Å; T73-L130 HydrophobicContact CG2-CD2 4.3Å
74	H	97.6	Very high	98.4	Very high	83 Å²	83	53.7 Å²	53.7	38%	0.384	26%	0.259	S	S	.	.	H	α-helix	trans	-69.1	-39.8	179.5	-71.4	79.6	0	0	0	111.9	F70 I71 V72 A76 Y77 E78	F70-H74 AromaticContact CD1-ND1 3.94Å; F70-H74 AromaticContact CD2-CE1 3.66Å; F70-H74 AromaticContact CE1-CE1 3.75Å; F70-H74 AromaticContact CE1-ND1 3.87Å; F70-H74 AromaticContact CE2-CE1 3.28Å; F70-H74 WeakPolarHBondContact CE2-CE1 3.41Å; F70-H74 AromaticContact CZ-CE1 3.32Å; F70-H74 WeakPolarHBondContact CZ-CE1 3.36Å; F70-H74 AromaticContact CZ-ND1 3.92Å; F70-H74 AromaticContact CZ-NE2 3.84Å; F70-H74 PolarHBondContact O-N 3.16Å; F70-H74 PolarHBondContact O-ND1 2.72Å; I71-H74 PolarHBondContact O-N 2.83Å; I71-H74 VanDerWaalsContact O-N 3.17Å; V72-H74 PolarHBondContact O-N 3.48Å; H74-A76 VanDerWaalsContact C-N 3.32Å; H74-A76 PolarHBondContact O-N 3.27Å; H74-Y77 WeakPolarHBondContact O-CB 3.37Å; H74-Y77 PolarHBondContact O-N 3.42Å; H74-E78 WeakPolarHBondContact O-CG 3.25Å; H74-E78 PolarHBondContact O-N 2.86Å
75	Q	98.3	Very high	98.4	Very high	57 Å²	57	53.1 Å²	53.1	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-60.4	-41.3	174.2	-72.7	176	-19.3	0	0	111.9	A52 I71 V72 E78 L79	A52-Q75 PolarHBondContact O-NE2 2.8Å; I71-Q75 HydrophobicContact CG2-CG 4.23Å; I71-Q75 WeakPolarHBondContact O-CG 3.49Å; I71-Q75 PolarHBondContact O-N 3.43Å; V72-Q75 PolarHBondContact O-N 3.19Å; Q75-E78 PolarHBondContact O-N 2.69Å; Q75-L79 WeakPolarHBondContact O-CG 3.44Å; Q75-L79 PolarHBondContact O-N 3.44Å
76	A	98.5	Very high	98.4	Very high	31 Å²	31	52.6 Å²	52.6	26%	0.256	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-41.9	174.9	0	0	0	0	0	112.1	V72 T73 H74 L79 W80	V72-A76 WeakPolarHBondContact O-CB 3.25Å; V72-A76 PolarHBondContact O-N 2.99Å; T73-A76 PolarHBondContact O-N 3.41Å; H74-A76 VanDerWaalsContact C-N 3.32Å; H74-A76 PolarHBondContact O-N 3.27Å; A76-L79 PolarHBondContact O-N 2.93Å; A76-W80 PolarHBondContact O-N 3.4Å; A76-W80 VanDerWaalsContact O-N 3.15Å
77	Y	98.4	Very high	98.4	Very high	11 Å²	11	51.5 Å²	51.5	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-57.9	-47.4	171.9	-82.2	-64.7	0	0	0	111.9	T73 H74 L79 W80 F81 L123 Q126 F127 W322	T73-Y77 HydrophobicContact CG2-CD2 3.95Å; T73-Y77 HydrophobicContact CG2-CE2 3.63Å; T73-Y77 WeakPolarHBondContact O-CD2 3.34Å; T73-Y77 PolarHBondContact O-N 2.97Å; T73-Y77 VanDerWaalsContact O-N 3.07Å; H74-Y77 WeakPolarHBondContact O-CB 3.37Å; H74-Y77 PolarHBondContact O-N 3.42Å; Y77-L79 VanDerWaalsContact C-N 3.34Å; Y77-L79 PolarHBondContact O-N 3.09Å; Y77-W80 CarbonylContact O-C 3.52Å; Y77-W80 PolarHBondContact O-N 3.13Å; Y77-W80 VanDerWaalsContact O-N 3.13Å; Y77-F81 HydrophobicContact CD1-CZ 4.27Å; Y77-F81 WeakPolarHBondContact O-CD2 3.39Å; Y77-F81 VanDerWaalsContact O-CG 3.27Å; Y77-F81 WeakPolarHBondContact O-CG 3.23Å; Y77-F81 PolarHBondContact O-N 2.72Å; Y77-L123 HydrophobicContact CD1-CB 4.33Å; Y77-L123 HydrophobicContact CD1-CD1 4.23Å; Y77-L123 HydrophobicContact CD1-CD2 3.55Å; Y77-L123 HydrophobicContact CD1-CG 4.23Å; Y77-L123 HydrophobicContact CE1-CB 3.87Å; Y77-L123 HydrophobicContact CE1-CD2 3.76Å; Y77-L123 HydrophobicContact CE1-CG 4.26Å; Y77-L123 WeakPolarHBondContact CE1-O 3.32Å; Y77-L123 PolarHBondContact OH-O 3.38Å; Y77-Q126 HydrophobicContact CE1-CB 4.42Å; Y77-Q126 HydrophobicContact CE2-CG 4.33Å; Y77-F127 HydrophobicContact CE2-CE1 4.4Å; Y77-F127 WeakPolarHBondContact OH-CD1 3.44Å; Y77-F127 WeakPolarHBondContact OH-CD2 3.45Å; Y77-F127 WeakPolarHBondContact OH-CE1 3.37Å; Y77-F127 WeakPolarHBondContact OH-CG 3.45Å; Y77-F127 PolarHBondContact OH-N 2.7Å; Y77-W322 AromaticContact CD1-NE1 3.9Å; Y77-W322 AromaticContact CE1-NE1 3.3Å; Y77-W322 VanDerWaalsContact CE1-NE1 3.3Å; Y77-W322 AromaticContact CZ-NE1 3.88Å
78	E	98.3	Very high	98.4	Very high	61 Å²	61	51.3 Å²	51.3	29%	0.285	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-32.4	-178.1	-70.1	-65.6	163.4	0	0	112.8	H74 Q75 K82 S153 Q155	H74-E78 WeakPolarHBondContact O-CG 3.25Å; H74-E78 PolarHBondContact O-N 2.86Å; Q75-E78 PolarHBondContact O-N 2.69Å; E78-K82 PolarHBondContact O-N 3.25Å; E78-S153 WeakPolarHBondContact OE1-CB 3.39Å; E78-S153 PolarHBondContact OE1-OG 3.32Å; E78-Q155 PolarHBondContact O-NE2 3.27Å; E78-Q155 PolarHBondContact OE2-NE2 2.91Å
79	L	98.7	Very high	98.4	Very high	99 Å²	99	49.6 Å²	49.6	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-64	-43.2	170.4	-73.3	175.4	0	0	0	111.7	Q75 A76 Y77 K82 Q83	Q75-L79 WeakPolarHBondContact O-CG 3.44Å; Q75-L79 PolarHBondContact O-N 3.44Å; A76-L79 PolarHBondContact O-N 2.93Å; Y77-L79 VanDerWaalsContact C-N 3.34Å; Y77-L79 PolarHBondContact O-N 3.09Å; L79-K82 WeakPolarHBondContact O-CB 3.3Å; L79-K82 PolarHBondContact O-N 2.87Å; L79-Q83 PolarHBondContact O-N 3.46Å; L79-Q83 VanDerWaalsContact O-N 3.08Å
80	W	98.8	Very high	98.4	Very high	91 Å²	91	48.9 Å²	48.9	35%	0.345	24%	0.237	S	C	.	.	H	α-helix	trans	-69.7	-37.7	176.8	-74.5	123.8	0	0	0	112.8	A76 Y77 K82 Q83 I84 I119 L122 L123	A76-W80 PolarHBondContact O-N 3.4Å; A76-W80 VanDerWaalsContact O-N 3.15Å; Y77-W80 CarbonylContact O-C 3.52Å; Y77-W80 PolarHBondContact O-N 3.13Å; Y77-W80 VanDerWaalsContact O-N 3.13Å; W80-K82 VanDerWaalsContact C-N 3.28Å; W80-K82 PolarHBondContact O-N 3.16Å; W80-Q83 HydrophobicContact CE3-CB 4.29Å; W80-Q83 PolarHBondContact O-N 3.42Å; W80-Q83 VanDerWaalsContact O-N 3.16Å; W80-I84 VanDerWaalsContact O-CG1 3.3Å; W80-I84 WeakPolarHBondContact O-CG1 3.28Å; W80-I84 PolarHBondContact O-N 2.81Å; W80-I119 HydrophobicContact CB-CG2 3.88Å; W80-I119 HydrophobicContact CD2-CG2 3.96Å; W80-I119 HydrophobicContact CE3-CB 4.41Å; W80-I119 HydrophobicContact CE3-CD1 4.1Å; W80-I119 HydrophobicContact CE3-CG1 3.89Å; W80-I119 HydrophobicContact CE3-CG2 3.66Å; W80-I119 HydrophobicContact CG-CG2 4.08Å; W80-I119 HydrophobicContact CZ3-CD1 4.23Å; W80-I119 HydrophobicContact CZ3-CG1 3.94Å; W80-I119 HydrophobicContact CZ3-CG2 4.5Å; W80-L122 HydrophobicContact CH2-CD2 4.28Å; W80-L122 HydrophobicContact CZ2-CD2 3.47Å; W80-L122 VanDerWaalsContact CZ2-CD2 3.47Å; W80-L123 HydrophobicContact CB-CD1 4.26Å; W80-L123 HydrophobicContact CB-CD2 3.66Å; W80-L123 HydrophobicContact CB-CG 4.33Å; W80-L123 VanDerWaalsContact CD1-CD2 3.49Å; W80-L123 HydrophobicContact CG-CD2 3.74Å
81	F	98.6	Very high	98.4	Very high	7 Å²	7	46.9 Å²	46.9	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-41.3	172.7	-64.7	-26.7	0	0	0	111.2	Y77 Q83 I84 L85 L123 Q155 F156 W322	Y77-F81 HydrophobicContact CD1-CZ 4.27Å; Y77-F81 WeakPolarHBondContact O-CD2 3.39Å; Y77-F81 VanDerWaalsContact O-CG 3.27Å; Y77-F81 WeakPolarHBondContact O-CG 3.23Å; Y77-F81 PolarHBondContact O-N 2.72Å; F81-Q83 VanDerWaalsContact C-N 3.35Å; F81-Q83 PolarHBondContact O-N 3.38Å; F81-I84 HydrophobicContact CD1-CD1 4.48Å; F81-I84 PolarHBondContact O-N 3.13Å; F81-L85 WeakPolarHBondContact O-CB 3.44Å; F81-L85 WeakPolarHBondContact O-CG 3.34Å; F81-L85 PolarHBondContact O-N 3.15Å; F81-L123 HydrophobicContact CD1-CD1 4.03Å; F81-L123 HydrophobicContact CE1-CD1 3.67Å; F81-Q155 HydrophobicContact CB-CB 3.93Å; F81-F156 HydrophobicContact CE1-CD2 4.29Å; F81-F156 HydrophobicContact CE2-CB 4.37Å; F81-F156 HydrophobicContact CE2-CD2 4.25Å; F81-F156 AromaticContact CZ-CD2 3.9Å; F81-F156 HydrophobicContact CZ-CD2 3.9Å; F81-W322 HydrophobicContact CZ-CZ2 4.05Å
82	K	98.6	Very high	98.5	Very high	138 Å²	138	46 Å²	46	60%	0.6	22%	0.223	S	C	*	.	H	α-helix	trans	-60.2	-43.8	173.6	-166.3	171.2	-178.9	173.3	0	112.3	E78 L79 W80 L85 F86	E78-K82 PolarHBondContact O-N 3.25Å; L79-K82 WeakPolarHBondContact O-CB 3.3Å; L79-K82 PolarHBondContact O-N 2.87Å; W80-K82 VanDerWaalsContact C-N 3.28Å; W80-K82 PolarHBondContact O-N 3.16Å; K82-L85 PolarHBondContact O-N 3.08Å; K82-F86 WeakPolarHBondContact O-CB 3.35Å; K82-F86 PolarHBondContact O-N 3.42Å
83	Q	98.8	Very high	98.4	Very high	71 Å²	71	48.3 Å²	48.3	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-62.8	-43.7	176.1	-174.8	61.8	43.2	0	0	111.4	L79 W80 F81 F86 E87 I119	L79-Q83 PolarHBondContact O-N 3.46Å; L79-Q83 VanDerWaalsContact O-N 3.08Å; W80-Q83 HydrophobicContact CE3-CB 4.29Å; W80-Q83 PolarHBondContact O-N 3.42Å; W80-Q83 VanDerWaalsContact O-N 3.16Å; F81-Q83 VanDerWaalsContact C-N 3.35Å; F81-Q83 PolarHBondContact O-N 3.38Å; Q83-F86 WeakPolarHBondContact O-CB 3.46Å; Q83-F86 PolarHBondContact O-N 3.42Å; Q83-E87 PolarHBondContact NE2-OE1 3.03Å; Q83-E87 WeakPolarHBondContact O-CG 3.17Å; Q83-E87 PolarHBondContact O-N 3.31Å; Q83-I119 HydrophobicContact CB-CD1 4.35Å; Q83-I119 HydrophobicContact CG-CD1 3.75Å
84	I	98.8	Very high	98.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-45.9	178	-66.5	167.2	0	0	0	110.5	W80 F81 F86 E87 I88 I116 I119 F120 L123 L159	W80-I84 VanDerWaalsContact O-CG1 3.3Å; W80-I84 WeakPolarHBondContact O-CG1 3.28Å; W80-I84 PolarHBondContact O-N 2.81Å; F81-I84 HydrophobicContact CD1-CD1 4.48Å; F81-I84 PolarHBondContact O-N 3.13Å; I84-F86 VanDerWaalsContact C-N 3.29Å; I84-F86 PolarHBondContact O-N 2.98Å; I84-E87 PolarHBondContact O-N 2.94Å; I84-I88 HydrophobicContact CG2-CD1 3.66Å; I84-I88 HydrophobicContact CG2-CG1 4.18Å; I84-I88 WeakPolarHBondContact O-CB 3.34Å; I84-I88 WeakPolarHBondContact O-CG1 3.39Å; I84-I88 PolarHBondContact O-N 3.07Å; I84-I116 HydrophobicContact CG1-CG2 4.33Å; I84-I116 HydrophobicContact CG2-CD1 4.47Å; I84-I116 HydrophobicContact CG2-CG1 4.17Å; I84-I116 HydrophobicContact CG2-CG2 3.74Å; I84-I119 HydrophobicContact CD1-CB 4.36Å; I84-I119 HydrophobicContact CD1-CG2 3.66Å; I84-I119 HydrophobicContact CG1-CB 4.2Å; I84-I119 HydrophobicContact CG1-CD1 4.15Å; I84-I119 HydrophobicContact CG1-CG2 3.76Å; I84-F120 HydrophobicContact CD1-CD1 4.44Å; I84-F120 HydrophobicContact CD1-CD2 4.28Å; I84-F120 HydrophobicContact CD1-CE1 4.14Å; I84-F120 HydrophobicContact CD1-CE2 3.98Å; I84-F120 HydrophobicContact CD1-CG 4.49Å; I84-F120 HydrophobicContact CD1-CZ 3.9Å; I84-F120 HydrophobicContact CG2-CE2 4.36Å; I84-L123 HydrophobicContact CD1-CD1 4.09Å; I84-L159 HydrophobicContact CG2-CD1 3.45Å; I84-L159 VanDerWaalsContact CG2-CD1 3.45Å
85	L	98.6	Very high	98.4	Very high	13 Å²	13	45.4 Å²	45.4	7%	0.068	22%	0.217	C	C	.	.	H	α-helix	trans	-57.8	-44.1	176	-74.4	169.4	0	0	0	111.3	F81 K82 E87 I88 D89 Q155 L158 L159 K162	F81-L85 WeakPolarHBondContact O-CB 3.44Å; F81-L85 WeakPolarHBondContact O-CG 3.34Å; F81-L85 PolarHBondContact O-N 3.15Å; K82-L85 PolarHBondContact O-N 3.08Å; L85-E87 VanDerWaalsContact C-N 3.35Å; L85-E87 PolarHBondContact O-N 3.21Å; L85-I88 PolarHBondContact O-N 2.91Å; L85-D89 WeakPolarHBondContact O-CB 3.29Å; L85-D89 PolarHBondContact O-N 3.43Å; L85-Q155 HydrophobicContact CD1-CB 3.77Å; L85-Q155 HydrophobicContact CD1-CG 3.97Å; L85-L158 HydrophobicContact CD1-CB 4.28Å; L85-L158 HydrophobicContact CD1-CD1 4.47Å; L85-L158 HydrophobicContact CD2-CB 3.88Å; L85-L159 HydrophobicContact CD2-CB 4.29Å; L85-K162 HydrophobicContact CD2-CD 3.79Å
86	F	98.6	Very high	98.3	Very high	144 Å²	144	46.7 Å²	46.7	63%	0.632	22%	0.224	S	C	*	.	H	α-helix	trans	-60.5	-42.4	176.7	-169.4	-99	0	0	0	112.5	K82 Q83 I84 S90	K82-F86 WeakPolarHBondContact O-CB 3.35Å; K82-F86 PolarHBondContact O-N 3.42Å; Q83-F86 WeakPolarHBondContact O-CB 3.46Å; Q83-F86 PolarHBondContact O-N 3.42Å; I84-F86 VanDerWaalsContact C-N 3.29Å; I84-F86 PolarHBondContact O-N 2.98Å; F86-S90 VanDerWaalsContact O-CB 3.32Å; F86-S90 WeakPolarHBondContact O-CB 3.43Å; F86-S90 PolarHBondContact O-N 2.91Å; F86-S90 PolarHBondContact O-OG 3.1Å
87	E	98.8	Very high	98.2	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.028	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-47.2	174.4	-62.8	-59.9	162.7	0	0	111.7	Q83 I84 L85 S90 V91 R112 R115 I116	Q83-E87 PolarHBondContact NE2-OE1 3.03Å; Q83-E87 WeakPolarHBondContact O-CG 3.17Å; Q83-E87 PolarHBondContact O-N 3.31Å; I84-E87 PolarHBondContact O-N 2.94Å; L85-E87 VanDerWaalsContact C-N 3.35Å; L85-E87 PolarHBondContact O-N 3.21Å; E87-S90 PolarHBondContact O-N 3.42Å; E87-S90 PolarHBondContact O-OG 3.33Å; E87-V91 WeakPolarHBondContact O-CG2 2.98Å; E87-V91 PolarHBondContact O-N 2.78Å; E87-R112 WeakPolarHBondContact OE2-CD 3.26Å; E87-R112 VanDerWaalsContact OE2-CG 3.25Å; E87-R112 WeakPolarHBondContact OE2-CG 3.33Å; E87-R115 VanDerWaalsContact CD-NH1 3.26Å; E87-R115 VanDerWaalsContact OE1-CD 3.23Å; E87-R115 WeakPolarHBondContact OE1-CD 3.48Å; E87-R115 IonicContact OE1-CZ 3.67Å; E87-R115 IonicContact OE1-NE 3.03Å; E87-R115 IonicContact OE1-NH1 2.72Å; E87-R115 PolarHBondContact OE1-NH1 2.76Å; E87-R115 IonicContact OE2-NH1 3.13Å; E87-R115 PolarHBondContact OE2-NH1 2.85Å; E87-R115 VanDerWaalsContact OE2-NH1 3.13Å; E87-I116 HydrophobicContact CB-CD1 3.73Å; E87-I116 HydrophobicContact CB-CG1 3.7Å; E87-I116 HydrophobicContact CG-CG1 4.23Å
88	I	98.1	Very high	98	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-49.8	-179.1	-72.5	176.2	0	0	0	110.7	I84 L85 S90 V91 R92 I116 L159 K162 I163	I84-I88 HydrophobicContact CG2-CD1 3.66Å; I84-I88 HydrophobicContact CG2-CG1 4.18Å; I84-I88 WeakPolarHBondContact O-CB 3.34Å; I84-I88 WeakPolarHBondContact O-CG1 3.39Å; I84-I88 PolarHBondContact O-N 3.07Å; L85-I88 PolarHBondContact O-N 2.91Å; I88-S90 VanDerWaalsContact C-N 3.28Å; I88-S90 PolarHBondContact O-N 3.17Å; I88-V91 PolarHBondContact O-N 3.45Å; I88-V91 VanDerWaalsContact O-N 3.09Å; I88-R92 HydrophobicContact CG2-CG 4.1Å; I88-R92 VanDerWaalsContact O-CG 3.28Å; I88-R92 WeakPolarHBondContact O-CG 3.2Å; I88-R92 PolarHBondContact O-N 2.91Å; I88-I116 HydrophobicContact CD1-CD1 4.35Å; I88-I116 HydrophobicContact CG1-CD1 3.47Å; I88-I116 VanDerWaalsContact CG1-CD1 3.47Å; I88-L159 HydrophobicContact CD1-CD1 3.43Å; I88-L159 VanDerWaalsContact CD1-CD1 3.43Å; I88-K162 HydrophobicContact CG2-CB 3.98Å; I88-I163 HydrophobicContact CD1-CD1 4.1Å; I88-I163 HydrophobicContact CD1-CG1 3.72Å
89	D	98.4	Very high	97.8	Very high	55 Å²	55	50.4 Å²	50.4	29%	0.294	25%	0.25	S	C	.	.	H	α-helix	trans	-61.8	-40.1	-179.9	-75.6	-29.3	0	0	0	111.1	L85 V91 R92 E93 K162	L85-D89 WeakPolarHBondContact O-CB 3.29Å; L85-D89 PolarHBondContact O-N 3.43Å; D89-V91 VanDerWaalsContact C-N 3.29Å; D89-V91 PolarHBondContact O-N 3.42Å; D89-R92 PolarHBondContact O-N 3.42Å; D89-R92 IonicContact OD1-CZ 3.35Å; D89-R92 IonicContact OD1-NH1 3.28Å; D89-R92 PolarHBondContact OD1-NH1 2.73Å; D89-E93 WeakPolarHBondContact O-CB 3.17Å; D89-E93 PolarHBondContact O-N 2.97Å; D89-K162 WeakPolarHBondContact OD1-CD 3.24Å; D89-K162 WeakPolarHBondContact OD1-CE 3.27Å; D89-K162 IonicContact OD1-NZ 2.77Å; D89-K162 PolarHBondContact OD1-NZ 2.96Å; D89-K162 IonicContact OD2-NZ 3.86Å; D89-K162 PolarHBondContact OD2-NZ 2.99Å
90	S	98.4	Very high	97.5	Very high	25 Å²	25	45.9 Å²	45.9	18%	0.175	23%	0.226	C	C	.	.	H	α-helix	trans	-66	-30	176	85	0	0	0	0	113.7	F86 E87 I88 I94 R112	F86-S90 VanDerWaalsContact O-CB 3.32Å; F86-S90 WeakPolarHBondContact O-CB 3.43Å; F86-S90 PolarHBondContact O-N 2.91Å; F86-S90 PolarHBondContact O-OG 3.1Å; E87-S90 PolarHBondContact O-N 3.42Å; E87-S90 PolarHBondContact O-OG 3.33Å; I88-S90 VanDerWaalsContact C-N 3.28Å; I88-S90 PolarHBondContact O-N 3.17Å; S90-I94 WeakPolarHBondContact O-CD1 3.33Å; S90-I94 WeakPolarHBondContact O-CG1 3.4Å; S90-I94 PolarHBondContact O-N 3.5Å; S90-R112 PolarHBondContact O-NH1 3.2Å; S90-R112 VanDerWaalsContact OG-CD 3.25Å; S90-R112 WeakPolarHBondContact OG-CD 3.27Å; S90-R112 PolarHBondContact OG-NH1 3.28Å
91	V	98.5	Very high	97.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-76.5	-47.6	174.4	170.5	0	0	0	0	109.6	E87 I88 D89 E93 I94 F95 V109 R112 I113 L199	E87-V91 WeakPolarHBondContact O-CG2 2.98Å; E87-V91 PolarHBondContact O-N 2.78Å; I88-V91 PolarHBondContact O-N 3.45Å; I88-V91 VanDerWaalsContact O-N 3.09Å; D89-V91 VanDerWaalsContact C-N 3.29Å; D89-V91 PolarHBondContact O-N 3.42Å; V91-E93 PolarHBondContact O-N 3.44Å; V91-I94 WeakPolarHBondContact O-CB 3.46Å; V91-I94 PolarHBondContact O-N 3.29Å; V91-F95 HydrophobicContact CG1-CD2 4.06Å; V91-F95 HydrophobicContact CG1-CE2 3.82Å; V91-F95 WeakPolarHBondContact O-CD2 3.46Å; V91-F95 PolarHBondContact O-N 3.18Å; V91-V109 HydrophobicContact CG1-CG1 3.99Å; V91-R112 HydrophobicContact CG2-CB 3.67Å; V91-R112 HydrophobicContact CG2-CG 4.49Å; V91-I113 HydrophobicContact CB-CD1 4.33Å; V91-I113 HydrophobicContact CG1-CD1 4.06Å; V91-I113 HydrophobicContact CG1-CG1 4.44Å; V91-I113 HydrophobicContact CG2-CD1 4.04Å; V91-I113 HydrophobicContact CG2-CG1 4.38Å; V91-L199 HydrophobicContact CG1-CD1 4.04Å
92	R	98.3	Very high	96.8	Very high	8 Å²	8	49.8 Å²	49.8	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-53.3	-44.8	176.2	-70	170.4	63.4	-125.1	-1	110.9	I88 D89 I94 F95 I96 E196 P197 L202	I88-R92 HydrophobicContact CG2-CG 4.1Å; I88-R92 VanDerWaalsContact O-CG 3.28Å; I88-R92 WeakPolarHBondContact O-CG 3.2Å; I88-R92 PolarHBondContact O-N 2.91Å; D89-R92 PolarHBondContact O-N 3.42Å; D89-R92 IonicContact OD1-CZ 3.35Å; D89-R92 IonicContact OD1-NH1 3.28Å; D89-R92 PolarHBondContact OD1-NH1 2.73Å; R92-I94 VanDerWaalsContact C-N 3.34Å; R92-I94 PolarHBondContact O-N 3.01Å; R92-F95 PolarHBondContact O-N 3.33Å; R92-I96 HydrophobicContact CB-CD1 4.34Å; R92-I96 VanDerWaalsContact O-CG1 3.28Å; R92-I96 WeakPolarHBondContact O-CG1 3.28Å; R92-I96 PolarHBondContact O-N 3.14Å; R92-E196 IonicContact CZ-OE2 3.9Å; R92-E196 VanDerWaalsContact CZ-OE2 3.28Å; R92-E196 IonicContact NH1-OE2 3.74Å; R92-E196 PolarHBondContact NH1-OE2 3.03Å; R92-E196 IonicContact NH2-OE2 3.78Å; R92-E196 PolarHBondContact NH2-OE2 3.15Å; R92-P197 VanDerWaalsContact CZ-O 3.3Å; R92-P197 PolarHBondContact NE-O 2.87Å; R92-P197 PolarHBondContact NH2-O 2.88Å; R92-L202 HydrophobicContact CB-CD1 3.75Å; R92-L202 HydrophobicContact CG-CD1 3.89Å
93	E	98	Very high	96.4	Very high	107 Å²	107	45.7 Å²	45.7	50%	0.5	23%	0.225	S	C	.	.	H	α-helix	trans	-60	-39.9	177.3	-175.3	53.1	-142.2	0	0	112.9	D89 V91 F95 I96 S97	D89-E93 WeakPolarHBondContact O-CB 3.17Å; D89-E93 PolarHBondContact O-N 2.97Å; V91-E93 PolarHBondContact O-N 3.44Å; E93-F95 VanDerWaalsContact C-N 3.26Å; E93-F95 PolarHBondContact O-N 2.95Å; E93-I96 PolarHBondContact O-N 2.5Å; E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.38Å; E93-S97 PolarHBondContact O-N 3.44Å; E93-S97 PolarHBondContact O-OG 3.32Å
94	I	97.9	Very high	96	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-35.8	176	-69.5	165.4	0	0	0	111.4	S90 V91 R92 H99 V100 N105 K108 V109	S90-I94 WeakPolarHBondContact O-CD1 3.33Å; S90-I94 WeakPolarHBondContact O-CG1 3.4Å; S90-I94 PolarHBondContact O-N 3.5Å; V91-I94 WeakPolarHBondContact O-CB 3.46Å; V91-I94 PolarHBondContact O-N 3.29Å; R92-I94 VanDerWaalsContact C-N 3.34Å; R92-I94 PolarHBondContact O-N 3.01Å; I94-H99 HydrophobicContact CG2-CB 4.14Å; I94-H99 PolarHBondContact O-N 3.14Å; I94-H99 VanDerWaalsContact O-N 3.14Å; I94-V100 HydrophobicContact CG2-CB 4.18Å; I94-V100 PolarHBondContact O-N 3.07Å; I94-N105 HydrophobicContact CG2-CB 4.37Å; I94-K108 HydrophobicContact CD1-CD 3.97Å; I94-K108 HydrophobicContact CD1-CG 4.49Å; I94-V109 HydrophobicContact CB-CG2 4.37Å; I94-V109 HydrophobicContact CD1-CG2 4.12Å; I94-V109 HydrophobicContact CG2-CG2 3.78Å
95	F	97.6	Very high	95.8	Very high	14 Å²	14	49.5 Å²	49.5	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-75.1	-47.5	175.7	-78.5	-106.9	0	0	0	111.7	V91 R92 E93 S97 G98 V100 V109 L202 V203 W206 L308	V91-F95 HydrophobicContact CG1-CD2 4.06Å; V91-F95 HydrophobicContact CG1-CE2 3.82Å; V91-F95 WeakPolarHBondContact O-CD2 3.46Å; V91-F95 PolarHBondContact O-N 3.18Å; R92-F95 PolarHBondContact O-N 3.33Å; E93-F95 VanDerWaalsContact C-N 3.26Å; E93-F95 PolarHBondContact O-N 2.95Å; F95-S97 PolarHBondContact O-N 3.17Å; F95-G98 PolarHBondContact O-N 2.9Å; F95-G98 VanDerWaalsContact O-N 3.07Å; F95-V100 HydrophobicContact CB-CG1 4.44Å; F95-V100 HydrophobicContact CD1-CB 4.2Å; F95-V100 HydrophobicContact CD1-CG1 3.9Å; F95-V100 HydrophobicContact CD1-CG2 3.99Å; F95-V100 HydrophobicContact CD2-CB 4.38Å; F95-V100 HydrophobicContact CD2-CG2 4.23Å; F95-V100 HydrophobicContact CE1-CB 4.45Å; F95-V100 HydrophobicContact CE1-CG1 4.41Å; F95-V100 HydrophobicContact CE1-CG2 3.74Å; F95-V100 HydrophobicContact CE2-CG2 4Å; F95-V100 HydrophobicContact CG-CB 4.17Å; F95-V100 HydrophobicContact CG-CG1 4.14Å; F95-V100 HydrophobicContact CG-CG2 4.23Å; F95-V100 HydrophobicContact CZ-CG2 3.75Å; F95-V109 HydrophobicContact CE2-CG1 3.76Å; F95-V109 HydrophobicContact CE2-CG2 4.22Å; F95-V109 HydrophobicContact CZ-CG1 4.25Å; F95-L202 HydrophobicContact CB-CB 3.82Å; F95-L202 HydrophobicContact CB-CD1 4.11Å; F95-L202 HydrophobicContact CB-CD2 4.02Å; F95-L202 HydrophobicContact CB-CG 4.2Å; F95-L202 HydrophobicContact CD1-CB 4.07Å; F95-L202 WeakPolarHBondContact CD1-O 3.43Å; F95-L202 HydrophobicContact CG-CB 4.08Å; F95-V203 HydrophobicContact CE1-CG2 4.44Å; F95-V203 HydrophobicContact CZ-CG2 4.4Å; F95-W206 HydrophobicContact CD1-CB 4Å; F95-W206 HydrophobicContact CE1-CB 3.59Å; F95-W206 HydrophobicContact CE1-CD2 4.27Å; F95-W206 AromaticContact CE1-CG 3.78Å; F95-W206 HydrophobicContact CE1-CG 3.78Å; F95-L308 HydrophobicContact CZ-CD2 4.32Å
96	I	96.8	Very high	95.6	Very high	83 Å²	83	49.3 Å²	49.3	43%	0.426	24%	0.237	S	C	.	.	H	α-helix	trans	-59	-48	-178	-69.6	165.7	0	0	0	110.9	R92 E93 G98 L202	R92-I96 HydrophobicContact CB-CD1 4.34Å; R92-I96 VanDerWaalsContact O-CG1 3.28Å; R92-I96 WeakPolarHBondContact O-CG1 3.28Å; R92-I96 PolarHBondContact O-N 3.14Å; E93-I96 PolarHBondContact O-N 2.5Å; I96-G98 PolarHBondContact O-N 3.48Å; I96-G98 VanDerWaalsContact O-N 3.16Å; I96-L202 HydrophobicContact CD1-CD1 4.2Å; I96-L202 HydrophobicContact CG1-CD1 3.89Å; I96-L202 HydrophobicContact CG1-CD2 3.69Å; I96-L202 HydrophobicContact CG1-CG 4.45Å
97	S	95.9	Very high	95.4	Very high	50 Å²	50	47.6 Å²	47.6	35%	0.35	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-0	179.2	59.8	0	0	0	0	114.1	E93 F95 H99	E93-S97 VanDerWaalsContact O-CB 3.32Å; E93-S97 WeakPolarHBondContact O-CB 3.38Å; E93-S97 PolarHBondContact O-N 3.44Å; E93-S97 PolarHBondContact O-OG 3.32Å; F95-S97 PolarHBondContact O-N 3.17Å; S97-H99 WeakPolarHBondContact CB-ND1 3.33Å; S97-H99 PolarHBondContact O-N 3.09Å; S97-H99 PolarHBondContact OG-ND1 2.96Å
98	G	93.9	Very high	95.3	Very high	28 Å²	28	51.9 Å²	51.9	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	75.5	-3	179.6	0	0	0	0	0	115.3	F95 I96 V100 R101	F95-G98 PolarHBondContact O-N 2.9Å; F95-G98 VanDerWaalsContact O-N 3.07Å; I96-G98 PolarHBondContact O-N 3.48Å; I96-G98 VanDerWaalsContact O-N 3.16Å; G98-V100 PolarHBondContact O-N 2.98Å; G98-V100 VanDerWaalsContact O-N 3.09Å; G98-R101 WeakPolarHBondContact O-CB 3.43Å; G98-R101 WeakPolarHBondContact O-CG 3.42Å; G98-R101 PolarHBondContact O-N 3.21Å
99	H	93.8	Very high	95.3	Very high	104 Å²	104	51.9 Å²	51.9	48%	0.481	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-59.8	-20.6	178.1	-72.9	100.6	0	0	0	113.6	I94 S97 R101 D102 N105	I94-H99 HydrophobicContact CG2-CB 4.14Å; I94-H99 PolarHBondContact O-N 3.14Å; I94-H99 VanDerWaalsContact O-N 3.14Å; S97-H99 WeakPolarHBondContact CB-ND1 3.33Å; S97-H99 PolarHBondContact O-N 3.09Å; S97-H99 PolarHBondContact OG-ND1 2.96Å; H99-R101 PolarHBondContact O-N 3.16Å; H99-D102 PolarHBondContact O-N 2.92Å; H99-N105 PolarHBondContact O-ND2 3.02Å
100	V	92.6	Very high	95.3	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.018	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-62.7	-21.4	172.2	74.1	0	0	0	0	113.4	I94 F95 G98 D102 M106	I94-V100 HydrophobicContact CG2-CB 4.18Å; I94-V100 PolarHBondContact O-N 3.07Å; F95-V100 HydrophobicContact CB-CG1 4.44Å; F95-V100 HydrophobicContact CD1-CB 4.2Å; F95-V100 HydrophobicContact CD1-CG1 3.9Å; F95-V100 HydrophobicContact CD1-CG2 3.99Å; F95-V100 HydrophobicContact CD2-CB 4.38Å; F95-V100 HydrophobicContact CD2-CG2 4.23Å; F95-V100 HydrophobicContact CE1-CB 4.45Å; F95-V100 HydrophobicContact CE1-CG1 4.41Å; F95-V100 HydrophobicContact CE1-CG2 3.74Å; F95-V100 HydrophobicContact CE2-CG2 4Å; F95-V100 HydrophobicContact CG-CB 4.17Å; F95-V100 HydrophobicContact CG-CG1 4.14Å; F95-V100 HydrophobicContact CG-CG2 4.23Å; F95-V100 HydrophobicContact CZ-CG2 3.75Å; G98-V100 PolarHBondContact O-N 2.98Å; G98-V100 VanDerWaalsContact O-N 3.09Å; V100-D102 VanDerWaalsContact C-N 3.26Å; V100-D102 PolarHBondContact O-N 3.47Å; V100-M106 HydrophobicContact CG2-SD 3.78Å
101	R	90.6	Very high	95.3	Very high	159 Å²	159	51.7 Å²	51.7	60%	0.6	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-68	-28.8	175.6	-66	178.5	177.9	-109.4	3.6	112.2	G98 H99 E103	G98-R101 WeakPolarHBondContact O-CB 3.43Å; G98-R101 WeakPolarHBondContact O-CG 3.42Å; G98-R101 PolarHBondContact O-N 3.21Å; H99-R101 PolarHBondContact O-N 3.16Å; R101-E103 PolarHBondContact O-N 2.77Å
102	D	91.4	Very high	95.3	Very high	22 Å²	22	54.7 Å²	54.7	12%	0.118	26%	0.263	C	S	.	.	S	Bend	trans	-78	105.3	168	176.2	5.4	0	0	0	108.9	H99 V100 R104 N105	H99-D102 PolarHBondContact O-N 2.92Å; V100-D102 VanDerWaalsContact C-N 3.26Å; V100-D102 PolarHBondContact O-N 3.47Å; D102-R104 VanDerWaalsContact CG-NE 3.35Å; D102-R104 PolarHBondContact O-N 3.35Å; D102-R104 VanDerWaalsContact OD1-CB 3.29Å; D102-R104 WeakPolarHBondContact OD1-CB 3.35Å; D102-R104 VanDerWaalsContact OD1-CG 3.27Å; D102-R104 WeakPolarHBondContact OD1-CG 3.34Å; D102-R104 IonicContact OD1-CZ 3.45Å; D102-R104 PolarHBondContact OD1-N 3.34Å; D102-R104 VanDerWaalsContact OD1-N 3.12Å; D102-R104 IonicContact OD1-NE 2.95Å; D102-R104 PolarHBondContact OD1-NE 2.83Å; D102-R104 IonicContact OD1-NH2 3.59Å; D102-R104 IonicContact OD2-CZ 3.21Å; D102-R104 IonicContact OD2-NE 2.96Å; D102-R104 PolarHBondContact OD2-NE 3.11Å; D102-R104 IonicContact OD2-NH2 2.7Å; D102-R104 PolarHBondContact OD2-NH2 3.31Å; D102-N105 WeakPolarHBondContact O-CB 3.4Å; D102-N105 PolarHBondContact O-N 2.86Å
103	E	89.8	Confident	95.3	Very high	51 Å²	51	54.4 Å²	54.4	24%	0.238	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-58.3	-20.1	-175.1	-66.1	-177	178.6	0	0	113.2	R101 N105 M106 R301 A390	R101-E103 PolarHBondContact O-N 2.77Å; E103-N105 PolarHBondContact O-N 3.26Å; E103-N105 VanDerWaalsContact O-N 3.16Å; E103-M106 VanDerWaalsContact O-CB 3.29Å; E103-M106 WeakPolarHBondContact O-CB 3.4Å; E103-M106 WeakPolarHBondContact O-CG 3.37Å; E103-M106 PolarHBondContact O-N 3.35Å; E103-R301 IonicContact OE1-CZ 2.83Å; E103-R301 IonicContact OE1-NE 3.86Å; E103-R301 PolarHBondContact OE1-NE 3.27Å; E103-R301 IonicContact OE1-NH2 3.41Å; E103-R301 PolarHBondContact OE1-NH2 3.36Å; E103-R301 IonicContact OE2-NE 2.78Å; E103-R301 PolarHBondContact OE2-NE 3.49Å; E103-A390 WeakPolarHBondContact OE2-CA 3.5Å; E103-A390 VanDerWaalsContact OE2-CB 3.3Å; E103-A390 WeakPolarHBondContact OE2-CB 3.27Å
104	R	90.4	Very high	95.4	Very high	132 Å²	132	53.4 Å²	53.4	50%	0.498	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.9	-25.7	173.5	-60.9	178.7	-64.8	-134.8	5.9	112.4	D102 C392	D102-R104 VanDerWaalsContact CG-NE 3.35Å; D102-R104 PolarHBondContact O-N 3.35Å; D102-R104 VanDerWaalsContact OD1-CB 3.29Å; D102-R104 WeakPolarHBondContact OD1-CB 3.35Å; D102-R104 VanDerWaalsContact OD1-CG 3.27Å; D102-R104 WeakPolarHBondContact OD1-CG 3.34Å; D102-R104 IonicContact OD1-CZ 3.45Å; D102-R104 PolarHBondContact OD1-N 3.34Å; D102-R104 VanDerWaalsContact OD1-N 3.12Å; D102-R104 IonicContact OD1-NE 2.95Å; D102-R104 PolarHBondContact OD1-NE 2.83Å; D102-R104 IonicContact OD1-NH2 3.59Å; D102-R104 IonicContact OD2-CZ 3.21Å; D102-R104 IonicContact OD2-NE 2.96Å; D102-R104 PolarHBondContact OD2-NE 3.11Å; D102-R104 IonicContact OD2-NH2 2.7Å; D102-R104 PolarHBondContact OD2-NH2 3.31Å; R104-C392 PolarHBondContact NH1-SG 3.08Å; R104-C392 VanDerWaalsContact NH1-SG 3.37Å
105	N	94.9	Very high	95.4	Very high	20 Å²	20	57.8 Å²	57.8	11%	0.107	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-80.7	-12.6	176.7	-69.8	-55.2	0	0	0	113.5	I94 H99 D102 E103 L107 K108 V109	I94-N105 HydrophobicContact CG2-CB 4.37Å; H99-N105 PolarHBondContact O-ND2 3.02Å; D102-N105 WeakPolarHBondContact O-CB 3.4Å; D102-N105 PolarHBondContact O-N 2.86Å; E103-N105 PolarHBondContact O-N 3.26Å; E103-N105 VanDerWaalsContact O-N 3.16Å; N105-L107 VanDerWaalsContact C-N 3.33Å; N105-L107 PolarHBondContact O-N 3.1Å; N105-K108 WeakPolarHBondContact O-CB 3.3Å; N105-K108 PolarHBondContact O-N 3.48Å; N105-K108 VanDerWaalsContact O-N 3.08Å; N105-K108 PolarHBondContact OD1-NZ 2.91Å; N105-V109 PolarHBondContact O-N 3.27Å
106	M	94.3	Very high	95.5	Very high	9 Å²	9	57.1 Å²	57.1	4%	0.044	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-37.6	-177.1	-71.4	-58.9	-60.2	0	0	112.7	V100 E103 K108 V109 N110 W206 V304 P305 L308	V100-M106 HydrophobicContact CG2-SD 3.78Å; E103-M106 VanDerWaalsContact O-CB 3.29Å; E103-M106 WeakPolarHBondContact O-CB 3.4Å; E103-M106 WeakPolarHBondContact O-CG 3.37Å; E103-M106 PolarHBondContact O-N 3.35Å; M106-K108 VanDerWaalsContact C-N 3.31Å; M106-K108 PolarHBondContact O-N 3.36Å; M106-V109 PolarHBondContact O-N 3.38Å; M106-N110 WeakPolarHBondContact O-CB 3.5Å; M106-N110 PolarHBondContact O-N 3.46Å; M106-W206 HydrophobicContact CE-CH2 4.21Å; M106-W206 HydrophobicContact CE-CZ2 3.58Å; M106-W206 HydrophobicContact SD-CZ2 4.37Å; M106-V304 HydrophobicContact CB-CB 4.32Å; M106-V304 HydrophobicContact CB-CG1 3.81Å; M106-P305 HydrophobicContact CE-CG 4.29Å; M106-L308 HydrophobicContact CE-CD2 3.78Å
107	L	94.8	Very high	95.6	Very high	108 Å²	108	53.2 Å²	53.2	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-63	-40.1	175.4	179.9	61.7	0	0	0	111.3	N105 T111	N105-L107 VanDerWaalsContact C-N 3.33Å; N105-L107 PolarHBondContact O-N 3.1Å; L107-T111 VanDerWaalsContact O-CB 3.28Å; L107-T111 WeakPolarHBondContact O-CB 3.43Å; L107-T111 PolarHBondContact O-N 3.33Å; L107-T111 PolarHBondContact O-OG1 3.29Å
108	K	97.6	Very high	95.7	Very high	95 Å²	95	55.3 Å²	55.3	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-46.6	177.2	-175.7	-169.7	-64.2	156.3	0	110.9	I94 N105 M106 T111 R112	I94-K108 HydrophobicContact CD1-CD 3.97Å; I94-K108 HydrophobicContact CD1-CG 4.49Å; N105-K108 WeakPolarHBondContact O-CB 3.3Å; N105-K108 PolarHBondContact O-N 3.48Å; N105-K108 VanDerWaalsContact O-N 3.08Å; N105-K108 PolarHBondContact OD1-NZ 2.91Å; M106-K108 VanDerWaalsContact C-N 3.31Å; M106-K108 PolarHBondContact O-N 3.36Å; K108-T111 PolarHBondContact O-N 2.97Å; K108-R112 WeakPolarHBondContact O-CG 3.48Å; K108-R112 PolarHBondContact O-N 3.1Å; K108-R112 VanDerWaalsContact O-N 3.09Å
109	V	98.1	Very high	95.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-54.7	175.2	169.1	0	0	0	0	110.5	V91 I94 F95 N105 M106 T111 R112 I113 L308	V91-V109 HydrophobicContact CG1-CG1 3.99Å; I94-V109 HydrophobicContact CB-CG2 4.37Å; I94-V109 HydrophobicContact CD1-CG2 4.12Å; I94-V109 HydrophobicContact CG2-CG2 3.78Å; F95-V109 HydrophobicContact CE2-CG1 3.76Å; F95-V109 HydrophobicContact CE2-CG2 4.22Å; F95-V109 HydrophobicContact CZ-CG1 4.25Å; N105-V109 PolarHBondContact O-N 3.27Å; M106-V109 PolarHBondContact O-N 3.38Å; V109-T111 VanDerWaalsContact C-N 3.33Å; V109-T111 PolarHBondContact O-N 3.48Å; V109-R112 PolarHBondContact O-N 3.02Å; V109-I113 PolarHBondContact O-N 2.89Å; V109-L308 HydrophobicContact CG1-CD1 3.98Å; V109-L308 HydrophobicContact CG1-CD2 4.01Å
110	N	97.9	Very high	96.2	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.07	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-41.7	-179.5	-176.1	56.8	0	0	0	112.1	M106 R112 I113 H114 V304 Q307 L308 S311	M106-N110 WeakPolarHBondContact O-CB 3.5Å; M106-N110 PolarHBondContact O-N 3.46Å; N110-R112 VanDerWaalsContact C-N 3.32Å; N110-R112 PolarHBondContact O-N 3.07Å; N110-I113 PolarHBondContact O-N 3.35Å; N110-H114 VanDerWaalsContact O-CB 3.24Å; N110-H114 WeakPolarHBondContact O-CB 3.29Å; N110-H114 PolarHBondContact O-N 3.3Å; N110-V304 HydrophobicContact CB-CG1 3.92Å; N110-Q307 PolarHBondContact ND2-OE1 3.47Å; N110-Q307 VanDerWaalsContact ND2-OE1 3.11Å; N110-Q307 VanDerWaalsContact OD1-C 3.24Å; N110-Q307 PolarHBondContact OD1-O 2.99Å; N110-L308 WeakPolarHBondContact OD1-CA 3.26Å; N110-L308 PolarHBondContact OD1-N 3.36Å; N110-S311 PolarHBondContact OD1-OG 2.92Å
111	T	98.4	Very high	96.4	Very high	63 Å²	63	54.9 Å²	54.9	39%	0.387	24%	0.24	S	C	.	.	H	α-helix	trans	-60.7	-39.9	177.7	-59.4	0	0	0	0	112.2	L107 K108 V109 R115	L107-T111 VanDerWaalsContact O-CB 3.28Å; L107-T111 WeakPolarHBondContact O-CB 3.43Å; L107-T111 PolarHBondContact O-N 3.33Å; L107-T111 PolarHBondContact O-OG1 3.29Å; K108-T111 PolarHBondContact O-N 2.97Å; V109-T111 VanDerWaalsContact C-N 3.33Å; V109-T111 PolarHBondContact O-N 3.48Å; T111-R115 WeakPolarHBondContact O-CB 3.34Å; T111-R115 PolarHBondContact O-N 3.2Å
112	R	98.7	Very high	96.8	Very high	64 Å²	64	51.1 Å²	51.1	24%	0.242	23%	0.232	C	C	.	.	H	α-helix	trans	-72.1	-42.5	178.9	-68.6	-175	179.7	167.9	-1.6	112.2	E87 S90 V91 K108 V109 N110 H114 R115 I116	E87-R112 WeakPolarHBondContact OE2-CD 3.26Å; E87-R112 VanDerWaalsContact OE2-CG 3.25Å; E87-R112 WeakPolarHBondContact OE2-CG 3.33Å; S90-R112 PolarHBondContact O-NH1 3.2Å; S90-R112 VanDerWaalsContact OG-CD 3.25Å; S90-R112 WeakPolarHBondContact OG-CD 3.27Å; S90-R112 PolarHBondContact OG-NH1 3.28Å; V91-R112 HydrophobicContact CG2-CB 3.67Å; V91-R112 HydrophobicContact CG2-CG 4.49Å; K108-R112 WeakPolarHBondContact O-CG 3.48Å; K108-R112 PolarHBondContact O-N 3.1Å; K108-R112 VanDerWaalsContact O-N 3.09Å; V109-R112 PolarHBondContact O-N 3.02Å; N110-R112 VanDerWaalsContact C-N 3.32Å; N110-R112 PolarHBondContact O-N 3.07Å; R112-H114 VanDerWaalsContact C-N 3.34Å; R112-H114 PolarHBondContact O-N 3.25Å; R112-R115 WeakPolarHBondContact O-CB 3.49Å; R112-R115 PolarHBondContact O-N 3.37Å; R112-I116 WeakPolarHBondContact O-CG1 3.36Å; R112-I116 PolarHBondContact O-N 3.03Å; R112-I116 VanDerWaalsContact O-N 3.08Å
113	I	98.6	Very high	97.2	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-42.4	173.5	-60.9	-57.2	0	0	0	110.9	V91 V109 N110 R115 I116 V117 L199 L308 L312	V91-I113 HydrophobicContact CB-CD1 4.33Å; V91-I113 HydrophobicContact CG1-CD1 4.06Å; V91-I113 HydrophobicContact CG1-CG1 4.44Å; V91-I113 HydrophobicContact CG2-CD1 4.04Å; V91-I113 HydrophobicContact CG2-CG1 4.38Å; V109-I113 PolarHBondContact O-N 2.89Å; N110-I113 PolarHBondContact O-N 3.35Å; I113-R115 VanDerWaalsContact C-N 3.29Å; I113-R115 PolarHBondContact O-N 2.82Å; I113-I116 HydrophobicContact CD1-CD1 4.03Å; I113-I116 WeakPolarHBondContact O-CB 3.35Å; I113-I116 PolarHBondContact O-N 3.36Å; I113-I116 VanDerWaalsContact O-N 3.1Å; I113-V117 PolarHBondContact O-N 3.41Å; I113-L199 HydrophobicContact CD1-CD2 4.16Å; I113-L308 HydrophobicContact CB-CD1 4.21Å; I113-L308 HydrophobicContact CG1-CD1 3.82Å; I113-L308 HydrophobicContact CG2-CD1 4.43Å; I113-L312 HydrophobicContact CG2-CD2 4.13Å
114	H	98.6	Very high	97.6	Very high	86 Å²	86	48.5 Å²	48.5	40%	0.398	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-34.9	175.2	-172.7	72.9	0	0	0	112.3	N110 R112 I116 V117 M118	N110-H114 VanDerWaalsContact O-CB 3.24Å; N110-H114 WeakPolarHBondContact O-CB 3.29Å; N110-H114 PolarHBondContact O-N 3.3Å; R112-H114 VanDerWaalsContact C-N 3.34Å; R112-H114 PolarHBondContact O-N 3.25Å; H114-I116 VanDerWaalsContact C-N 3.34Å; H114-I116 PolarHBondContact O-N 2.98Å; H114-V117 WeakPolarHBondContact O-CB 3.39Å; H114-V117 PolarHBondContact O-N 2.97Å; H114-M118 WeakPolarHBondContact O-CG 3.24Å; H114-M118 PolarHBondContact O-N 3.08Å
115	R	98.8	Very high	97.9	Very high	109 Å²	109	47.5 Å²	47.5	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-61.2	-42.4	171.7	-175.2	-177.2	-63.3	148.7	4	111.6	E87 T111 R112 I113 V117 M118 I119	E87-R115 VanDerWaalsContact CD-NH1 3.26Å; E87-R115 VanDerWaalsContact OE1-CD 3.23Å; E87-R115 WeakPolarHBondContact OE1-CD 3.48Å; E87-R115 IonicContact OE1-CZ 3.67Å; E87-R115 IonicContact OE1-NE 3.03Å; E87-R115 IonicContact OE1-NH1 2.72Å; E87-R115 PolarHBondContact OE1-NH1 2.76Å; E87-R115 IonicContact OE2-NH1 3.13Å; E87-R115 PolarHBondContact OE2-NH1 2.85Å; E87-R115 VanDerWaalsContact OE2-NH1 3.13Å; T111-R115 WeakPolarHBondContact O-CB 3.34Å; T111-R115 PolarHBondContact O-N 3.2Å; R112-R115 WeakPolarHBondContact O-CB 3.49Å; R112-R115 PolarHBondContact O-N 3.37Å; I113-R115 VanDerWaalsContact C-N 3.29Å; I113-R115 PolarHBondContact O-N 2.82Å; R115-V117 VanDerWaalsContact C-N 3.31Å; R115-V117 PolarHBondContact O-N 3.37Å; R115-M118 PolarHBondContact O-N 3.09Å; R115-I119 HydrophobicContact CG-CD1 4.17Å; R115-I119 WeakPolarHBondContact O-CG1 3.45Å; R115-I119 PolarHBondContact O-N 2.78Å
116	I	98.8	Very high	98.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-44	174.1	-64.9	163.6	0	0	0	110.6	I84 E87 I88 R112 I113 H114 M118 I119 F120 M315	I84-I116 HydrophobicContact CG1-CG2 4.33Å; I84-I116 HydrophobicContact CG2-CD1 4.47Å; I84-I116 HydrophobicContact CG2-CG1 4.17Å; I84-I116 HydrophobicContact CG2-CG2 3.74Å; E87-I116 HydrophobicContact CB-CD1 3.73Å; E87-I116 HydrophobicContact CB-CG1 3.7Å; E87-I116 HydrophobicContact CG-CG1 4.23Å; I88-I116 HydrophobicContact CD1-CD1 4.35Å; I88-I116 HydrophobicContact CG1-CD1 3.47Å; I88-I116 VanDerWaalsContact CG1-CD1 3.47Å; R112-I116 WeakPolarHBondContact O-CG1 3.36Å; R112-I116 PolarHBondContact O-N 3.03Å; R112-I116 VanDerWaalsContact O-N 3.08Å; I113-I116 HydrophobicContact CD1-CD1 4.03Å; I113-I116 WeakPolarHBondContact O-CB 3.35Å; I113-I116 PolarHBondContact O-N 3.36Å; I113-I116 VanDerWaalsContact O-N 3.1Å; H114-I116 VanDerWaalsContact C-N 3.34Å; H114-I116 PolarHBondContact O-N 2.98Å; I116-M118 VanDerWaalsContact C-N 3.32Å; I116-M118 PolarHBondContact O-N 2.98Å; I116-I119 PolarHBondContact O-N 3.27Å; I116-F120 HydrophobicContact CG2-CD2 3.59Å; I116-F120 HydrophobicContact CG2-CE2 3.48Å; I116-F120 VanDerWaalsContact CG2-CE2 3.48Å; I116-F120 WeakPolarHBondContact O-CD2 3.37Å; I116-F120 PolarHBondContact O-N 3.43Å; I116-M315 HydrophobicContact CG2-CG 4.15Å; I116-M315 HydrophobicContact CG2-SD 3.82Å
117	V	98.8	Very high	98.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56	-46.5	174	169	0	0	0	0	111	I113 H114 R115 F120 R121 S311 D314 M315 L318	I113-V117 PolarHBondContact O-N 3.41Å; H114-V117 WeakPolarHBondContact O-CB 3.39Å; H114-V117 PolarHBondContact O-N 2.97Å; R115-V117 VanDerWaalsContact C-N 3.31Å; R115-V117 PolarHBondContact O-N 3.37Å; V117-F120 PolarHBondContact O-N 3.39Å; V117-R121 WeakPolarHBondContact O-CG 3.5Å; V117-R121 PolarHBondContact O-N 3.35Å; V117-S311 VanDerWaalsContact CG2-O 3.31Å; V117-S311 WeakPolarHBondContact CG2-O 3.39Å; V117-D314 HydrophobicContact CG1-CB 3.92Å; V117-D314 HydrophobicContact CG2-CB 3.85Å; V117-M315 HydrophobicContact CG2-CB 4.19Å; V117-L318 HydrophobicContact CB-CD1 4.35Å; V117-L318 HydrophobicContact CG1-CD1 3.66Å; V117-L318 VanDerWaalsContact O-CD1 3.27Å; V117-L318 WeakPolarHBondContact O-CD1 3.27Å
118	M	98.8	Very high	98.3	Very high	94 Å²	94	45.2 Å²	45.2	46%	0.463	22%	0.22	S	C	.	.	H	α-helix	trans	-65.9	-38	178.5	-67.3	-51.9	-58.4	0	0	112.9	H114 R115 I116 R121 L122	H114-M118 WeakPolarHBondContact O-CG 3.24Å; H114-M118 PolarHBondContact O-N 3.08Å; R115-M118 PolarHBondContact O-N 3.09Å; I116-M118 VanDerWaalsContact C-N 3.32Å; I116-M118 PolarHBondContact O-N 2.98Å; M118-R121 PolarHBondContact O-N 3.46Å; M118-L122 PolarHBondContact O-N 3.04Å
119	I	98.8	Very high	98.3	Very high	10 Å²	10	44.6 Å²	44.6	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-47.6	173.8	-65.7	164.8	0	0	0	109.8	W80 Q83 I84 R115 I116 R121 L122 L123	W80-I119 HydrophobicContact CB-CG2 3.88Å; W80-I119 HydrophobicContact CD2-CG2 3.96Å; W80-I119 HydrophobicContact CE3-CB 4.41Å; W80-I119 HydrophobicContact CE3-CD1 4.1Å; W80-I119 HydrophobicContact CE3-CG1 3.89Å; W80-I119 HydrophobicContact CE3-CG2 3.66Å; W80-I119 HydrophobicContact CG-CG2 4.08Å; W80-I119 HydrophobicContact CZ3-CD1 4.23Å; W80-I119 HydrophobicContact CZ3-CG1 3.94Å; W80-I119 HydrophobicContact CZ3-CG2 4.5Å; Q83-I119 HydrophobicContact CB-CD1 4.35Å; Q83-I119 HydrophobicContact CG-CD1 3.75Å; I84-I119 HydrophobicContact CD1-CB 4.36Å; I84-I119 HydrophobicContact CD1-CG2 3.66Å; I84-I119 HydrophobicContact CG1-CB 4.2Å; I84-I119 HydrophobicContact CG1-CD1 4.15Å; I84-I119 HydrophobicContact CG1-CG2 3.76Å; R115-I119 HydrophobicContact CG-CD1 4.17Å; R115-I119 WeakPolarHBondContact O-CG1 3.45Å; R115-I119 PolarHBondContact O-N 2.78Å; I116-I119 PolarHBondContact O-N 3.27Å; I119-R121 VanDerWaalsContact C-N 3.29Å; I119-R121 PolarHBondContact O-N 2.85Å; I119-L122 WeakPolarHBondContact O-CA 3.48Å; I119-L122 WeakPolarHBondContact O-CB 3.22Å; I119-L122 PolarHBondContact O-N 2.88Å; I119-L122 VanDerWaalsContact O-N 3.08Å; I119-L123 HydrophobicContact CG2-CD1 4.34Å; I119-L123 HydrophobicContact CG2-CG 4.2Å; I119-L123 WeakPolarHBondContact O-CG 3.34Å; I119-L123 PolarHBondContact O-N 3.32Å
120	F	98.6	Very high	98.2	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-33.4	178.1	-84.1	-65.9	0	0	0	113.5	I84 I116 V117 L122 L123 V124 L159 M315 L318 M319	I84-F120 HydrophobicContact CD1-CD1 4.44Å; I84-F120 HydrophobicContact CD1-CD2 4.28Å; I84-F120 HydrophobicContact CD1-CE1 4.14Å; I84-F120 HydrophobicContact CD1-CE2 3.98Å; I84-F120 HydrophobicContact CD1-CG 4.49Å; I84-F120 HydrophobicContact CD1-CZ 3.9Å; I84-F120 HydrophobicContact CG2-CE2 4.36Å; I116-F120 HydrophobicContact CG2-CD2 3.59Å; I116-F120 HydrophobicContact CG2-CE2 3.48Å; I116-F120 VanDerWaalsContact CG2-CE2 3.48Å; I116-F120 WeakPolarHBondContact O-CD2 3.37Å; I116-F120 PolarHBondContact O-N 3.43Å; V117-F120 PolarHBondContact O-N 3.39Å; F120-L122 VanDerWaalsContact C-N 3.35Å; F120-L123 HydrophobicContact CD1-CD1 4.18Å; F120-L123 HydrophobicContact CE1-CD1 4.47Å; F120-L123 PolarHBondContact O-N 2.87Å; F120-V124 VanDerWaalsContact O-CG2 3.29Å; F120-V124 WeakPolarHBondContact O-CG2 3.36Å; F120-V124 PolarHBondContact O-N 3.41Å; F120-L159 HydrophobicContact CE1-CD2 4.29Å; F120-L159 HydrophobicContact CZ-CD1 4.38Å; F120-L159 HydrophobicContact CZ-CD2 3.79Å; F120-M315 HydrophobicContact CD2-CG 4.19Å; F120-M315 HydrophobicContact CE2-CG 3.92Å; F120-L318 HydrophobicContact CB-CB 3.7Å; F120-L318 HydrophobicContact CB-CD1 4.02Å; F120-L318 HydrophobicContact CB-CG 4.44Å; F120-L318 HydrophobicContact CG-CB 4.41Å; F120-M319 HydrophobicContact CD1-CG 4.26Å; F120-M319 HydrophobicContact CE1-CG 3.62Å; F120-M319 HydrophobicContact CE2-CG 3.95Å; F120-M319 HydrophobicContact CE2-SD 4.45Å; F120-M319 HydrophobicContact CZ-CG 3.44Å; F120-M319 VanDerWaalsContact CZ-CG 3.44Å; F120-M319 HydrophobicContact CZ-SD 3.97Å
121	R	98.6	Very high	98.1	Very high	115 Å²	115	48.2 Å²	48.2	43%	0.434	24%	0.241	S	C	.	.	H	α-helix	trans	-59	-47.8	171.5	-71.8	177.7	-178.4	-126	2.7	111	V117 M118 I119 L123 V124 D125 L318	V117-R121 WeakPolarHBondContact O-CG 3.5Å; V117-R121 PolarHBondContact O-N 3.35Å; M118-R121 PolarHBondContact O-N 3.46Å; I119-R121 VanDerWaalsContact C-N 3.29Å; I119-R121 PolarHBondContact O-N 2.85Å; R121-L123 VanDerWaalsContact C-N 3.32Å; R121-L123 PolarHBondContact O-N 2.89Å; R121-V124 PolarHBondContact O-N 3.47Å; R121-D125 PolarHBondContact O-N 2.89Å; R121-D125 VanDerWaalsContact O-N 3.1Å; R121-L318 HydrophobicContact CG-CD1 3.67Å; R121-L318 HydrophobicContact CG-CD2 3.73Å; R121-L318 HydrophobicContact CG-CG 4.38Å
122	L	98.6	Very high	98.1	Very high	81 Å²	81	50.2 Å²	50.2	42%	0.424	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-42.5	175	-179.9	66.5	0	0	0	111.7	W80 M118 I119 F120 V124 D125 Q126	W80-L122 HydrophobicContact CH2-CD2 4.28Å; W80-L122 HydrophobicContact CZ2-CD2 3.47Å; W80-L122 VanDerWaalsContact CZ2-CD2 3.47Å; M118-L122 PolarHBondContact O-N 3.04Å; I119-L122 WeakPolarHBondContact O-CA 3.48Å; I119-L122 WeakPolarHBondContact O-CB 3.22Å; I119-L122 PolarHBondContact O-N 2.88Å; I119-L122 VanDerWaalsContact O-N 3.08Å; F120-L122 VanDerWaalsContact C-N 3.35Å; L122-V124 VanDerWaalsContact C-N 3.32Å; L122-V124 PolarHBondContact O-N 2.98Å; L122-D125 PolarHBondContact O-N 3.07Å; L122-Q126 WeakPolarHBondContact O-CB 3.5Å; L122-Q126 PolarHBondContact O-N 2.89Å
123	L	98.4	Very high	98.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-35.4	177.8	-66.7	-167	0	0	0	113	Y77 W80 F81 I84 I119 F120 R121	Y77-L123 HydrophobicContact CD1-CB 4.33Å; Y77-L123 HydrophobicContact CD1-CD1 4.23Å; Y77-L123 HydrophobicContact CD1-CD2 3.55Å; Y77-L123 HydrophobicContact CD1-CG 4.23Å; Y77-L123 HydrophobicContact CE1-CB 3.87Å; Y77-L123 HydrophobicContact CE1-CD2 3.76Å; Y77-L123 HydrophobicContact CE1-CG 4.26Å; Y77-L123 WeakPolarHBondContact CE1-O 3.32Å; Y77-L123 PolarHBondContact OH-O 3.38Å; W80-L123 HydrophobicContact CB-CD1 4.26Å; W80-L123 HydrophobicContact CB-CD2 3.66Å; W80-L123 HydrophobicContact CB-CG 4.33Å; W80-L123 VanDerWaalsContact CD1-CD2 3.49Å; W80-L123 HydrophobicContact CG-CD2 3.74Å; F81-L123 HydrophobicContact CD1-CD1 4.03Å; F81-L123 HydrophobicContact CE1-CD1 3.67Å; I84-L123 HydrophobicContact CD1-CD1 4.09Å; I119-L123 HydrophobicContact CG2-CD1 4.34Å; I119-L123 HydrophobicContact CG2-CG 4.2Å; I119-L123 WeakPolarHBondContact O-CG 3.34Å; I119-L123 PolarHBondContact O-N 3.32Å; F120-L123 HydrophobicContact CD1-CD1 4.18Å; F120-L123 HydrophobicContact CE1-CD1 4.47Å; F120-L123 PolarHBondContact O-N 2.87Å; R121-L123 VanDerWaalsContact C-N 3.32Å; R121-L123 PolarHBondContact O-N 2.89Å
124	V	98.3	Very high	98	Very high	17 Å²	17	50.1 Å²	50.1	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-42.3	174.4	168.6	0	0	0	0	110.6	F120 R121 L122 L318 K321 W322 N325	F120-V124 VanDerWaalsContact O-CG2 3.29Å; F120-V124 WeakPolarHBondContact O-CG2 3.36Å; F120-V124 PolarHBondContact O-N 3.41Å; R121-V124 PolarHBondContact O-N 3.47Å; L122-V124 VanDerWaalsContact C-N 3.32Å; L122-V124 PolarHBondContact O-N 2.98Å; V124-L318 HydrophobicContact CG2-CD2 4.38Å; V124-K321 HydrophobicContact CG2-CB 4.1Å; V124-W322 HydrophobicContact CG2-CB 3.99Å; V124-N325 WeakPolarHBondContact CG1-ND2 3.37Å; V124-N325 PolarHBondContact O-ND2 2.73Å
125	D	97.8	Very high	97.9	Very high	111 Å²	111	47.8 Å²	47.8	59%	0.594	26%	0.256	S	S	*	.	H	α-helix	trans	-74.5	-29.8	-179.7	-68.1	-17.5	0	0	0	112.6	R121 L122 F127 A128	R121-D125 PolarHBondContact O-N 2.89Å; R121-D125 VanDerWaalsContact O-N 3.1Å; L122-D125 PolarHBondContact O-N 3.07Å; D125-F127 PolarHBondContact O-N 3.02Å; D125-F127 VanDerWaalsContact O-N 3.09Å; D125-A128 VanDerWaalsContact O-CB 3.27Å; D125-A128 WeakPolarHBondContact O-CB 3.27Å; D125-A128 PolarHBondContact O-N 3.37Å
126	Q	98	Very high	97.8	Very high	25 Å²	25	49 Å²	49	12%	0.117	27%	0.27	C	S	.	.	H	α-helix	trans	-58.9	-25	179.8	-176.5	173	-34.6	0	0	112.8	T73 Y77 L122 A128 V129	T73-Q126 PolarHBondContact O-NE2 3.29Å; T73-Q126 VanDerWaalsContact O-NE2 3.1Å; Y77-Q126 HydrophobicContact CE1-CB 4.42Å; Y77-Q126 HydrophobicContact CE2-CG 4.33Å; L122-Q126 WeakPolarHBondContact O-CB 3.5Å; L122-Q126 PolarHBondContact O-N 2.89Å; Q126-A128 PolarHBondContact O-N 2.81Å; Q126-V129 WeakPolarHBondContact O-CB 3.48Å; Q126-V129 PolarHBondContact O-N 3.01Å; Q126-V129 VanDerWaalsContact O-N 3.09Å
127	F	96.4	Very high	97.7	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-32.4	171.9	-84.5	-52.5	0	0	0	113.6	Y77 D125 V129 L130 E131 W322 N325 H326 I329	Y77-F127 HydrophobicContact CE2-CE1 4.4Å; Y77-F127 WeakPolarHBondContact OH-CD1 3.44Å; Y77-F127 WeakPolarHBondContact OH-CD2 3.45Å; Y77-F127 WeakPolarHBondContact OH-CE1 3.37Å; Y77-F127 WeakPolarHBondContact OH-CG 3.45Å; Y77-F127 PolarHBondContact OH-N 2.7Å; D125-F127 PolarHBondContact O-N 3.02Å; D125-F127 VanDerWaalsContact O-N 3.09Å; F127-V129 PolarHBondContact O-N 3.1Å; F127-L130 PolarHBondContact O-N 3.17Å; F127-L130 VanDerWaalsContact O-N 3.11Å; F127-E131 WeakPolarHBondContact O-CG 3.47Å; F127-E131 PolarHBondContact O-N 3.36Å; F127-W322 AromaticContact CE2-CD1 3.42Å; F127-W322 VanDerWaalsContact CE2-CD1 3.42Å; F127-W322 HydrophobicContact CE2-CD2 4.22Å; F127-W322 AromaticContact CE2-CE2 3.95Å; F127-W322 AromaticContact CE2-CG 3.91Å; F127-W322 HydrophobicContact CE2-CG 3.91Å; F127-W322 AromaticContact CE2-NE1 3.44Å; F127-W322 WeakPolarHBondContact CE2-O 3.35Å; F127-W322 HydrophobicContact CZ-CD2 4.36Å; F127-W322 AromaticContact CZ-CE2 3.78Å; F127-W322 HydrophobicContact CZ-CZ2 4.15Å; F127-W322 AromaticContact CZ-NE1 3.56Å; F127-N325 HydrophobicContact CB-CB 4.49Å; F127-N325 HydrophobicContact CD2-CB 3.47Å; F127-N325 VanDerWaalsContact CD2-CB 3.47Å; F127-N325 HydrophobicContact CE2-CB 3.9Å; F127-N325 HydrophobicContact CG-CB 4.15Å; F127-H326 HydrophobicContact CE1-CB 4.19Å; F127-H326 HydrophobicContact CE2-CB 4.24Å; F127-H326 HydrophobicContact CZ-CB 3.6Å; F127-I329 HydrophobicContact CB-CD1 3.49Å; F127-I329 VanDerWaalsContact CB-CD1 3.49Å; F127-I329 HydrophobicContact CD1-CD1 3.14Å; F127-I329 HydrophobicContact CE1-CD1 4.03Å; F127-I329 HydrophobicContact CG-CD1 3.53Å
128	A	97.3	Very high	97.6	Very high	59 Å²	59	52.9 Å²	52.9	49%	0.488	29%	0.29	S	S	.	.	H	α-helix	trans	-60.8	-28.5	176.8	0	0	0	0	0	112.8	D125 Q126 E131	D125-A128 VanDerWaalsContact O-CB 3.27Å; D125-A128 WeakPolarHBondContact O-CB 3.27Å; D125-A128 PolarHBondContact O-N 3.37Å; Q126-A128 PolarHBondContact O-N 2.81Å; A128-E131 PolarHBondContact O-N 2.65Å
129	V	97.8	Very high	97.4	Very high	82 Å²	82	54 Å²	54	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-71.5	-44.9	175.4	177.7	0	0	0	0	110.7	L69 Q126 F127 E131 T132	L69-V129 HydrophobicContact CD1-CG1 3.92Å; Q126-V129 WeakPolarHBondContact O-CB 3.48Å; Q126-V129 PolarHBondContact O-N 3.01Å; Q126-V129 VanDerWaalsContact O-N 3.09Å; F127-V129 PolarHBondContact O-N 3.1Å; V129-E131 PolarHBondContact O-N 2.92Å; V129-T132 PolarHBondContact O-N 3.37Å; V129-T132 PolarHBondContact O-OG1 3.08Å
130	L	96.6	Very high	97.3	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-23	175	-167.8	60.9	0	0	0	111.7	F70 T73 F127 T132 M133	F70-L130 HydrophobicContact CD2-CD1 4.47Å; T73-L130 HydrophobicContact CG2-CB 4.16Å; T73-L130 HydrophobicContact CG2-CD1 4.37Å; T73-L130 HydrophobicContact CG2-CD2 4.3Å; F127-L130 PolarHBondContact O-N 3.17Å; F127-L130 VanDerWaalsContact O-N 3.11Å; L130-T132 PolarHBondContact O-N 3.2Å; L130-M133 HydrophobicContact CD1-CE 3.88Å; L130-M133 HydrophobicContact CG-CE 4.45Å; L130-M133 WeakPolarHBondContact O-CB 3.28Å; L130-M133 PolarHBondContact O-N 3.5Å
131	E	96.1	Very high	97.2	Very high	77 Å²	77	57.4 Å²	57.4	36%	0.36	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.7	-179.3	-80.8	177.4	165.7	0	0	114.3	F127 A128 V129 M133 I329 R332	F127-E131 WeakPolarHBondContact O-CG 3.47Å; F127-E131 PolarHBondContact O-N 3.36Å; A128-E131 PolarHBondContact O-N 2.65Å; V129-E131 PolarHBondContact O-N 2.92Å; E131-M133 PolarHBondContact O-N 3.28Å; E131-I329 HydrophobicContact CG-CD1 3.7Å; E131-I329 HydrophobicContact CG-CG1 3.65Å; E131-I329 WeakPolarHBondContact OE1-CG1 3.32Å; E131-R332 VanDerWaalsContact O-CZ 3.28Å; E131-R332 PolarHBondContact O-NH1 3.31Å; E131-R332 PolarHBondContact O-NH2 3.39Å
132	T	98	Very high	96.9	Very high	105 Å²	105	54.4 Å²	54.4	64%	0.644	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-21.2	176.5	70	0	0	0	0	112.8	V129 L130	V129-T132 PolarHBondContact O-N 3.37Å; V129-T132 PolarHBondContact O-OG1 3.08Å; L130-T132 PolarHBondContact O-N 3.2Å
133	M	98.1	Very high	96.6	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.01	31%	0.307	C	S	.	.	S	Bend	trans	-71.9	134.2	171.3	177.3	172.6	68.8	0	0	110	D66 L69 F70 L130 E131 D137 F138 F141 R332 M333	D66-M133 HydrophobicContact CB-CG 3.98Å; D66-M133 HydrophobicContact CB-SD 3.82Å; D66-M133 WeakPolarHBondContact OD2-CG 3.45Å; L69-M133 HydrophobicContact CD2-CB 4.28Å; F70-M133 HydrophobicContact CD2-CE 4.23Å; L130-M133 HydrophobicContact CD1-CE 3.88Å; L130-M133 HydrophobicContact CG-CE 4.45Å; L130-M133 WeakPolarHBondContact O-CB 3.28Å; L130-M133 PolarHBondContact O-N 3.5Å; E131-M133 PolarHBondContact O-N 3.28Å; M133-D137 HydrophobicContact CG-CB 4.48Å; M133-F138 HydrophobicContact CE-CB 4Å; M133-F138 HydrophobicContact CE-CD2 3.65Å; M133-F138 HydrophobicContact CE-CG 4.13Å; M133-F138 HydrophobicContact CG-CB 4.38Å; M133-F138 HydrophobicContact SD-CB 4.11Å; M133-F138 HydrophobicContact SD-CD2 4.25Å; M133-F141 HydrophobicContact CE-CZ 4.22Å; M133-F141 HydrophobicContact SD-CE1 3.55Å; M133-F141 VanDerWaalsContact SD-CE1 3.55Å; M133-F141 HydrophobicContact SD-CZ 3.62Å; M133-R332 PolarHBondContact O-NH1 2.88Å; M133-R332 PolarHBondContact O-NH2 3.16Å; M133-M333 HydrophobicContact CB-CE 4.1Å; M133-M333 HydrophobicContact CE-CE 3.51Å; M133-M333 HydrophobicContact CE-SD 4.2Å; M133-M333 HydrophobicContact CG-CE 4.21Å; M133-M333 WeakPolarHBondContact O-CE 3.32Å
134	T	97.5	Very high	96.4	Very high	60 Å²	60	58.7 Å²	58.7	37%	0.368	31%	0.313	S	S	.	.			trans	-84.2	157.4	176.7	84.4	0	0	0	0	111.5	L136 D137 F138	T134-L136 PolarHBondContact O-N 3.11Å; T134-L136 PolarHBondContact OG1-N 3.17Å; T134-D137 WeakPolarHBondContact CB-OD2 3.47Å; T134-D137 WeakPolarHBondContact CG2-OD2 3.46Å; T134-D137 PolarHBondContact O-N 2.95Å; T134-D137 VanDerWaalsContact OG1-CG 3.31Å; T134-D137 PolarHBondContact OG1-N 3.41Å; T134-D137 VanDerWaalsContact OG1-N 3.16Å; T134-D137 PolarHBondContact OG1-OD2 3.48Å; T134-F138 WeakPolarHBondContact O-CB 3.32Å; T134-F138 PolarHBondContact O-N 2.92Å
135	A	96.2	Very high	95.8	Very high	38 Å²	38	59.2 Å²	59.2	31%	0.314	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-25.7	175.2	0	0	0	0	0	112.9	F139 R332	A135-F139 WeakPolarHBondContact O-CB 3.33Å; A135-F139 PolarHBondContact O-N 2.89Å; A135-F139 VanDerWaalsContact O-N 3.09Å; A135-R332 WeakPolarHBondContact CB-O 3.48Å
136	L	95.9	Very high	94.8	Very high	135 Å²	135	61.2 Å²	61.2	71%	0.707	32%	0.323	S	S	*	.	H	α-helix	trans	-71.3	-49.8	176	-69.1	172	0	0	0	110.4	T134 F138 F139 D140	T134-L136 PolarHBondContact O-N 3.11Å; T134-L136 PolarHBondContact OG1-N 3.17Å; L136-F138 VanDerWaalsContact C-N 3.3Å; L136-F138 PolarHBondContact O-N 3.32Å; L136-F139 WeakPolarHBondContact O-CB 3.22Å; L136-F139 PolarHBondContact O-N 3.22Å; L136-D140 PolarHBondContact O-N 3.03Å
137	D	96.9	Very high	93.5	Very high	60 Å²	60	64 Å²	64	32%	0.321	35%	0.345	S	S	.	.	H	α-helix	trans	-62.8	-39.5	178.1	-57.9	-55.1	0	0	0	111.1	D66 M133 T134 F139 D140 F141	D66-D137 HydrophobicContact CB-CB 4.38Å; M133-D137 HydrophobicContact CG-CB 4.48Å; T134-D137 WeakPolarHBondContact CB-OD2 3.47Å; T134-D137 WeakPolarHBondContact CG2-OD2 3.46Å; T134-D137 PolarHBondContact O-N 2.95Å; T134-D137 VanDerWaalsContact OG1-CG 3.31Å; T134-D137 PolarHBondContact OG1-N 3.41Å; T134-D137 VanDerWaalsContact OG1-N 3.16Å; T134-D137 PolarHBondContact OG1-OD2 3.48Å; D137-F139 VanDerWaalsContact C-N 3.31Å; D137-F139 PolarHBondContact O-N 3.46Å; D137-D140 PolarHBondContact O-N 3.22Å; D137-F141 VanDerWaalsContact O-CD1 3.22Å; D137-F141 WeakPolarHBondContact O-CD1 3.3Å
138	F	96.6	Very high	92.5	Very high	21 Å²	21	66.1 Å²	66.1	9%	0.092	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-42.2	172.3	179.4	-113.1	0	0	0	112.2	F70 M133 T134 L136 D140 F141 R142 L145 M333 I334	F70-F138 HydrophobicContact CD2-CE2 4.27Å; F70-F138 AromaticContact CE2-CE2 3.95Å; F70-F138 HydrophobicContact CE2-CE2 3.95Å; M133-F138 HydrophobicContact CE-CB 4Å; M133-F138 HydrophobicContact CE-CD2 3.65Å; M133-F138 HydrophobicContact CE-CG 4.13Å; M133-F138 HydrophobicContact CG-CB 4.38Å; M133-F138 HydrophobicContact SD-CB 4.11Å; M133-F138 HydrophobicContact SD-CD2 4.25Å; T134-F138 WeakPolarHBondContact O-CB 3.32Å; T134-F138 PolarHBondContact O-N 2.92Å; L136-F138 VanDerWaalsContact C-N 3.3Å; L136-F138 PolarHBondContact O-N 3.32Å; F138-D140 VanDerWaalsContact C-N 3.25Å; F138-D140 PolarHBondContact O-N 2.89Å; F138-F141 HydrophobicContact CB-CE1 4.47Å; F138-F141 HydrophobicContact CD2-CE1 4.01Å; F138-F141 AromaticContact CD2-CE2 3.92Å; F138-F141 HydrophobicContact CD2-CE2 3.92Å; F138-F141 AromaticContact CD2-CZ 3.49Å; F138-F141 HydrophobicContact CD2-CZ 3.49Å; F138-F141 VanDerWaalsContact CD2-CZ 3.49Å; F138-F141 HydrophobicContact CE2-CE2 4.03Å; F138-F141 HydrophobicContact CE2-CZ 4.04Å; F138-F141 PolarHBondContact O-N 3.08Å; F138-R142 HydrophobicContact CE1-CB 4.22Å; F138-R142 HydrophobicContact CE1-CG 3.99Å; F138-R142 HydrophobicContact CZ-CB 4.27Å; F138-R142 HydrophobicContact CZ-CG 4.02Å; F138-R142 VanDerWaalsContact O-CB 3.3Å; F138-R142 WeakPolarHBondContact O-CB 3.34Å; F138-R142 PolarHBondContact O-N 3.31Å; F138-L145 HydrophobicContact CE2-CD1 4.11Å; F138-L145 HydrophobicContact CZ-CD1 4.32Å; F138-M333 HydrophobicContact CB-SD 3.87Å; F138-M333 HydrophobicContact CD1-CB 3.96Å; F138-M333 HydrophobicContact CD1-SD 4.37Å; F138-M333 HydrophobicContact CE1-CB 4.24Å; F138-M333 HydrophobicContact CG-SD 4.14Å; F138-I334 HydrophobicContact CD1-CG2 4.32Å; F138-I334 HydrophobicContact CE1-CG2 3.66Å
139	F	94.8	Very high	91.8	Very high	117 Å²	117	64.5 Å²	64.5	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-32.6	-178.7	-172.7	-102.6	0	0	0	112.5	A135 L136 D137 F141	A135-F139 WeakPolarHBondContact O-CB 3.33Å; A135-F139 PolarHBondContact O-N 2.89Å; A135-F139 VanDerWaalsContact O-N 3.09Å; L136-F139 WeakPolarHBondContact O-CB 3.22Å; L136-F139 PolarHBondContact O-N 3.22Å; D137-F139 VanDerWaalsContact C-N 3.31Å; D137-F139 PolarHBondContact O-N 3.46Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 2.76Å
140	D	96.6	Very high	91	Very high	82 Å²	82	63.5 Å²	63.5	44%	0.439	36%	0.355	S	S	.	.	H	α-helix	trans	-65.1	-34	-178.5	-73.9	-19	0	0	0	113.5	I64 L136 D137 F138	I64-D140 HydrophobicContact CD1-CB 4.07Å; I64-D140 HydrophobicContact CG1-CB 4.31Å; I64-D140 HydrophobicContact CG2-CB 4.35Å; L136-D140 PolarHBondContact O-N 3.03Å; D137-D140 PolarHBondContact O-N 3.22Å; F138-D140 VanDerWaalsContact C-N 3.25Å; F138-D140 PolarHBondContact O-N 2.89Å
141	F	96.3	Very high	90.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-105.1	-13.5	177.8	74.2	-95.7	0	0	0	114.9	I64 D66 E67 F70 M133 D137 F138 F139 K143 Y144 L145	I64-F141 HydrophobicContact CB-CB 3.93Å; I64-F141 HydrophobicContact CB-CD1 4.43Å; I64-F141 HydrophobicContact CG1-CB 3.93Å; I64-F141 HydrophobicContact CG2-CB 4.14Å; I64-F141 HydrophobicContact CG2-CD1 3.82Å; I64-F141 HydrophobicContact CG2-CG 4.44Å; D66-F141 HydrophobicContact CB-CE1 4.27Å; E67-F141 HydrophobicContact CB-CB 4.34Å; E67-F141 HydrophobicContact CB-CD1 4.26Å; E67-F141 HydrophobicContact CB-CD2 4.04Å; E67-F141 HydrophobicContact CB-CE2 4.35Å; E67-F141 HydrophobicContact CB-CG 3.98Å; E67-F141 HydrophobicContact CG-CD2 3.91Å; E67-F141 HydrophobicContact CG-CE2 4.24Å; E67-F141 HydrophobicContact CG-CG 4.3Å; F70-F141 HydrophobicContact CB-CE2 4.02Å; F70-F141 HydrophobicContact CB-CZ 3.79Å; F70-F141 HydrophobicContact CD1-CE2 4.23Å; F70-F141 HydrophobicContact CD2-CE2 4.19Å; F70-F141 HydrophobicContact CD2-CZ 4.12Å; F70-F141 AromaticContact CG-CE2 3.89Å; F70-F141 HydrophobicContact CG-CE2 3.89Å; F70-F141 HydrophobicContact CG-CZ 4Å; M133-F141 HydrophobicContact CE-CZ 4.22Å; M133-F141 HydrophobicContact SD-CE1 3.55Å; M133-F141 VanDerWaalsContact SD-CE1 3.55Å; M133-F141 HydrophobicContact SD-CZ 3.62Å; D137-F141 VanDerWaalsContact O-CD1 3.22Å; D137-F141 WeakPolarHBondContact O-CD1 3.3Å; F138-F141 HydrophobicContact CB-CE1 4.47Å; F138-F141 HydrophobicContact CD2-CE1 4.01Å; F138-F141 AromaticContact CD2-CE2 3.92Å; F138-F141 HydrophobicContact CD2-CE2 3.92Å; F138-F141 AromaticContact CD2-CZ 3.49Å; F138-F141 HydrophobicContact CD2-CZ 3.49Å; F138-F141 VanDerWaalsContact CD2-CZ 3.49Å; F138-F141 HydrophobicContact CE2-CE2 4.03Å; F138-F141 HydrophobicContact CE2-CZ 4.04Å; F138-F141 PolarHBondContact O-N 3.08Å; F139-F141 VanDerWaalsContact C-N 3.34Å; F139-F141 PolarHBondContact O-N 2.76Å; F141-K143 PolarHBondContact O-N 3.2Å; F141-Y144 HydrophobicContact CB-CD2 3.86Å; F141-Y144 HydrophobicContact CB-CE2 4.2Å; F141-Y144 WeakPolarHBondContact O-CB 3.27Å; F141-Y144 WeakPolarHBondContact O-CD2 3.35Å; F141-Y144 PolarHBondContact O-N 3.29Å; F141-L145 HydrophobicContact CE2-CD1 4.35Å
142	R	93.4	Very high	89.6	Confident	53 Å²	53	63.9 Å²	63.9	20%	0.2	36%	0.357	C	S	.	.	H	α-helix	trans	-50.3	-35.4	-179.3	-177	-178.9	-174.3	-90.8	1.3	113.7	F138 Y144 L145 A338 T340	F138-R142 HydrophobicContact CE1-CB 4.22Å; F138-R142 HydrophobicContact CE1-CG 3.99Å; F138-R142 HydrophobicContact CZ-CB 4.27Å; F138-R142 HydrophobicContact CZ-CG 4.02Å; F138-R142 VanDerWaalsContact O-CB 3.3Å; F138-R142 WeakPolarHBondContact O-CB 3.34Å; F138-R142 PolarHBondContact O-N 3.31Å; R142-Y144 PolarHBondContact O-N 2.91Å; R142-L145 WeakPolarHBondContact O-CB 3.32Å; R142-L145 PolarHBondContact O-N 3.2Å; R142-A338 PolarHBondContact NH2-O 3.33Å; R142-T340 HydrophobicContact CG-CG2 4.47Å
143	K	92.3	Very high	89.3	Confident	137 Å²	137	59.6 Å²	59.6	60%	0.596	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.4	179.3	66.1	-174.6	178	-174.9	0	113.7	F141 L145	F141-K143 PolarHBondContact O-N 3.2Å; K143-L145 VanDerWaalsContact C-N 3.34Å
144	Y	93.2	Very high	89	Confident	33 Å²	33	61 Å²	61	13%	0.129	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-81.6	-14.9	179.8	-49	-64.3	0	0	0	112.9	Q60 N62 I64 F141 R142 M146	Q60-Y144 HydrophobicContact CB-CD1 4.14Å; Q60-Y144 HydrophobicContact CB-CE1 3.82Å; Q60-Y144 HydrophobicContact CG-CD1 3.92Å; Q60-Y144 HydrophobicContact CG-CE1 4.11Å; N62-Y144 WeakPolarHBondContact CB-OH 3.49Å; N62-Y144 PolarHBondContact ND2-OH 3.01Å; I64-Y144 HydrophobicContact CG1-CE2 4.4Å; F141-Y144 HydrophobicContact CB-CD2 3.86Å; F141-Y144 HydrophobicContact CB-CE2 4.2Å; F141-Y144 WeakPolarHBondContact O-CB 3.27Å; F141-Y144 WeakPolarHBondContact O-CD2 3.35Å; F141-Y144 PolarHBondContact O-N 3.29Å; R142-Y144 PolarHBondContact O-N 2.91Å; Y144-M146 PolarHBondContact O-N 3.42Å
145	L	86.1	Confident	88.9	Confident	28 Å²	28	60 Å²	60	15%	0.147	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-72.6	-9.5	176.9	-56.9	179	0	0	0	112.8	F70 F138 F141 R142 K143 S147 A148	F70-L145 HydrophobicContact CE1-CD1 4.19Å; F70-L145 HydrophobicContact CE1-CD2 4.04Å; F70-L145 HydrophobicContact CZ-CD1 4.01Å; F138-L145 HydrophobicContact CE2-CD1 4.11Å; F138-L145 HydrophobicContact CZ-CD1 4.32Å; F141-L145 HydrophobicContact CE2-CD1 4.35Å; R142-L145 WeakPolarHBondContact O-CB 3.32Å; R142-L145 PolarHBondContact O-N 3.2Å; K143-L145 VanDerWaalsContact C-N 3.34Å; L145-S147 PolarHBondContact O-N 3.22Å; L145-A148 VanDerWaalsContact O-CB 3.22Å; L145-A148 WeakPolarHBondContact O-CB 3.4Å; L145-A148 PolarHBondContact O-N 3.1Å
146	M	76.1	Confident	88.9	Confident	153 Å²	153	58.9 Å²	58.9	75%	0.754	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	-126.7	178	-60	-176.8	67.8	0	0	112.5	Y144 T340	Y144-M146 PolarHBondContact O-N 3.42Å; M146-T340 WeakPolarHBondContact O-CB 3.29Å
147	S	71.8	Confident	88.8	Confident	83 Å²	83	53 Å²	53	58%	0.58	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.4	175.8	58.3	0	0	0	0	113.8	L145 S149	L145-S147 PolarHBondContact O-N 3.22Å; S147-S149 PolarHBondContact O-N 3.35Å
148	A	75.3	Confident	88.7	Confident	51 Å²	51	50.9 Å²	50.9	42%	0.421	28%	0.275	S	S	.	.			trans	-64	136.6	-174.8	0	0	0	0	0	110.3	L145 E152 T340	L145-A148 VanDerWaalsContact O-CB 3.22Å; L145-A148 WeakPolarHBondContact O-CB 3.4Å; L145-A148 PolarHBondContact O-N 3.1Å; A148-E152 VanDerWaalsContact CA-OE2 3.27Å; A148-E152 WeakPolarHBondContact CA-OE2 3.35Å; A148-T340 PolarHBondContact O-OG1 2.86Å
149	S	81.8	Confident	88.7	Confident	25 Å²	25	49.9 Å²	49.9	18%	0.175	27%	0.27	C	S	.	.			trans	-156.1	161.2	-178.4	74.9	0	0	0	0	113	S147 F151 E152	S147-S149 PolarHBondContact O-N 3.35Å; S149-F151 PolarHBondContact O-N 3.02Å; S149-F151 WeakPolarHBondContact OG-CB 3.44Å; S149-F151 WeakPolarHBondContact OG-CD2 3.4Å; S149-F151 PolarHBondContact OG-N 3.26Å; S149-E152 PolarHBondContact N-OE2 3.22Å; S149-E152 VanDerWaalsContact N-OE2 3.07Å; S149-E152 WeakPolarHBondContact O-CB 3.47Å; S149-E152 PolarHBondContact O-N 3.44Å
150	G	80.9	Confident	88.8	Confident	61 Å²	61	44.3 Å²	44.3	63%	0.629	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-60.6	-8	173.8	0	0	0	0	0	114.9	E152 S153	G150-E152 PolarHBondContact O-N 2.83Å; G150-S153 PolarHBondContact O-N 3.41Å
151	F	80.8	Confident	88.8	Confident	19 Å²	19	40.8 Å²	40.8	8%	0.083	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-65.1	-24.4	168.2	-72.7	-81.4	0	0	0	112.8	S149 S153 Y173 Y181 Y348	S149-F151 PolarHBondContact O-N 3.02Å; S149-F151 WeakPolarHBondContact OG-CB 3.44Å; S149-F151 WeakPolarHBondContact OG-CD2 3.4Å; S149-F151 PolarHBondContact OG-N 3.26Å; F151-S153 VanDerWaalsContact C-N 3.34Å; F151-Y173 AromaticContact CE1-CD1 3.84Å; F151-Y173 HydrophobicContact CE1-CD1 3.84Å; F151-Y173 HydrophobicContact CE1-CE1 4.37Å; F151-Y173 HydrophobicContact CE2-CD1 4.37Å; F151-Y173 HydrophobicContact CE2-CE1 4.16Å; F151-Y173 AromaticContact CZ-CD1 3.71Å; F151-Y173 HydrophobicContact CZ-CD1 3.71Å; F151-Y173 AromaticContact CZ-CE1 3.95Å; F151-Y173 HydrophobicContact CZ-CE1 3.95Å; F151-Y173 HydrophobicContact CZ-CG 4.35Å; F151-Y181 HydrophobicContact CB-CD1 4.14Å; F151-Y181 HydrophobicContact CB-CG 4.05Å; F151-Y348 HydrophobicContact CE1-CD1 4.18Å; F151-Y348 AromaticContact CE1-CE1 3.37Å; F151-Y348 HydrophobicContact CE1-CE1 3.37Å; F151-Y348 HydrophobicContact CE1-CE2 4.3Å; F151-Y348 AromaticContact CE1-CZ 3.44Å; F151-Y348 VanDerWaalsContact CE1-CZ 3.44Å; F151-Y348 WeakPolarHBondContact CE1-OH 3.36Å; F151-Y348 HydrophobicContact CE2-CD1 4.44Å; F151-Y348 HydrophobicContact CE2-CE1 4.29Å; F151-Y348 AromaticContact CZ-CD1 3.52Å; F151-Y348 HydrophobicContact CZ-CD1 3.52Å; F151-Y348 AromaticContact CZ-CE1 3.17Å; F151-Y348 HydrophobicContact CZ-CE1 3.17Å; F151-Y348 HydrophobicContact CZ-CE2 4.38Å; F151-Y348 HydrophobicContact CZ-CG 4.27Å; F151-Y348 AromaticContact CZ-CZ 3.66Å
152	E	83.3	Confident	88.8	Confident	79 Å²	79	41.6 Å²	41.6	37%	0.369	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-89.9	2.5	-179.4	-57.6	168.4	148.4	0	0	112	A148 S149 G150 L154	A148-E152 VanDerWaalsContact CA-OE2 3.27Å; A148-E152 WeakPolarHBondContact CA-OE2 3.35Å; S149-E152 PolarHBondContact N-OE2 3.22Å; S149-E152 VanDerWaalsContact N-OE2 3.07Å; S149-E152 WeakPolarHBondContact O-CB 3.47Å; S149-E152 PolarHBondContact O-N 3.44Å; G150-E152 PolarHBondContact O-N 2.83Å; E152-L154 PolarHBondContact O-N 2.94Å
153	S	91.9	Very high	89	Confident	15 Å²	15	39.1 Å²	39.1	11%	0.105	22%	0.221	C	C	.	.			trans	-71.8	97	174.1	176.5	0	0	0	0	110.1	E78 G150 F151 Q155 F156 R157	E78-S153 WeakPolarHBondContact OE1-CB 3.39Å; E78-S153 PolarHBondContact OE1-OG 3.32Å; G150-S153 PolarHBondContact O-N 3.41Å; F151-S153 VanDerWaalsContact C-N 3.34Å; S153-Q155 PolarHBondContact O-N 2.94Å; S153-F156 PolarHBondContact O-N 3.11Å; S153-F156 WeakPolarHBondContact OG-CB 3.33Å; S153-F156 PolarHBondContact OG-N 3.31Å; S153-R157 PolarHBondContact O-N 3.28Å
154	L	92.1	Very high	89.3	Confident	30 Å²	30	32.9 Å²	32.9	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-55.1	-49.7	177.2	176	63.4	0	0	0	111.4	E152 F156 R157 L158 I182 E186 L190	E152-L154 PolarHBondContact O-N 2.94Å; L154-F156 VanDerWaalsContact C-N 3.3Å; L154-F156 PolarHBondContact O-N 3.41Å; L154-R157 PolarHBondContact O-N 3.39Å; L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 HydrophobicContact CD1-CD2 4.41Å; L154-L158 HydrophobicContact CD1-CG 4.08Å; L154-L158 HydrophobicContact CD2-CD1 4.38Å; L154-L158 HydrophobicContact CG-CD1 3.89Å; L154-L158 HydrophobicContact CG-CG 4.19Å; L154-L158 WeakPolarHBondContact O-CG 3.48Å; L154-L158 PolarHBondContact O-N 3.42Å; L154-I182 HydrophobicContact CB-CD1 4.49Å; L154-I182 HydrophobicContact CD1-CG2 4.12Å; L154-E186 HydrophobicContact CD1-CB 4.19Å; L154-E186 HydrophobicContact CD2-CB 3.86Å; L154-E186 HydrophobicContact CD2-CG 3.79Å; L154-L190 HydrophobicContact CD1-CB 4.37Å; L154-L190 HydrophobicContact CD1-CD1 4.04Å
155	Q	95.6	Very high	89.4	Confident	40 Å²	40	31.7 Å²	31.7	19%	0.187	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-36.4	-175.3	-63.5	-165.9	101.8	0	0	112.3	E78 F81 L85 S153 R157 L158 L159	E78-Q155 PolarHBondContact O-NE2 3.27Å; E78-Q155 PolarHBondContact OE2-NE2 2.91Å; F81-Q155 HydrophobicContact CB-CB 3.93Å; L85-Q155 HydrophobicContact CD1-CB 3.77Å; L85-Q155 HydrophobicContact CD1-CG 3.97Å; S153-Q155 PolarHBondContact O-N 2.94Å; Q155-R157 VanDerWaalsContact C-N 3.32Å; Q155-R157 PolarHBondContact O-N 3.09Å; Q155-L158 PolarHBondContact O-N 3.21Å; Q155-L159 VanDerWaalsContact O-CB 3.26Å; Q155-L159 WeakPolarHBondContact O-CB 3.28Å; Q155-L159 PolarHBondContact O-N 3.09Å
156	F	95.4	Very high	89.6	Confident	15 Å²	15	33.5 Å²	33.5	7%	0.066	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-35.7	175.1	-171.5	-100.2	0	0	0	112.2	F81 S153 L154 L159 E160 W322	F81-F156 HydrophobicContact CE1-CD2 4.29Å; F81-F156 HydrophobicContact CE2-CB 4.37Å; F81-F156 HydrophobicContact CE2-CD2 4.25Å; F81-F156 AromaticContact CZ-CD2 3.9Å; F81-F156 HydrophobicContact CZ-CD2 3.9Å; S153-F156 PolarHBondContact O-N 3.11Å; S153-F156 WeakPolarHBondContact OG-CB 3.33Å; S153-F156 PolarHBondContact OG-N 3.31Å; L154-F156 VanDerWaalsContact C-N 3.3Å; L154-F156 PolarHBondContact O-N 3.41Å; F156-L159 HydrophobicContact CD2-CD2 4.35Å; F156-L159 WeakPolarHBondContact O-CB 3.33Å; F156-E160 HydrophobicContact CE1-CG 4.19Å; F156-E160 WeakPolarHBondContact CE1-OE1 3.27Å; F156-E160 WeakPolarHBondContact O-CG 3.3Å; F156-E160 PolarHBondContact O-N 2.99Å; F156-E160 VanDerWaalsContact O-N 3.13Å; F156-W322 HydrophobicContact CD2-CH2 4.2Å; F156-W322 HydrophobicContact CD2-CZ3 4.27Å; F156-W322 HydrophobicContact CE1-CZ3 4.39Å; F156-W322 AromaticContact CE2-CE3 3.89Å; F156-W322 HydrophobicContact CE2-CE3 3.89Å; F156-W322 AromaticContact CE2-CH2 3.73Å; F156-W322 HydrophobicContact CE2-CH2 3.73Å; F156-W322 AromaticContact CE2-CZ3 3.37Å; F156-W322 HydrophobicContact CE2-CZ3 3.37Å; F156-W322 HydrophobicContact CZ-CE3 4.11Å; F156-W322 HydrophobicContact CZ-CH2 4.09Å; F156-W322 AromaticContact CZ-CZ3 3.44Å; F156-W322 HydrophobicContact CZ-CZ3 3.44Å; F156-W322 VanDerWaalsContact CZ-CZ3 3.44Å
157	R	93.9	Very high	90.3	Very high	12 Å²	12	29.4 Å²	29.4	5%	0.045	18%	0.181	C	C	.	.	H	α-helix	trans	-72.1	-42.1	174.5	-63.1	-54.4	179.6	-168.9	-2.4	112.6	S153 L154 Q155 L159 E160 N161 Y178 L190	S153-R157 PolarHBondContact O-N 3.28Å; L154-R157 PolarHBondContact O-N 3.39Å; Q155-R157 VanDerWaalsContact C-N 3.32Å; Q155-R157 PolarHBondContact O-N 3.09Å; R157-L159 VanDerWaalsContact C-N 3.26Å; R157-L159 PolarHBondContact O-N 3.4Å; R157-E160 VanDerWaalsContact CD-OE2 3.3Å; R157-E160 WeakPolarHBondContact CD-OE2 3.49Å; R157-E160 IonicContact CZ-OE2 2.82Å; R157-E160 IonicContact NE-OE2 3.75Å; R157-E160 IonicContact NH1-OE1 2.8Å; R157-E160 PolarHBondContact NH1-OE1 3.25Å; R157-E160 IonicContact NH1-OE2 2.68Å; R157-E160 PolarHBondContact NH1-OE2 3.41Å; R157-E160 PolarHBondContact O-N 3.39Å; R157-N161 WeakPolarHBondContact O-CB 3.1Å; R157-N161 VanDerWaalsContact O-CG 3.26Å; R157-N161 PolarHBondContact O-N 3.3Å; R157-N161 PolarHBondContact O-OD1 2.58Å; R157-Y178 HydrophobicContact CB-CD2 4.34Å; R157-Y178 HydrophobicContact CB-CE2 4.12Å; R157-Y178 HydrophobicContact CG-CD2 3.91Å; R157-Y178 HydrophobicContact CG-CE2 4.2Å; R157-L190 HydrophobicContact CB-CD1 3.8Å
158	L	95.3	Very high	91.1	Very high	15 Å²	15	30.6 Å²	30.6	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-58.4	-41.5	173.4	-67.2	176.9	0	0	0	111.3	L85 L154 Q155 N161 K162 T189 L190 A193	L85-L158 HydrophobicContact CD1-CB 4.28Å; L85-L158 HydrophobicContact CD1-CD1 4.47Å; L85-L158 HydrophobicContact CD2-CB 3.88Å; L154-L158 HydrophobicContact CD1-CD1 4.22Å; L154-L158 HydrophobicContact CD1-CD2 4.41Å; L154-L158 HydrophobicContact CD1-CG 4.08Å; L154-L158 HydrophobicContact CD2-CD1 4.38Å; L154-L158 HydrophobicContact CG-CD1 3.89Å; L154-L158 HydrophobicContact CG-CG 4.19Å; L154-L158 WeakPolarHBondContact O-CG 3.48Å; L154-L158 PolarHBondContact O-N 3.42Å; Q155-L158 PolarHBondContact O-N 3.21Å; L158-N161 PolarHBondContact O-N 2.95Å; L158-K162 VanDerWaalsContact O-CB 3.27Å; L158-K162 WeakPolarHBondContact O-CB 3.3Å; L158-K162 VanDerWaalsContact O-CG 3.3Å; L158-K162 WeakPolarHBondContact O-CG 3.19Å; L158-K162 PolarHBondContact O-N 2.79Å; L158-T189 HydrophobicContact CD1-CG2 4.04Å; L158-T189 HydrophobicContact CD2-CG2 4.05Å; L158-L190 HydrophobicContact CD2-CB 4.44Å; L158-A193 HydrophobicContact CD2-CB 3.58Å
159	L	96.3	Very high	91.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.8	-51.8	175.8	171.7	68.2	0	0	0	111.3	I84 L85 I88 F120 Q155 F156 R157 N161 K162 I163	I84-L159 HydrophobicContact CG2-CD1 3.45Å; I84-L159 VanDerWaalsContact CG2-CD1 3.45Å; L85-L159 HydrophobicContact CD2-CB 4.29Å; I88-L159 HydrophobicContact CD1-CD1 3.43Å; I88-L159 VanDerWaalsContact CD1-CD1 3.43Å; F120-L159 HydrophobicContact CE1-CD2 4.29Å; F120-L159 HydrophobicContact CZ-CD1 4.38Å; F120-L159 HydrophobicContact CZ-CD2 3.79Å; Q155-L159 VanDerWaalsContact O-CB 3.26Å; Q155-L159 WeakPolarHBondContact O-CB 3.28Å; Q155-L159 PolarHBondContact O-N 3.09Å; F156-L159 HydrophobicContact CD2-CD2 4.35Å; F156-L159 WeakPolarHBondContact O-CB 3.33Å; R157-L159 VanDerWaalsContact C-N 3.26Å; R157-L159 PolarHBondContact O-N 3.4Å; L159-N161 VanDerWaalsContact C-N 3.31Å; L159-N161 PolarHBondContact O-N 3.37Å; L159-K162 PolarHBondContact O-N 3.23Å; L159-I163 HydrophobicContact CD1-CD1 3.57Å; L159-I163 HydrophobicContact CD1-CG1 4.18Å; L159-I163 HydrophobicContact CG-CD1 4Å; L159-I163 WeakPolarHBondContact O-CB 3.49Å; L159-I163 VanDerWaalsContact O-CG1 3.24Å; L159-I163 WeakPolarHBondContact O-CG1 3.49Å; L159-I163 PolarHBondContact O-N 3.22Å
160	E	96.3	Very high	92.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.1	-44.2	177.7	-72.7	177.5	141.4	0	0	111.8	F156 R157 G164 V165 R170 M319 R323	F156-E160 HydrophobicContact CE1-CG 4.19Å; F156-E160 WeakPolarHBondContact CE1-OE1 3.27Å; F156-E160 WeakPolarHBondContact O-CG 3.3Å; F156-E160 PolarHBondContact O-N 2.99Å; F156-E160 VanDerWaalsContact O-N 3.13Å; R157-E160 VanDerWaalsContact CD-OE2 3.3Å; R157-E160 WeakPolarHBondContact CD-OE2 3.49Å; R157-E160 IonicContact CZ-OE2 2.82Å; R157-E160 IonicContact NE-OE2 3.75Å; R157-E160 IonicContact NH1-OE1 2.8Å; R157-E160 PolarHBondContact NH1-OE1 3.25Å; R157-E160 IonicContact NH1-OE2 2.68Å; R157-E160 PolarHBondContact NH1-OE2 3.41Å; R157-E160 PolarHBondContact O-N 3.39Å; E160-G164 PolarHBondContact O-N 3.12Å; E160-V165 HydrophobicContact CB-CB 4.1Å; E160-V165 HydrophobicContact CB-CG2 3.9Å; E160-V165 HydrophobicContact CG-CG2 4.26Å; E160-V165 WeakPolarHBondContact O-CB 3.41Å; E160-V165 PolarHBondContact O-N 3.33Å; E160-R170 VanDerWaalsContact CB-NH2 3.29Å; E160-R170 IonicContact OE1-NH1 3.44Å; E160-R170 IonicContact OE2-CZ 2.76Å; E160-R170 IonicContact OE2-NH1 2.7Å; E160-R170 PolarHBondContact OE2-NH1 2.84Å; E160-R170 IonicContact OE2-NH2 3.16Å; E160-R170 PolarHBondContact OE2-NH2 3.49Å; E160-M319 HydrophobicContact CG-CE 4.49Å; E160-R323 IonicContact OE1-CZ 2.96Å; E160-R323 VanDerWaalsContact OE1-CZ 3.24Å; E160-R323 IonicContact OE1-NH1 3.42Å; E160-R323 PolarHBondContact OE1-NH1 3.21Å; E160-R323 IonicContact OE1-NH2 2.6Å; E160-R323 PolarHBondContact OE1-NH2 3.07Å
161	N	96	Very high	92.8	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-50.3	-179.2	-68.5	-1.5	0	0	0	111.6	R157 L158 L159 I163 G164 R170 Y178 A193 T198	R157-N161 WeakPolarHBondContact O-CB 3.1Å; R157-N161 VanDerWaalsContact O-CG 3.26Å; R157-N161 PolarHBondContact O-N 3.3Å; R157-N161 PolarHBondContact O-OD1 2.58Å; L158-N161 PolarHBondContact O-N 2.95Å; L159-N161 VanDerWaalsContact C-N 3.31Å; L159-N161 PolarHBondContact O-N 3.37Å; N161-I163 VanDerWaalsContact C-N 3.3Å; N161-I163 PolarHBondContact O-N 3.16Å; N161-G164 WeakPolarHBondContact O-CA 3.42Å; N161-G164 PolarHBondContact O-N 3.24Å; N161-G164 VanDerWaalsContact O-N 3.12Å; N161-R170 PolarHBondContact OD1-NH2 3.34Å; N161-Y178 PolarHBondContact ND2-OH 3.34Å; N161-Y178 PolarHBondContact OD1-OH 2.93Å; N161-A193 HydrophobicContact CB-CB 4.49Å; N161-T198 VanDerWaalsContact O-CG2 3.31Å; N161-T198 WeakPolarHBondContact O-CG2 3.43Å
162	K	97.6	Very high	92.7	Very high	18 Å²	18	31.5 Å²	31.5	8%	0.078	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-30	-178.1	-72.6	171.6	177.4	-73.7	0	112.8	L85 I88 D89 L158 L159 A193 E196 L199	L85-K162 HydrophobicContact CD2-CD 3.79Å; I88-K162 HydrophobicContact CG2-CB 3.98Å; D89-K162 WeakPolarHBondContact OD1-CD 3.24Å; D89-K162 WeakPolarHBondContact OD1-CE 3.27Å; D89-K162 IonicContact OD1-NZ 2.77Å; D89-K162 PolarHBondContact OD1-NZ 2.96Å; D89-K162 IonicContact OD2-NZ 3.86Å; D89-K162 PolarHBondContact OD2-NZ 2.99Å; L158-K162 VanDerWaalsContact O-CB 3.27Å; L158-K162 WeakPolarHBondContact O-CB 3.3Å; L158-K162 VanDerWaalsContact O-CG 3.3Å; L158-K162 WeakPolarHBondContact O-CG 3.19Å; L158-K162 PolarHBondContact O-N 2.79Å; L159-K162 PolarHBondContact O-N 3.23Å; K162-A193 HydrophobicContact CG-CB 4.42Å; K162-E196 IonicContact NZ-OE2 3.02Å; K162-E196 PolarHBondContact NZ-OE2 3.39Å; K162-L199 PolarHBondContact O-N 2.97Å
163	I	97.7	Very high	92.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.2	-48.1	170.6	-65.2	172.2	0	0	0	110	I88 L159 N161 L200 M315 M319 V359 F360	I88-I163 HydrophobicContact CD1-CD1 4.1Å; I88-I163 HydrophobicContact CD1-CG1 3.72Å; L159-I163 HydrophobicContact CD1-CD1 3.57Å; L159-I163 HydrophobicContact CD1-CG1 4.18Å; L159-I163 HydrophobicContact CG-CD1 4Å; L159-I163 WeakPolarHBondContact O-CB 3.49Å; L159-I163 VanDerWaalsContact O-CG1 3.24Å; L159-I163 WeakPolarHBondContact O-CG1 3.49Å; L159-I163 PolarHBondContact O-N 3.22Å; N161-I163 VanDerWaalsContact C-N 3.3Å; N161-I163 PolarHBondContact O-N 3.16Å; I163-L200 PolarHBondContact O-N 3.42Å; I163-M315 HydrophobicContact CD1-CE 4.14Å; I163-M315 HydrophobicContact CD1-SD 4.05Å; I163-M315 HydrophobicContact CG1-CE 4.24Å; I163-M315 HydrophobicContact CG1-SD 4.5Å; I163-M315 HydrophobicContact CG2-CE 3.85Å; I163-M319 HydrophobicContact CD1-CE 4.44Å; I163-M319 HydrophobicContact CD1-SD 3.43Å; I163-M319 WeakPolarHBondContact CD1-SD 3.3Å; I163-V359 HydrophobicContact CG2-CB 3.94Å; I163-V359 HydrophobicContact CG2-CG1 4.06Å; I163-V359 HydrophobicContact CG2-CG2 3.82Å; I163-F360 HydrophobicContact CG2-CE2 4.06Å
164	G	97.1	Very high	90.8	Very high	6 Å²	6	33 Å²	33	6%	0.062	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	132.5	30.2	175.1	0	0	0	0	0	115.6	E160 N161 Q166	E160-G164 PolarHBondContact O-N 3.12Å; N161-G164 WeakPolarHBondContact O-CA 3.42Å; N161-G164 PolarHBondContact O-N 3.24Å; N161-G164 VanDerWaalsContact O-N 3.12Å; G164-Q166 PolarHBondContact O-N 3.21Å
165	V	95.9	Very high	89.6	Confident	9 Å²	9	43.6 Å²	43.6	6%	0.055	21%	0.214	C	C	.	.			trans	-67.8	112.2	171.9	178.5	0	0	0	0	109	E160 R170 Y357 V359	E160-V165 HydrophobicContact CB-CB 4.1Å; E160-V165 HydrophobicContact CB-CG2 3.9Å; E160-V165 HydrophobicContact CG-CG2 4.26Å; E160-V165 WeakPolarHBondContact O-CB 3.41Å; E160-V165 PolarHBondContact O-N 3.33Å; V165-R170 HydrophobicContact CG1-CG 4.16Å; V165-Y357 HydrophobicContact CG1-CD1 3.79Å; V165-Y357 HydrophobicContact CG1-CE1 4.18Å; V165-V359 HydrophobicContact CB-CG2 4.46Å; V165-V359 HydrophobicContact CG2-CG2 3.64Å
166	Q	91.5	Very high	88.4	Confident	65 Å²	65	48.7 Å²	48.7	30%	0.304	23%	0.231	S	C	.	.			trans	-70.3	140.4	-179.4	-57.5	-177.9	11.7	0	0	111.7	G164 N168 L169	G164-Q166 PolarHBondContact O-N 3.21Å; Q166-N168 WeakPolarHBondContact CB-OD1 3.18Å; Q166-N168 PolarHBondContact O-N 3.04Å; Q166-N168 PolarHBondContact OE1-OD1 2.7Å; Q166-L169 HydrophobicContact CB-CD1 4.03Å; Q166-L169 HydrophobicContact CB-CG 4.12Å; Q166-L169 HydrophobicContact CG-CD1 4.36Å; Q166-L169 PolarHBondContact O-N 3.09Å
167	D	89.3	Confident	87.6	Confident	67 Å²	67	50.8 Å²	50.8	36%	0.358	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-63.4	-43.3	-176	-176.7	58	0	0	0	113.3	L169 R170 H177 Y178	D167-L169 PolarHBondContact O-N 2.74Å; D167-L169 VanDerWaalsContact O-N 3.09Å; D167-R170 VanDerWaalsContact O-CB 3.31Å; D167-R170 WeakPolarHBondContact O-CB 3.42Å; D167-R170 PolarHBondContact O-N 2.84Å; D167-H177 IonicContact OD1-CE1 2.71Å; D167-H177 PolarHBondContact OD1-CE1 3.19Å; D167-H177 IonicContact OD1-NE2 2.7Å; D167-H177 PolarHBondContact OD1-NE2 3.44Å; D167-H177 IonicContact OD2-CD2 2.74Å; D167-H177 IonicContact OD2-CE1 3.7Å; D167-H177 IonicContact OD2-NE2 3.21Å; D167-H177 PolarHBondContact OD2-NE2 2.8Å; D167-Y178 WeakPolarHBondContact OD1-CE1 3.43Å
168	N	89.7	Confident	87	Confident	109 Å²	109	51.2 Å²	51.2	58%	0.583	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.6	-19.2	176.4	64.7	-17.1	0	0	0	114.3	Q166	Q166-N168 WeakPolarHBondContact CB-OD1 3.18Å; Q166-N168 PolarHBondContact O-N 3.04Å; Q166-N168 PolarHBondContact OE1-OD1 2.7Å
169	L	91.4	Very high	86.4	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-90	-17	177.8	-63.7	179.6	0	0	0	112.9	Q166 D167 V171 R281 R356	Q166-L169 HydrophobicContact CB-CD1 4.03Å; Q166-L169 HydrophobicContact CB-CG 4.12Å; Q166-L169 HydrophobicContact CG-CD1 4.36Å; Q166-L169 PolarHBondContact O-N 3.09Å; D167-L169 PolarHBondContact O-N 2.74Å; D167-L169 VanDerWaalsContact O-N 3.09Å; L169-V171 PolarHBondContact O-N 2.88Å; L169-R281 VanDerWaalsContact CD1-CZ 3.42Å; L169-R281 VanDerWaalsContact CD1-NE 3.35Å; L169-R281 VanDerWaalsContact CD1-NH2 3.29Å; L169-R356 HydrophobicContact CB-CB 4.42Å
170	R	92.2	Very high	85.8	Confident	22 Å²	22	56.9 Å²	56.9	8%	0.083	27%	0.271	C	S	.	.	S	Bend	trans	-63.5	135.6	179.7	-63.8	177	173.2	-81.4	8.8	109.5	E160 N161 V165 D167 P172 Y178 Y357	E160-R170 VanDerWaalsContact CB-NH2 3.29Å; E160-R170 IonicContact OE1-NH1 3.44Å; E160-R170 IonicContact OE2-CZ 2.76Å; E160-R170 IonicContact OE2-NH1 2.7Å; E160-R170 PolarHBondContact OE2-NH1 2.84Å; E160-R170 IonicContact OE2-NH2 3.16Å; E160-R170 PolarHBondContact OE2-NH2 3.49Å; N161-R170 PolarHBondContact OD1-NH2 3.34Å; V165-R170 HydrophobicContact CG1-CG 4.16Å; D167-R170 VanDerWaalsContact O-CB 3.31Å; D167-R170 WeakPolarHBondContact O-CB 3.42Å; D167-R170 PolarHBondContact O-N 2.84Å; R170-P172 WeakPolarHBondContact O-CD 3.43Å; R170-Y178 VanDerWaalsContact CD-CD1 3.48Å; R170-Y357 HydrophobicContact CG-CE1 4.36Å
171	V	88.6	Confident	85	Confident	35 Å²	35	58.5 Å²	58.5	21%	0.212	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-70.6	121.2	177.2	179	0	0	0	0	108.1	L169 S351 Y357	L169-V171 PolarHBondContact O-N 2.88Å; V171-S351 WeakPolarHBondContact CG1-OG 3.45Å; V171-Y357 HydrophobicContact CG2-CE2 4.13Å; V171-Y357 PolarHBondContact N-OH 3.28Å
172	P	79.1	Confident	84.3	Confident	106 Å²	106	58.5 Å²	58.5	69%	0.688	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-66.9	147.3	-178.8	27.8	-34.7	0	0	0	110.1	R170	R170-P172 WeakPolarHBondContact O-CD 3.43Å
173	Y	72.8	Confident	83.3	Confident	19 Å²	19	65.6 Å²	65.6	8%	0.075	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-136.7	128.2	178.4	165.6	-120.5	0	0	0	109.9	F151 R175 R176 Y181 G341 G342 S343 Y348	F151-Y173 AromaticContact CE1-CD1 3.84Å; F151-Y173 HydrophobicContact CE1-CD1 3.84Å; F151-Y173 HydrophobicContact CE1-CE1 4.37Å; F151-Y173 HydrophobicContact CE2-CD1 4.37Å; F151-Y173 HydrophobicContact CE2-CE1 4.16Å; F151-Y173 AromaticContact CZ-CD1 3.71Å; F151-Y173 HydrophobicContact CZ-CD1 3.71Å; F151-Y173 AromaticContact CZ-CE1 3.95Å; F151-Y173 HydrophobicContact CZ-CE1 3.95Å; F151-Y173 HydrophobicContact CZ-CG 4.35Å; Y173-R175 PolarHBondContact O-N 3.02Å; Y173-R176 PolarHBondContact O-N 3.27Å; Y173-Y181 HydrophobicContact CD1-CE2 4.36Å; Y173-Y181 WeakPolarHBondContact CD1-OH 3.44Å; Y173-Y181 HydrophobicContact CE1-CE1 4.49Å; Y173-Y181 HydrophobicContact CE1-CE2 4.48Å; Y173-Y181 AromaticContact CE1-CZ 3.79Å; Y173-Y181 WeakPolarHBondContact CE1-OH 3.31Å; Y173-G341 PolarHBondContact OH-O 3.34Å; Y173-G342 WeakPolarHBondContact OH-CA 3.45Å; Y173-G342 PolarHBondContact OH-O 3.39Å; Y173-S343 WeakPolarHBondContact OH-CA 3.34Å; Y173-S343 PolarHBondContact OH-N 3.03Å; Y173-Y348 HydrophobicContact CG-CD2 4.32Å; Y173-Y348 HydrophobicContact CG-CE2 4.41Å
174	N	63.3	Low	82.2	Confident	105 Å²	105	68.2 Å²	68.2	56%	0.561	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	26.9	-174.3	-80.4	-1.8	0	0	0	115	R176	N174-R176 PolarHBondContact O-N 3.08Å; N174-R176 VanDerWaalsContact O-N 3.11Å
175	R	67.3	Low	81	Confident	253 Å²	253	74.7 Å²	74.7	96%	0.955	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	20.9	-172.9	-53.4	179.1	177	177.2	-1.9	113.5	Y173	Y173-R175 PolarHBondContact O-N 3.02Å
176	R	70	Confident	80.2	Confident	147 Å²	147	78.5 Å²	78.5	56%	0.555	39%	0.386	S	S	*	.	B	Isolated β-bridge	trans	-104	146.6	175.8	-73.4	-170.4	-174.4	-174.6	0.5	110	Y173 N174 D180 Y181	Y173-R176 PolarHBondContact O-N 3.27Å; N174-R176 PolarHBondContact O-N 3.08Å; N174-R176 VanDerWaalsContact O-N 3.11Å; R176-D180 WeakPolarHBondContact CA-OD2 3.4Å; R176-D180 HydrophobicContact CB-CB 4.34Å; R176-D180 VanDerWaalsContact CB-OD2 3.23Å; R176-D180 WeakPolarHBondContact CB-OD2 3.47Å; R176-Y181 HydrophobicContact CB-CE2 4.28Å
177	H	78.3	Confident	79.5	Confident	59 Å²	59	77.5 Å²	77.5	27%	0.273	38%	0.384	S	S	.	.			trans	-74.6	151.6	173	-157	-81.3	0	0	0	108.8	D167 K179 D180	D167-H177 IonicContact OD1-CE1 2.71Å; D167-H177 PolarHBondContact OD1-CE1 3.19Å; D167-H177 IonicContact OD1-NE2 2.7Å; D167-H177 PolarHBondContact OD1-NE2 3.44Å; D167-H177 IonicContact OD2-CD2 2.74Å; D167-H177 IonicContact OD2-CE1 3.7Å; D167-H177 IonicContact OD2-NE2 3.21Å; D167-H177 PolarHBondContact OD2-NE2 2.8Å; H177-K179 HydrophobicContact CB-CB 4.4Å; H177-K179 VanDerWaalsContact CE1-CD 3.45Å; H177-K179 WeakPolarHBondContact CE1-CD 3.41Å; H177-K179 VanDerWaalsContact CE1-CE 3.49Å; H177-K179 WeakPolarHBondContact CE1-CE 3.47Å; H177-K179 WeakPolarHBondContact ND1-CD 3.46Å; H177-K179 VanDerWaalsContact ND1-CG 3.26Å; H177-K179 WeakPolarHBondContact ND1-CG 3.39Å; H177-K179 PolarHBondContact ND1-N 3.4Å; H177-K179 PolarHBondContact O-N 3.02Å; H177-D180 PolarHBondContact N-OD2 3.13Å; H177-D180 WeakPolarHBondContact O-CB 3.46Å; H177-D180 PolarHBondContact O-N 3.39Å
178	Y	81.8	Confident	79.2	Confident	21 Å²	21	80.4 Å²	80.4	8%	0.082	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-61	-19.7	176.2	78	-89.3	0	0	0	112.5	R157 N161 D167 R170 D180 L190 E194	R157-Y178 HydrophobicContact CB-CD2 4.34Å; R157-Y178 HydrophobicContact CB-CE2 4.12Å; R157-Y178 HydrophobicContact CG-CD2 3.91Å; R157-Y178 HydrophobicContact CG-CE2 4.2Å; N161-Y178 PolarHBondContact ND2-OH 3.34Å; N161-Y178 PolarHBondContact OD1-OH 2.93Å; D167-Y178 WeakPolarHBondContact OD1-CE1 3.43Å; R170-Y178 VanDerWaalsContact CD-CD1 3.48Å; Y178-D180 VanDerWaalsContact C-N 3.35Å; Y178-L190 HydrophobicContact CE2-CD1 3.96Å; Y178-L190 HydrophobicContact CE2-CD2 3.81Å; Y178-L190 HydrophobicContact CE2-CG 4.29Å; Y178-E194 PolarHBondContact OH-OE1 2.92Å
179	K	82.3	Confident	79	Confident	46 Å²	46	78.4 Å²	78.4	20%	0.2	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-69.8	-29.3	176.9	-72	174.7	-177.4	162	0	112.9	H177 Y181 I182 L190 E194	H177-K179 HydrophobicContact CB-CB 4.4Å; H177-K179 VanDerWaalsContact CE1-CD 3.45Å; H177-K179 WeakPolarHBondContact CE1-CD 3.41Å; H177-K179 VanDerWaalsContact CE1-CE 3.49Å; H177-K179 WeakPolarHBondContact CE1-CE 3.47Å; H177-K179 WeakPolarHBondContact ND1-CD 3.46Å; H177-K179 VanDerWaalsContact ND1-CG 3.26Å; H177-K179 WeakPolarHBondContact ND1-CG 3.39Å; H177-K179 PolarHBondContact ND1-N 3.4Å; H177-K179 PolarHBondContact O-N 3.02Å; K179-Y181 PolarHBondContact O-N 2.95Å; K179-I182 PolarHBondContact O-N 3.26Å; K179-L190 HydrophobicContact CD-CD2 4.15Å; K179-L190 HydrophobicContact CG-CD2 3.56Å; K179-E194 WeakPolarHBondContact CE-OE1 3.36Å; K179-E194 WeakPolarHBondContact CE-OE2 3.36Å; K179-E194 IonicContact NZ-OE1 3.76Å; K179-E194 PolarHBondContact NZ-OE1 3.3Å; K179-E194 IonicContact NZ-OE2 2.69Å; K179-E194 PolarHBondContact NZ-OE2 3.07Å
180	D	82.9	Confident	78.8	Confident	88 Å²	88	77.9 Å²	77.9	47%	0.471	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-66.4	-12.5	-175.8	-58	-19.7	0	0	0	112.6	R176 H177 Y178	R176-D180 WeakPolarHBondContact CA-OD2 3.4Å; R176-D180 HydrophobicContact CB-CB 4.34Å; R176-D180 VanDerWaalsContact CB-OD2 3.23Å; R176-D180 WeakPolarHBondContact CB-OD2 3.47Å; H177-D180 PolarHBondContact N-OD2 3.13Å; H177-D180 WeakPolarHBondContact O-CB 3.46Å; H177-D180 PolarHBondContact O-N 3.39Å; Y178-D180 VanDerWaalsContact C-N 3.35Å
181	Y	80.3	Confident	78.4	Confident	35 Å²	35	80.2 Å²	80.2	14%	0.137	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-92.4	-13.6	178	-64	-84.3	0	0	0	113.2	F151 Y173 R176 K179	F151-Y181 HydrophobicContact CB-CD1 4.14Å; F151-Y181 HydrophobicContact CB-CG 4.05Å; Y173-Y181 HydrophobicContact CD1-CE2 4.36Å; Y173-Y181 WeakPolarHBondContact CD1-OH 3.44Å; Y173-Y181 HydrophobicContact CE1-CE1 4.49Å; Y173-Y181 HydrophobicContact CE1-CE2 4.48Å; Y173-Y181 AromaticContact CE1-CZ 3.79Å; Y173-Y181 WeakPolarHBondContact CE1-OH 3.31Å; R176-Y181 HydrophobicContact CB-CE2 4.28Å; K179-Y181 PolarHBondContact O-N 2.95Å
182	I	80.9	Confident	78.4	Confident	7 Å²	7	82 Å²	82	4%	0.036	41%	0.407	C	S	.	.			trans	-102.6	130.5	179.2	-55.6	-60.2	0	0	0	108.2	L154 K179 E186 T187 L190	L154-I182 HydrophobicContact CB-CD1 4.49Å; L154-I182 HydrophobicContact CD1-CG2 4.12Å; K179-I182 PolarHBondContact O-N 3.26Å; I182-E186 HydrophobicContact CG2-CB 3.43Å; I182-E186 VanDerWaalsContact CG2-CB 3.43Å; I182-T187 PolarHBondContact O-OG1 3.39Å; I182-T187 VanDerWaalsContact O-OG1 3.09Å; I182-L190 HydrophobicContact CG1-CD1 4.07Å
183	K	77.3	Confident	78.7	Confident	167 Å²	167	77.1 Å²	77.1	73%	0.726	38%	0.375	S	S	*	.			trans	-123.7	150.2	-172.9	-63.5	-177.5	-176.4	173.8	0	111.8
184	G	73.3	Confident	79.3	Confident	55 Å²	55	79.3 Å²	79.3	57%	0.567	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	-146	172	0	0	0	0	0	112.8	E186 T187	G184-E186 PolarHBondContact O-N 3.31Å; G184-E186 VanDerWaalsContact O-N 3.1Å; G184-T187 WeakPolarHBondContact O-CB 3.41Å; G184-T187 PolarHBondContact O-N 3.34Å; G184-T187 PolarHBondContact O-OG1 3.39Å
185	D	72.5	Confident	80.5	Confident	142 Å²	142	81.8 Å²	81.8	76%	0.759	39%	0.394	S	S	*	.	H	α-helix	trans	-59.2	-23.1	-176.7	-56.1	-10.1	0	0	0	113	T187 E188 T189	D185-T187 PolarHBondContact O-N 2.92Å; D185-E188 PolarHBondContact O-N 3.34Å; D185-T189 PolarHBondContact O-N 3.25Å
186	E	78.5	Confident	81.7	Confident	89 Å²	89	73.5 Å²	73.5	42%	0.416	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-26.7	175	-60.6	-171	165.1	0	0	113.1	L154 I182 G184 L190	L154-E186 HydrophobicContact CD1-CB 4.19Å; L154-E186 HydrophobicContact CD2-CB 3.86Å; L154-E186 HydrophobicContact CD2-CG 3.79Å; I182-E186 HydrophobicContact CG2-CB 3.43Å; I182-E186 VanDerWaalsContact CG2-CB 3.43Å; G184-E186 PolarHBondContact O-N 3.31Å; G184-E186 VanDerWaalsContact O-N 3.1Å; E186-L190 PolarHBondContact O-N 3.26Å
187	T	78.4	Confident	83	Confident	43 Å²	43	69.2 Å²	69.2	26%	0.264	36%	0.357	S	S	.	.	H	α-helix	trans	-68.6	-37.8	177.6	-52.5	0	0	0	0	111.1	I182 G184 D185 L190 L191	I182-T187 PolarHBondContact O-OG1 3.39Å; I182-T187 VanDerWaalsContact O-OG1 3.09Å; G184-T187 WeakPolarHBondContact O-CB 3.41Å; G184-T187 PolarHBondContact O-N 3.34Å; G184-T187 PolarHBondContact O-OG1 3.39Å; D185-T187 PolarHBondContact O-N 2.92Å; T187-L190 PolarHBondContact O-N 3.21Å; T187-L191 HydrophobicContact CG2-CD1 4.45Å; T187-L191 WeakPolarHBondContact O-CG 3.46Å; T187-L191 PolarHBondContact O-N 3.13Å
188	E	82.9	Confident	84	Confident	129 Å²	129	67.8 Å²	67.8	60%	0.603	35%	0.353	S	S	*	.	H	α-helix	trans	-64.6	-47.5	177.5	-172.6	171.9	-162.3	0	0	110.8	D185 L190 L191 D192	D185-E188 PolarHBondContact O-N 3.34Å; E188-L190 PolarHBondContact O-N 3.47Å; E188-L190 VanDerWaalsContact O-N 3.11Å; E188-L191 WeakPolarHBondContact O-CB 3.29Å; E188-L191 PolarHBondContact O-N 2.85Å; E188-D192 PolarHBondContact O-N 3.11Å
189	T	85.1	Confident	84.8	Confident	66 Å²	66	66.9 Å²	66.9	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-55	-36.3	176.2	-55.4	0	0	0	0	112.2	L158 D185 A193	L158-T189 HydrophobicContact CD1-CG2 4.04Å; L158-T189 HydrophobicContact CD2-CG2 4.05Å; D185-T189 PolarHBondContact O-N 3.25Å; T189-A193 WeakPolarHBondContact O-CB 3.39Å; T189-A193 PolarHBondContact O-N 2.91Å; T189-A193 VanDerWaalsContact O-N 3.1Å
190	L	86.1	Confident	85.6	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-78.4	-32.3	-178.9	-170.2	143	0	0	0	112.7	L154 R157 L158 Y178 K179 I182 E186 T187 E188 E194	L154-L190 HydrophobicContact CD1-CB 4.37Å; L154-L190 HydrophobicContact CD1-CD1 4.04Å; R157-L190 HydrophobicContact CB-CD1 3.8Å; L158-L190 HydrophobicContact CD2-CB 4.44Å; Y178-L190 HydrophobicContact CE2-CD1 3.96Å; Y178-L190 HydrophobicContact CE2-CD2 3.81Å; Y178-L190 HydrophobicContact CE2-CG 4.29Å; K179-L190 HydrophobicContact CD-CD2 4.15Å; K179-L190 HydrophobicContact CG-CD2 3.56Å; I182-L190 HydrophobicContact CG1-CD1 4.07Å; E186-L190 PolarHBondContact O-N 3.26Å; T187-L190 PolarHBondContact O-N 3.21Å; E188-L190 PolarHBondContact O-N 3.47Å; E188-L190 VanDerWaalsContact O-N 3.11Å; L190-E194 PolarHBondContact O-N 3.33Å
191	L	85.3	Confident	86.3	Confident	71 Å²	71	64.9 Å²	64.9	37%	0.372	34%	0.337	S	S	.	.	H	α-helix	trans	-67.9	-41.6	170.9	-70.5	170.8	0	0	0	111.2	T187 E188 A193 E194 Q195	T187-L191 HydrophobicContact CG2-CD1 4.45Å; T187-L191 WeakPolarHBondContact O-CG 3.46Å; T187-L191 PolarHBondContact O-N 3.13Å; E188-L191 WeakPolarHBondContact O-CB 3.29Å; E188-L191 PolarHBondContact O-N 2.85Å; L191-A193 VanDerWaalsContact C-N 3.35Å; L191-E194 PolarHBondContact O-N 3.29Å; L191-Q195 WeakPolarHBondContact O-CG 3.32Å; L191-Q195 PolarHBondContact O-N 3.36Å
192	D	87	Confident	87.2	Confident	74 Å²	74	63.5 Å²	63.5	40%	0.396	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-47.3	175.2	-67.1	-19.1	0	0	0	110.4	E188 E194 Q195 E196	E188-D192 PolarHBondContact O-N 3.11Å; D192-E194 PolarHBondContact O-N 3.38Å; D192-E194 VanDerWaalsContact O-N 3.12Å; D192-Q195 PolarHBondContact O-N 2.95Å; D192-E196 WeakPolarHBondContact O-CG 3.25Å; D192-E196 PolarHBondContact O-N 3.47Å
193	A	86.5	Confident	88	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-21.5	178.8	0	0	0	0	0	114.5	L158 N161 K162 T189 L191	L158-A193 HydrophobicContact CD2-CB 3.58Å; N161-A193 HydrophobicContact CB-CB 4.49Å; K162-A193 HydrophobicContact CG-CB 4.42Å; T189-A193 WeakPolarHBondContact O-CB 3.39Å; T189-A193 PolarHBondContact O-N 2.91Å; T189-A193 VanDerWaalsContact O-N 3.1Å; L191-A193 VanDerWaalsContact C-N 3.35Å
194	E	84.9	Confident	89	Confident	66 Å²	66	56.3 Å²	56.3	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-84.7	-27.9	172.8	-75.6	-175.3	163.8	0	0	113.5	Y178 K179 L190 L191 D192	Y178-E194 PolarHBondContact OH-OE1 2.92Å; K179-E194 WeakPolarHBondContact CE-OE1 3.36Å; K179-E194 WeakPolarHBondContact CE-OE2 3.36Å; K179-E194 IonicContact NZ-OE1 3.76Å; K179-E194 PolarHBondContact NZ-OE1 3.3Å; K179-E194 IonicContact NZ-OE2 2.69Å; K179-E194 PolarHBondContact NZ-OE2 3.07Å; L190-E194 PolarHBondContact O-N 3.33Å; L191-E194 PolarHBondContact O-N 3.29Å; D192-E194 PolarHBondContact O-N 3.38Å; D192-E194 VanDerWaalsContact O-N 3.12Å
195	Q	88.8	Confident	90.2	Very high	156 Å²	156	57.2 Å²	57.2	73%	0.729	29%	0.29	S	S	*	.	H	α-helix	trans	-83.6	-32	180	-68.3	177.4	40.2	0	0	112	L191 D192	L191-Q195 WeakPolarHBondContact O-CG 3.32Å; L191-Q195 PolarHBondContact O-N 3.36Å; D192-Q195 PolarHBondContact O-N 2.95Å
196	E	93.6	Very high	91.5	Very high	80 Å²	80	51.9 Å²	51.9	37%	0.374	26%	0.26	S	S	.	.	S	Bend	trans	-67.5	150.7	176.9	-64.8	175.6	177	0	0	112.2	R92 K162 D192 T198	R92-E196 IonicContact CZ-OE2 3.9Å; R92-E196 VanDerWaalsContact CZ-OE2 3.28Å; R92-E196 IonicContact NH1-OE2 3.74Å; R92-E196 PolarHBondContact NH1-OE2 3.03Å; R92-E196 IonicContact NH2-OE2 3.78Å; R92-E196 PolarHBondContact NH2-OE2 3.15Å; K162-E196 IonicContact NZ-OE2 3.02Å; K162-E196 PolarHBondContact NZ-OE2 3.39Å; D192-E196 WeakPolarHBondContact O-CG 3.25Å; D192-E196 PolarHBondContact O-N 3.47Å; E196-T198 PolarHBondContact O-N 2.83Å
197	P	96.9	Very high	92.4	Very high	56 Å²	56	47.7 Å²	47.7	36%	0.364	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-57.6	125.4	175.7	-24.8	34.1	0	0	0	112.4	R92 L202	R92-P197 VanDerWaalsContact CZ-O 3.3Å; R92-P197 PolarHBondContact NE-O 2.87Å; R92-P197 PolarHBondContact NH2-O 2.88Å; P197-L202 HydrophobicContact CB-CD1 4.22Å; P197-L202 HydrophobicContact CB-CD2 3.82Å; P197-L202 HydrophobicContact CB-CG 3.9Å
198	T	98.3	Very high	93.4	Very high	30 Å²	30	48.4 Å²	48.4	18%	0.184	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-74.4	160.9	176.8	66.6	0	0	0	0	111.1	N161 E196 L200 K201 L202	N161-T198 VanDerWaalsContact O-CG2 3.31Å; N161-T198 WeakPolarHBondContact O-CG2 3.43Å; E196-T198 PolarHBondContact O-N 2.83Å; T198-L200 PolarHBondContact O-N 2.9Å; T198-K201 PolarHBondContact O-N 3.31Å; T198-K201 VanDerWaalsContact O-N 3.13Å; T198-K201 PolarHBondContact OG1-N 2.92Å; T198-L202 WeakPolarHBondContact O-CG 3.41Å; T198-L202 PolarHBondContact O-N 3.09Å
199	L	98.6	Very high	94	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-58	-40.3	173.4	-177.5	63.7	0	0	0	111.3	V91 I113 K162 K201 L202 V203 L312 M315 F360	V91-L199 HydrophobicContact CG1-CD1 4.04Å; I113-L199 HydrophobicContact CD1-CD2 4.16Å; K162-L199 PolarHBondContact O-N 2.97Å; L199-K201 PolarHBondContact O-N 3.46Å; L199-L202 PolarHBondContact O-N 3.03Å; L199-V203 HydrophobicContact CD1-CG2 4.07Å; L199-V203 HydrophobicContact CG-CG2 4.27Å; L199-V203 WeakPolarHBondContact O-CB 3.46Å; L199-V203 VanDerWaalsContact O-CG2 3.23Å; L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 2.87Å; L199-L312 HydrophobicContact CD2-CD2 3.91Å; L199-M315 HydrophobicContact CD2-CE 4.06Å; L199-F360 HydrophobicContact CD2-CZ 4.24Å; L199-F360 HydrophobicContact CG-CZ 4.15Å
200	L	98.6	Very high	94.5	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.058	21%	0.21	C	C	.	.	H	α-helix	trans	-54.2	-50.7	172.8	174.9	64.4	0	0	0	111.7	I163 T198 L202 V203 E204 R281 L282 V359 F360	I163-L200 PolarHBondContact O-N 3.42Å; T198-L200 PolarHBondContact O-N 2.9Å; L200-L202 PolarHBondContact O-N 3.3Å; L200-V203 PolarHBondContact O-N 3.46Å; L200-E204 WeakPolarHBondContact O-CB 3.45Å; L200-E204 PolarHBondContact O-N 2.82Å; L200-R281 HydrophobicContact CD1-CB 4.29Å; L200-R281 HydrophobicContact CD2-CB 4.01Å; L200-L282 HydrophobicContact CD1-CD2 3.74Å; L200-V359 HydrophobicContact CB-CG1 3.67Å; L200-V359 HydrophobicContact CD1-CG1 4.19Å; L200-V359 HydrophobicContact CD2-CG1 3.9Å; L200-V359 HydrophobicContact CG-CG1 4.12Å; L200-F360 HydrophobicContact CB-CE1 4.48Å; L200-F360 HydrophobicContact CD1-CD1 4.1Å; L200-F360 HydrophobicContact CD1-CE1 4Å
201	K	98.4	Very high	94.8	Very high	82 Å²	82	44.5 Å²	44.5	36%	0.357	22%	0.215	S	C	.	.	H	α-helix	trans	-64.2	-41.9	-177.5	-177.7	60.5	-171.5	169.8	0	111.9	T198 L199 E204 E205	T198-K201 PolarHBondContact O-N 3.31Å; T198-K201 VanDerWaalsContact O-N 3.13Å; T198-K201 PolarHBondContact OG1-N 2.92Å; L199-K201 PolarHBondContact O-N 3.46Å; K201-E204 WeakPolarHBondContact CD-OE2 3.2Å; K201-E204 IonicContact NZ-OE2 3.98Å; K201-E204 PolarHBondContact NZ-OE2 2.55Å; K201-E204 WeakPolarHBondContact O-CB 3.35Å; K201-E204 PolarHBondContact O-N 2.6Å; K201-E205 WeakPolarHBondContact CE-OE1 3.49Å; K201-E205 WeakPolarHBondContact O-CG 2.85Å; K201-E205 PolarHBondContact O-N 3Å
202	L	98.6	Very high	95.1	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-38.5	179.2	-66.8	168.4	0	0	0	112.4	R92 F95 I96 P197 T198 L199 L200 W206	R92-L202 HydrophobicContact CB-CD1 3.75Å; R92-L202 HydrophobicContact CG-CD1 3.89Å; F95-L202 HydrophobicContact CB-CB 3.82Å; F95-L202 HydrophobicContact CB-CD1 4.11Å; F95-L202 HydrophobicContact CB-CD2 4.02Å; F95-L202 HydrophobicContact CB-CG 4.2Å; F95-L202 HydrophobicContact CD1-CB 4.07Å; F95-L202 WeakPolarHBondContact CD1-O 3.43Å; F95-L202 HydrophobicContact CG-CB 4.08Å; I96-L202 HydrophobicContact CD1-CD1 4.2Å; I96-L202 HydrophobicContact CG1-CD1 3.89Å; I96-L202 HydrophobicContact CG1-CD2 3.69Å; I96-L202 HydrophobicContact CG1-CG 4.45Å; P197-L202 HydrophobicContact CB-CD1 4.22Å; P197-L202 HydrophobicContact CB-CD2 3.82Å; P197-L202 HydrophobicContact CB-CG 3.9Å; T198-L202 WeakPolarHBondContact O-CG 3.41Å; T198-L202 PolarHBondContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 3.03Å; L200-L202 PolarHBondContact O-N 3.3Å; L202-W206 WeakPolarHBondContact O-CB 3.46Å; L202-W206 PolarHBondContact O-N 3.15Å; L202-W206 VanDerWaalsContact O-N 3.12Å
203	V	98.7	Very high	95.5	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-41.2	173.8	169.9	0	0	0	0	110.8	F95 L199 L200 W206 L207 L312 F360	F95-V203 HydrophobicContact CE1-CG2 4.44Å; F95-V203 HydrophobicContact CZ-CG2 4.4Å; L199-V203 HydrophobicContact CD1-CG2 4.07Å; L199-V203 HydrophobicContact CG-CG2 4.27Å; L199-V203 WeakPolarHBondContact O-CB 3.46Å; L199-V203 VanDerWaalsContact O-CG2 3.23Å; L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 2.87Å; L200-V203 PolarHBondContact O-N 3.46Å; V203-W206 HydrophobicContact CG1-CE3 4.4Å; V203-W206 PolarHBondContact O-N 3.16Å; V203-L207 HydrophobicContact CG1-CD1 3.93Å; V203-L207 HydrophobicContact CG1-CG 4.25Å; V203-L207 WeakPolarHBondContact O-CB 3.35Å; V203-L207 VanDerWaalsContact O-CG 3.32Å; V203-L207 WeakPolarHBondContact O-CG 3.16Å; V203-L207 PolarHBondContact O-N 3.44Å; V203-L312 HydrophobicContact CG1-CD1 3.96Å; V203-L312 HydrophobicContact CG2-CD1 4Å; V203-F360 HydrophobicContact CB-CE1 4.29Å; V203-F360 HydrophobicContact CG1-CE1 4.29Å; V203-F360 HydrophobicContact CG2-CE1 4.42Å
204	E	98.7	Very high	95.8	Very high	21 Å²	21	42.7 Å²	42.7	10%	0.098	20%	0.204	C	C	.	.	H	α-helix	trans	-55.2	-55.1	173.9	176	-176.4	-100	0	0	110.9	L200 K201 W206 L207 E208 L282 S283 A286	L200-E204 WeakPolarHBondContact O-CB 3.45Å; L200-E204 PolarHBondContact O-N 2.82Å; K201-E204 WeakPolarHBondContact CD-OE2 3.2Å; K201-E204 IonicContact NZ-OE2 3.98Å; K201-E204 PolarHBondContact NZ-OE2 2.55Å; K201-E204 WeakPolarHBondContact O-CB 3.35Å; K201-E204 PolarHBondContact O-N 2.6Å; E204-W206 PolarHBondContact O-N 3.04Å; E204-L207 WeakPolarHBondContact O-CB 3.45Å; E204-L207 PolarHBondContact O-N 3.22Å; E204-E208 WeakPolarHBondContact O-CG 3.26Å; E204-E208 PolarHBondContact O-N 3.12Å; E204-L282 HydrophobicContact CB-CD2 3.96Å; E204-L282 HydrophobicContact CG-CD2 4.42Å; E204-S283 PolarHBondContact OE1-N 2.96Å; E204-A286 HydrophobicContact CB-CB 4.35Å; E204-A286 HydrophobicContact CG-CB 3.71Å
205	E	98.5	Very high	96.1	Very high	74 Å²	74	44.6 Å²	44.6	35%	0.346	22%	0.22	S	C	.	.	H	α-helix	trans	-59.8	-34.7	179.9	-71.7	174.1	-171.3	0	0	112.6	K201 R209	K201-E205 WeakPolarHBondContact CE-OE1 3.49Å; K201-E205 WeakPolarHBondContact O-CG 2.85Å; K201-E205 PolarHBondContact O-N 3Å; E205-R209 VanDerWaalsContact C-NH1 3.29Å; E205-R209 VanDerWaalsContact O-CZ 3.3Å; E205-R209 PolarHBondContact O-NH1 3.38Å
206	W	98.4	Very high	96	Very high	31 Å²	31	45.3 Å²	45.3	12%	0.117	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-42.4	174.1	169	81.6	0	0	0	112.3	F95 M106 L202 V203 E204 E208 R209 I293 P305 L308 L309	F95-W206 HydrophobicContact CD1-CB 4Å; F95-W206 HydrophobicContact CE1-CB 3.59Å; F95-W206 HydrophobicContact CE1-CD2 4.27Å; F95-W206 AromaticContact CE1-CG 3.78Å; F95-W206 HydrophobicContact CE1-CG 3.78Å; M106-W206 HydrophobicContact CE-CH2 4.21Å; M106-W206 HydrophobicContact CE-CZ2 3.58Å; M106-W206 HydrophobicContact SD-CZ2 4.37Å; L202-W206 WeakPolarHBondContact O-CB 3.46Å; L202-W206 PolarHBondContact O-N 3.15Å; L202-W206 VanDerWaalsContact O-N 3.12Å; V203-W206 HydrophobicContact CG1-CE3 4.4Å; V203-W206 PolarHBondContact O-N 3.16Å; E204-W206 PolarHBondContact O-N 3.04Å; W206-E208 VanDerWaalsContact C-N 3.32Å; W206-E208 PolarHBondContact O-N 2.86Å; W206-R209 PolarHBondContact O-N 3.36Å; W206-R209 VanDerWaalsContact O-N 3.16Å; W206-I293 HydrophobicContact CH2-CD1 3.78Å; W206-I293 HydrophobicContact CZ3-CD1 4.14Å; W206-P305 HydrophobicContact CH2-CB 3.73Å; W206-P305 HydrophobicContact CH2-CG 4.37Å; W206-P305 HydrophobicContact CZ2-CB 3.91Å; W206-P305 HydrophobicContact CZ2-CG 4.04Å; W206-L308 HydrophobicContact CH2-CD2 4.25Å; W206-L308 HydrophobicContact CZ3-CD2 4.31Å; W206-L309 HydrophobicContact CZ3-CD2 4.24Å
207	L	98.6	Very high	95.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-35.9	175.9	-75.8	172.2	0	0	0	112.5	V203 E204 R209 T210 L282 A286 A290 I293 L309	V203-L207 HydrophobicContact CG1-CD1 3.93Å; V203-L207 HydrophobicContact CG1-CG 4.25Å; V203-L207 WeakPolarHBondContact O-CB 3.35Å; V203-L207 VanDerWaalsContact O-CG 3.32Å; V203-L207 WeakPolarHBondContact O-CG 3.16Å; V203-L207 PolarHBondContact O-N 3.44Å; E204-L207 WeakPolarHBondContact O-CB 3.45Å; E204-L207 PolarHBondContact O-N 3.22Å; L207-R209 PolarHBondContact O-N 2.87Å; L207-R209 VanDerWaalsContact O-N 3.15Å; L207-T210 VanDerWaalsContact O-CB 3.25Å; L207-T210 WeakPolarHBondContact O-CB 3.46Å; L207-T210 PolarHBondContact O-N 2.91Å; L207-T210 PolarHBondContact O-OG1 3.27Å; L207-L282 HydrophobicContact CD1-CD1 4.08Å; L207-L282 HydrophobicContact CD1-CD2 4.38Å; L207-A286 HydrophobicContact CB-CB 3.81Å; L207-A286 HydrophobicContact CD1-CB 4.31Å; L207-A290 HydrophobicContact CD1-CB 4.18Å; L207-A290 HydrophobicContact CD2-CB 4.15Å; L207-I293 HydrophobicContact CD2-CD1 3.61Å; L207-L309 HydrophobicContact CD2-CD2 4.27Å
208	E	98.4	Very high	95.5	Very high	58 Å²	58	40.8 Å²	40.8	27%	0.271	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18	176.8	-70.3	179	167.3	0	0	113.8	E204 W206 S283 K285 A286	E204-E208 WeakPolarHBondContact O-CG 3.26Å; E204-E208 PolarHBondContact O-N 3.12Å; W206-E208 VanDerWaalsContact C-N 3.32Å; W206-E208 PolarHBondContact O-N 2.86Å; E208-S283 VanDerWaalsContact OE1-CB 3.31Å; E208-S283 WeakPolarHBondContact OE1-CB 3.45Å; E208-S283 PolarHBondContact OE1-OG 3.01Å; E208-K285 HydrophobicContact CB-CD 4.19Å; E208-K285 HydrophobicContact CB-CG 4.35Å; E208-K285 HydrophobicContact CG-CB 4.11Å; E208-K285 HydrophobicContact CG-CD 4.44Å; E208-K285 HydrophobicContact CG-CG 4.34Å; E208-K285 WeakPolarHBondContact O-CE 3.45Å; E208-K285 PolarHBondContact O-NZ 3.33Å; E208-A286 HydrophobicContact CG-CB 4.02Å
209	R	96.2	Very high	95.3	Very high	93 Å²	93	40.5 Å²	40.5	35%	0.351	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	11.4	176.2	-57.7	-175.5	-58.2	-96.5	7.3	112.7	E205 W206 L207	E205-R209 VanDerWaalsContact C-NH1 3.29Å; E205-R209 VanDerWaalsContact O-CZ 3.3Å; E205-R209 PolarHBondContact O-NH1 3.38Å; W206-R209 PolarHBondContact O-N 3.36Å; W206-R209 VanDerWaalsContact O-N 3.16Å; L207-R209 PolarHBondContact O-N 2.87Å; L207-R209 VanDerWaalsContact O-N 3.15Å
210	T	96.1	Very high	95.2	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.031	21%	0.209	C	C	.	.			trans	-59.1	126.8	-179.6	-60.2	0	0	0	0	109.6	L207 G212 L213 G289 M292 I293 F302	L207-T210 VanDerWaalsContact O-CB 3.25Å; L207-T210 WeakPolarHBondContact O-CB 3.46Å; L207-T210 PolarHBondContact O-N 2.91Å; L207-T210 PolarHBondContact O-OG1 3.27Å; T210-G212 PolarHBondContact O-N 3.48Å; T210-L213 WeakPolarHBondContact O-CG 3.42Å; T210-G289 WeakPolarHBondContact OG1-CA 3.23Å; T210-M292 HydrophobicContact CG2-CB 4.08Å; T210-M292 HydrophobicContact CG2-CG 3.95Å; T210-I293 HydrophobicContact CG2-CD1 4.31Å; T210-I293 HydrophobicContact CG2-CG1 4Å; T210-F302 HydrophobicContact CG2-CE1 3.78Å; T210-F302 HydrophobicContact CG2-CZ 4.03Å
211	P	92.8	Very high	95.1	Very high	17 Å²	17	41.2 Å²	41.2	11%	0.11	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	135.3	-178.7	25.6	-35.4	0	0	0	111.4	F302 F386 L387	P211-F302 HydrophobicContact CG-CE1 3.7Å; P211-F302 HydrophobicContact CG-CZ 3.78Å; P211-F386 HydrophobicContact CB-CD1 3.75Å; P211-F386 HydrophobicContact CB-CE1 3.11Å; P211-F386 HydrophobicContact CB-CZ 3.94Å; P211-F386 HydrophobicContact CG-CE1 4.31Å; P211-L387 HydrophobicContact CB-CD2 4.28Å; P211-L387 HydrophobicContact CG-CD2 4.09Å
212	G	91.4	Very high	95	Very high	6 Å²	6	42.2 Å²	42.2	6%	0.062	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	105	-5	179.1	0	0	0	0	0	114.7	T210 E214 N219 F220	T210-G212 PolarHBondContact O-N 3.48Å; G212-E214 VanDerWaalsContact C-N 3.3Å; G212-E214 WeakPolarHBondContact CA-OE2 3.36Å; G212-E214 PolarHBondContact N-OE2 3.39Å; G212-N219 PolarHBondContact O-N 3.12Å; G212-F220 VanDerWaalsContact O-CB 3.27Å; G212-F220 WeakPolarHBondContact O-CB 3.32Å; G212-F220 PolarHBondContact O-N 3.28Å
213	L	94.8	Very high	94.9	Very high	15 Å²	15	46.4 Å²	46.4	8%	0.079	23%	0.233	C	C	.	.			trans	-81.1	-10	173.3	-60	-175.9	0	0	0	113.2	T210 F220 K285 Q288 M292	T210-L213 WeakPolarHBondContact O-CG 3.42Å; L213-F220 HydrophobicContact CD2-CB 4.35Å; L213-F220 HydrophobicContact CD2-CD1 3.77Å; L213-K285 HydrophobicContact CD1-CG 4.2Å; L213-Q288 HydrophobicContact CD1-CB 4.38Å; L213-Q288 HydrophobicContact CD2-CB 3.82Å; L213-M292 HydrophobicContact CD2-CB 4.38Å
214	E	92.4	Very high	94.8	Very high	88 Å²	88	46.4 Å²	46.4	41%	0.411	23%	0.233	S	C	.	.			trans	-69.2	131.6	-175.4	-52.2	78.9	-170.6	0	0	111.1	G212 D216 G217 N219	G212-E214 VanDerWaalsContact C-N 3.3Å; G212-E214 WeakPolarHBondContact CA-OE2 3.36Å; G212-E214 PolarHBondContact N-OE2 3.39Å; E214-D216 PolarHBondContact O-N 3.01Å; E214-G217 PolarHBondContact O-N 3.47Å; E214-N219 VanDerWaalsContact O-CA 3.29Å; E214-N219 WeakPolarHBondContact O-CA 3.31Å; E214-N219 PolarHBondContact O-N 3.35Å
215	V	90.8	Very high	94.8	Very high	106 Å²	106	48.8 Å²	48.8	64%	0.642	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-42.9	-180	-179.8	0	0	0	0	111.4	G217	V215-G217 PolarHBondContact O-N 3.13Å
216	D	87.6	Confident	94.8	Very high	170 Å²	170	49.3 Å²	49.3	91%	0.909	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.1	177	-57.8	-41	0	0	0	112.9	E214	E214-D216 PolarHBondContact O-N 3.01Å
217	G	88.2	Confident	94.8	Very high	35 Å²	35	50.2 Å²	50.2	36%	0.361	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-125.1	-176.5	0	0	0	0	0	112.9	E214 V215 N219	E214-G217 PolarHBondContact O-N 3.47Å; V215-G217 PolarHBondContact O-N 3.13Å; G217-N219 VanDerWaalsContact C-N 3.29Å
218	F	91.1	Very high	94.7	Very high	7 Å²	7	50.2 Å²	50.2	3%	0.031	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-27.3	177	179.3	-118.4	0	0	0	112.4	F220 R223 M292 Y296 P377 L379 H384	F218-F220 HydrophobicContact CD1-CB 3.78Å; F218-F220 HydrophobicContact CE1-CB 3.93Å; F218-F220 HydrophobicContact CE1-CD2 4.15Å; F218-F220 PolarHBondContact O-N 3.17Å; F218-R223 VanDerWaalsContact CE2-NH1 3.27Å; F218-R223 VanDerWaalsContact O-CD 3.23Å; F218-R223 WeakPolarHBondContact O-CD 3.23Å; F218-R223 PolarHBondContact O-NE 3.36Å; F218-R223 PolarHBondContact O-NH1 3.03Å; F218-M292 HydrophobicContact CD1-CE 3.83Å; F218-M292 HydrophobicContact CD1-SD 4.3Å; F218-M292 HydrophobicContact CE1-CE 3.87Å; F218-M292 HydrophobicContact CE1-SD 4.18Å; F218-Y296 HydrophobicContact CE1-CE2 4.17Å; F218-Y296 AromaticContact CE1-CZ 3.99Å; F218-Y296 WeakPolarHBondContact CZ-OH 3.37Å; F218-P377 HydrophobicContact CZ-CB 3.92Å; F218-L379 HydrophobicContact CD2-CD2 4.15Å; F218-L379 HydrophobicContact CE1-CD2 4.09Å; F218-L379 HydrophobicContact CE2-CD2 3.67Å; F218-L379 HydrophobicContact CZ-CD2 3.63Å; F218-H384 AromaticContact CD2-CD2 3.77Å; F218-H384 AromaticContact CD2-CE1 3.83Å; F218-H384 AromaticContact CD2-NE2 3.51Å
219	N	94.3	Very high	94.7	Very high	24 Å²	24	49.6 Å²	49.6	13%	0.128	25%	0.252	C	S	.	.			trans	48.5	57.2	-178.4	-168.2	2	0	0	0	112.3	G212 E214 G217 W221 E222 R223	G212-N219 PolarHBondContact O-N 3.12Å; E214-N219 VanDerWaalsContact O-CA 3.29Å; E214-N219 WeakPolarHBondContact O-CA 3.31Å; E214-N219 PolarHBondContact O-N 3.35Å; G217-N219 VanDerWaalsContact C-N 3.29Å; N219-W221 VanDerWaalsContact C-N 3.25Å; N219-W221 PolarHBondContact O-N 3.41Å; N219-E222 PolarHBondContact ND2-OE2 3.04Å; N219-E222 WeakPolarHBondContact OD1-CB 3.42Å; N219-R223 WeakPolarHBondContact O-CB 3.48Å; N219-R223 VanDerWaalsContact O-CG 3.32Å; N219-R223 WeakPolarHBondContact O-CG 3.32Å; N219-R223 PolarHBondContact O-N 2.78Å
220	F	95.6	Very high	94.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-52.1	-44.2	-178	165.8	-116.3	0	0	0	112.6	G212 L213 F218 L224 L291 M292 F295 Y296	G212-F220 VanDerWaalsContact O-CB 3.27Å; G212-F220 WeakPolarHBondContact O-CB 3.32Å; G212-F220 PolarHBondContact O-N 3.28Å; L213-F220 HydrophobicContact CD2-CB 4.35Å; L213-F220 HydrophobicContact CD2-CD1 3.77Å; F218-F220 HydrophobicContact CD1-CB 3.78Å; F218-F220 HydrophobicContact CE1-CB 3.93Å; F218-F220 HydrophobicContact CE1-CD2 4.15Å; F218-F220 PolarHBondContact O-N 3.17Å; F220-L224 HydrophobicContact CE1-CD2 4.26Å; F220-L224 HydrophobicContact CE2-CB 4.23Å; F220-L224 HydrophobicContact CE2-CD1 4.45Å; F220-L224 HydrophobicContact CE2-CD2 4.12Å; F220-L224 HydrophobicContact CE2-CG 4.5Å; F220-L224 HydrophobicContact CZ-CB 4.5Å; F220-L224 HydrophobicContact CZ-CD2 3.67Å; F220-L224 VanDerWaalsContact O-CB 3.25Å; F220-L224 WeakPolarHBondContact O-CB 3.5Å; F220-L224 PolarHBondContact O-N 3.07Å; F220-L291 HydrophobicContact CE1-CB 4.12Å; F220-L291 HydrophobicContact CZ-CB 4.16Å; F220-M292 HydrophobicContact CB-SD 3.67Å; F220-M292 HydrophobicContact CD1-CB 4.01Å; F220-M292 HydrophobicContact CD1-SD 3.98Å; F220-M292 HydrophobicContact CD2-SD 3.55Å; F220-M292 VanDerWaalsContact CD2-SD 3.55Å; F220-M292 HydrophobicContact CE1-CB 3.99Å; F220-M292 HydrophobicContact CE2-SD 4.15Å; F220-M292 HydrophobicContact CG-CB 4.44Å; F220-M292 HydrophobicContact CG-SD 3.44Å; F220-M292 WeakPolarHBondContact CG-SD 3.28Å; F220-M292 HydrophobicContact CZ-CB 4.41Å; F220-F295 HydrophobicContact CE2-CD2 4.01Å; F220-F295 AromaticContact CZ-CD2 3.75Å; F220-F295 HydrophobicContact CZ-CD2 3.75Å; F220-F295 HydrophobicContact CZ-CE2 4.21Å; F220-Y296 AromaticContact CD2-CE2 3.79Å; F220-Y296 HydrophobicContact CD2-CE2 3.79Å; F220-Y296 AromaticContact CE2-CE2 3.79Å; F220-Y296 HydrophobicContact CE2-CE2 3.79Å
221	W	97.1	Very high	94.8	Very high	27 Å²	27	49.7 Å²	49.7	10%	0.102	26%	0.261	C	S	.	.	H	α-helix	trans	-68.1	-50.4	-168.7	-161.1	-118.8	0	0	0	112.9	N219 R223 L224 E225 L265 F266 Y284 Q288 L291	N219-W221 VanDerWaalsContact C-N 3.25Å; N219-W221 PolarHBondContact O-N 3.41Å; W221-R223 PolarHBondContact O-N 3.42Å; W221-L224 HydrophobicContact CE3-CD2 4.32Å; W221-L224 HydrophobicContact CZ3-CD2 4.11Å; W221-L224 PolarHBondContact O-N 3.21Å; W221-E225 PolarHBondContact O-N 3.36Å; W221-L265 HydrophobicContact CH2-CD1 3.92Å; W221-L265 HydrophobicContact CH2-CD2 3.97Å; W221-L265 HydrophobicContact CH2-CG 3.72Å; W221-L265 HydrophobicContact CZ2-CD1 4.44Å; W221-L265 HydrophobicContact CZ2-CG 4.04Å; W221-F266 HydrophobicContact CD2-CD1 4.31Å; W221-F266 AromaticContact CD2-CE1 3.98Å; W221-F266 HydrophobicContact CD2-CE1 3.98Å; W221-F266 AromaticContact CE2-CD1 3.55Å; W221-F266 AromaticContact CE2-CE1 3.62Å; W221-F266 HydrophobicContact CE3-CE1 4.35Å; W221-F266 HydrophobicContact CH2-CD1 4.49Å; W221-F266 HydrophobicContact CH2-CE1 4.12Å; W221-F266 AromaticContact CZ2-CD1 3.66Å; W221-F266 HydrophobicContact CZ2-CD1 3.66Å; W221-F266 AromaticContact CZ2-CE1 3.7Å; W221-F266 HydrophobicContact CZ2-CE1 3.7Å; W221-F266 HydrophobicContact CZ3-CE1 4.43Å; W221-F266 AromaticContact NE1-CD1 3.55Å; W221-F266 AromaticContact NE1-CE1 3.99Å; W221-Y284 AromaticContact CE2-CZ 3.9Å; W221-Y284 HydrophobicContact CZ2-CE2 4.05Å; W221-Y284 AromaticContact CZ2-CZ 3.71Å; W221-Y284 VanDerWaalsContact CZ2-OH 3.24Å; W221-Y284 WeakPolarHBondContact CZ2-OH 3.47Å; W221-Y284 AromaticContact NE1-CE1 3.82Å; W221-Y284 AromaticContact NE1-CZ 3.65Å; W221-Y284 PolarHBondContact NE1-OH 3.04Å; W221-Q288 HydrophobicContact CD2-CB 4.36Å; W221-Q288 HydrophobicContact CD2-CG 3.55Å; W221-Q288 HydrophobicContact CE3-CB 3.9Å; W221-Q288 HydrophobicContact CE3-CG 3.51Å; W221-Q288 HydrophobicContact CG-CG 4.16Å; W221-Q288 HydrophobicContact CH2-CG 3.99Å; W221-Q288 HydrophobicContact CZ2-CG 4.04Å; W221-Q288 HydrophobicContact CZ3-CB 4.13Å; W221-Q288 HydrophobicContact CZ3-CG 3.74Å; W221-L291 HydrophobicContact CH2-CD1 3.96Å; W221-L291 HydrophobicContact CZ3-CD1 3.75Å
222	E	96.8	Very high	95	Very high	102 Å²	102	48.9 Å²	48.9	48%	0.477	26%	0.256	S	S	.	.	H	α-helix	trans	-65.1	-40.5	178.6	-171.4	178.6	174	0	0	111.2	N219 L224 E225 I226	N219-E222 PolarHBondContact ND2-OE2 3.04Å; N219-E222 WeakPolarHBondContact OD1-CB 3.42Å; E222-L224 VanDerWaalsContact C-N 3.33Å; E222-L224 PolarHBondContact O-N 2.7Å; E222-E225 PolarHBondContact O-N 2.71Å; E222-I226 HydrophobicContact CG-CD1 4.14Å; E222-I226 WeakPolarHBondContact O-CG1 3.16Å; E222-I226 PolarHBondContact O-N 2.9Å
223	R	96.6	Very high	95.2	Very high	95 Å²	95	51.1 Å²	51.1	36%	0.358	27%	0.266	S	S	.	.	H	α-helix	trans	-64.4	-38.4	176.6	-69.2	-179.7	179.8	-179.2	4.5	112.3	F218 N219 W221 N227 P377	F218-R223 VanDerWaalsContact CE2-NH1 3.27Å; F218-R223 VanDerWaalsContact O-CD 3.23Å; F218-R223 WeakPolarHBondContact O-CD 3.23Å; F218-R223 PolarHBondContact O-NE 3.36Å; F218-R223 PolarHBondContact O-NH1 3.03Å; N219-R223 WeakPolarHBondContact O-CB 3.48Å; N219-R223 VanDerWaalsContact O-CG 3.32Å; N219-R223 WeakPolarHBondContact O-CG 3.32Å; N219-R223 PolarHBondContact O-N 2.78Å; W221-R223 PolarHBondContact O-N 3.42Å; R223-N227 WeakPolarHBondContact O-CB 3.42Å; R223-N227 PolarHBondContact O-N 3.28Å; R223-N227 VanDerWaalsContact O-N 3.09Å; R223-N227 PolarHBondContact O-OD1 2.89Å; R223-P377 HydrophobicContact CB-CB 3.89Å; R223-P377 HydrophobicContact CB-CG 3.71Å
224	L	97.4	Very high	95.3	Very high	1 Å²	1	54 Å²	54	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-65.4	-45.1	176.2	-177.9	69	0	0	0	110.4	F220 W221 E222 N227 I228 F266 F295 P377	F220-L224 HydrophobicContact CE1-CD2 4.26Å; F220-L224 HydrophobicContact CE2-CB 4.23Å; F220-L224 HydrophobicContact CE2-CD1 4.45Å; F220-L224 HydrophobicContact CE2-CD2 4.12Å; F220-L224 HydrophobicContact CE2-CG 4.5Å; F220-L224 HydrophobicContact CZ-CB 4.5Å; F220-L224 HydrophobicContact CZ-CD2 3.67Å; F220-L224 VanDerWaalsContact O-CB 3.25Å; F220-L224 WeakPolarHBondContact O-CB 3.5Å; F220-L224 PolarHBondContact O-N 3.07Å; W221-L224 HydrophobicContact CE3-CD2 4.32Å; W221-L224 HydrophobicContact CZ3-CD2 4.11Å; W221-L224 PolarHBondContact O-N 3.21Å; E222-L224 VanDerWaalsContact C-N 3.33Å; E222-L224 PolarHBondContact O-N 2.7Å; L224-N227 PolarHBondContact O-N 2.93Å; L224-I228 HydrophobicContact CD1-CD1 3.93Å; L224-I228 HydrophobicContact CD1-CG1 4.22Å; L224-I228 HydrophobicContact CD2-CD1 4.32Å; L224-I228 HydrophobicContact CG-CD1 3.76Å; L224-I228 HydrophobicContact CG-CG1 4.35Å; L224-I228 WeakPolarHBondContact O-CB 3.39Å; L224-I228 VanDerWaalsContact O-CG1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.03Å; L224-I228 PolarHBondContact O-N 3.01Å; L224-F266 HydrophobicContact CD2-CZ 4.42Å; L224-F266 HydrophobicContact CG-CZ 4.35Å; L224-F295 HydrophobicContact CD1-CE2 4.12Å; L224-F295 HydrophobicContact CD2-CE2 4.05Å; L224-P377 HydrophobicContact CB-CG 4.17Å
225	E	97.9	Very high	95.5	Very high	70 Å²	70	52.5 Å²	52.5	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-56.1	-53.1	177.2	-173.1	171.5	-162.7	0	0	111.6	W221 E222 N227 I228 F229 F266	W221-E225 PolarHBondContact O-N 3.36Å; E222-E225 PolarHBondContact O-N 2.71Å; E225-N227 PolarHBondContact O-N 3.48Å; E225-I228 PolarHBondContact O-N 2.87Å; E225-F229 HydrophobicContact CG-CD2 3.75Å; E225-F229 HydrophobicContact CG-CE2 3.74Å; E225-F229 VanDerWaalsContact O-CD2 3.29Å; E225-F229 WeakPolarHBondContact O-CD2 3.49Å; E225-F229 PolarHBondContact O-N 3.47Å; E225-F266 VanDerWaalsContact CA-CZ 3.45Å; E225-F266 HydrophobicContact CB-CD1 3.8Å; E225-F266 HydrophobicContact CB-CD2 4.36Å; E225-F266 HydrophobicContact CB-CE1 3.55Å; E225-F266 HydrophobicContact CB-CE2 4.15Å; E225-F266 HydrophobicContact CB-CG 4.22Å; E225-F266 HydrophobicContact CB-CZ 3.75Å; E225-F266 HydrophobicContact CG-CB 4.49Å; E225-F266 HydrophobicContact CG-CD1 3.89Å; E225-F266 HydrophobicContact CG-CD2 3.87Å; E225-F266 HydrophobicContact CG-CE1 4.08Å; E225-F266 HydrophobicContact CG-CE2 4.06Å; E225-F266 HydrophobicContact CG-CG 3.81Å; E225-F266 HydrophobicContact CG-CZ 4.17Å
226	I	97.9	Very high	95.7	Very high	85 Å²	85	50.2 Å²	50.2	44%	0.436	26%	0.259	S	S	.	.	H	α-helix	trans	-55.6	-51.8	178.5	-68.1	166.1	0	0	0	110.4	E222 I228 F229 D230	E222-I226 HydrophobicContact CG-CD1 4.14Å; E222-I226 WeakPolarHBondContact O-CG1 3.16Å; E222-I226 PolarHBondContact O-N 2.9Å; I226-I228 VanDerWaalsContact C-N 3.32Å; I226-I228 PolarHBondContact O-N 3.39Å; I226-F229 PolarHBondContact O-N 3.42Å; I226-D230 WeakPolarHBondContact O-CB 3.45Å; I226-D230 PolarHBondContact O-N 2.92Å
227	N	97.9	Very high	96.2	Very high	51 Å²	51	48.1 Å²	48.1	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-36.4	-177	-73.2	1.3	0	0	0	113.1	R223 L224 E225 G231 W375	R223-N227 WeakPolarHBondContact O-CB 3.42Å; R223-N227 PolarHBondContact O-N 3.28Å; R223-N227 VanDerWaalsContact O-N 3.09Å; R223-N227 PolarHBondContact O-OD1 2.89Å; L224-N227 PolarHBondContact O-N 2.93Å; E225-N227 PolarHBondContact O-N 3.48Å; N227-G231 PolarHBondContact O-N 2.89Å; N227-W375 WeakPolarHBondContact CB-O 3.45Å; N227-W375 PolarHBondContact ND2-O 3.43Å
228	I	97.8	Very high	96.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-49.8	178	-72.7	177.8	0	0	0	110.1	L224 E225 I226 G231 L232 F262 F266 V371 W375	L224-I228 HydrophobicContact CD1-CD1 3.93Å; L224-I228 HydrophobicContact CD1-CG1 4.22Å; L224-I228 HydrophobicContact CD2-CD1 4.32Å; L224-I228 HydrophobicContact CG-CD1 3.76Å; L224-I228 HydrophobicContact CG-CG1 4.35Å; L224-I228 WeakPolarHBondContact O-CB 3.39Å; L224-I228 VanDerWaalsContact O-CG1 3.23Å; L224-I228 WeakPolarHBondContact O-CG1 3.03Å; L224-I228 PolarHBondContact O-N 3.01Å; E225-I228 PolarHBondContact O-N 2.87Å; I226-I228 VanDerWaalsContact C-N 3.32Å; I226-I228 PolarHBondContact O-N 3.39Å; I228-G231 PolarHBondContact O-N 3.5Å; I228-L232 HydrophobicContact CG2-CD1 3.93Å; I228-L232 HydrophobicContact CG2-CG 4.41Å; I228-L232 VanDerWaalsContact O-CG 3.3Å; I228-L232 WeakPolarHBondContact O-CG 3.33Å; I228-L232 PolarHBondContact O-N 3.42Å; I228-F262 HydrophobicContact CD1-CD1 3.82Å; I228-F262 HydrophobicContact CD1-CE1 3.86Å; I228-F262 HydrophobicContact CG2-CB 3.98Å; I228-F262 HydrophobicContact CG2-CD1 3.96Å; I228-F262 HydrophobicContact CG2-CD2 3.92Å; I228-F262 HydrophobicContact CG2-CE1 4.47Å; I228-F262 HydrophobicContact CG2-CE2 4.43Å; I228-F262 HydrophobicContact CG2-CG 3.68Å; I228-F266 HydrophobicContact CD1-CE2 4.13Å; I228-F266 HydrophobicContact CD1-CZ 4.01Å; I228-V371 HydrophobicContact CD1-CG1 3.79Å; I228-V371 HydrophobicContact CG1-CG1 3.92Å; I228-W375 HydrophobicContact CG1-CE3 4.35Å
229	F	97.9	Very high	96.7	Very high	44 Å²	44	52 Å²	52	19%	0.193	25%	0.25	C	C	.	.	H	α-helix	trans	-69.3	-34.9	-178.8	-75.6	-67.8	0	0	0	112.4	E225 I226 L232 N233 R259 F266	E225-F229 HydrophobicContact CG-CD2 3.75Å; E225-F229 HydrophobicContact CG-CE2 3.74Å; E225-F229 VanDerWaalsContact O-CD2 3.29Å; E225-F229 WeakPolarHBondContact O-CD2 3.49Å; E225-F229 PolarHBondContact O-N 3.47Å; I226-F229 PolarHBondContact O-N 3.42Å; F229-L232 HydrophobicContact CD1-CD1 4.17Å; F229-L232 HydrophobicContact CE1-CD1 4.46Å; F229-L232 PolarHBondContact O-N 3.17Å; F229-N233 WeakPolarHBondContact O-CB 3.29Å; F229-N233 PolarHBondContact O-N 3.26Å; F229-N233 PolarHBondContact O-ND2 3.38Å; F229-R259 HydrophobicContact CE1-CG 4.12Å; F229-F266 AromaticContact CE2-CD2 3.94Å; F229-F266 HydrophobicContact CE2-CD2 3.94Å; F229-F266 HydrophobicContact CE2-CE2 4.36Å; F229-F266 HydrophobicContact CZ-CD2 4.49Å
230	D	97.8	Very high	96.8	Very high	93 Å²	93	55.9 Å²	55.9	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-62.7	-44.2	170.5	-78.9	-13.6	0	0	0	111.7	I226 N233 V234	I226-D230 WeakPolarHBondContact O-CB 3.45Å; I226-D230 PolarHBondContact O-N 2.92Å; D230-N233 PolarHBondContact O-N 3.18Å; D230-V234 WeakPolarHBondContact O-CG2 3.48Å; D230-V234 PolarHBondContact O-N 2.85Å
231	G	96.8	Very high	96.8	Very high	8 Å²	8	64.3 Å²	64.3	8%	0.082	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-49.2	174.5	0	0	0	0	0	112.4	N227 I228 N233 V234 E235 W375	N227-G231 PolarHBondContact O-N 2.89Å; I228-G231 PolarHBondContact O-N 3.5Å; G231-N233 VanDerWaalsContact C-N 3.35Å; G231-N233 PolarHBondContact O-N 3.11Å; G231-V234 PolarHBondContact O-N 2.97Å; G231-V234 VanDerWaalsContact O-N 3.16Å; G231-E235 WeakPolarHBondContact O-CG 3.46Å; G231-E235 PolarHBondContact O-N 3.01Å; G231-W375 VanDerWaalsContact C-CH2 3.48Å; G231-W375 VanDerWaalsContact CA-CZ2 3.46Å
232	L	96.5	Very high	96.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-41	177	-70.5	171.3	0	0	0	112.1	I228 F229 V234 E235 E236 L255 Q258 R259 F262 W375	I228-L232 HydrophobicContact CG2-CD1 3.93Å; I228-L232 HydrophobicContact CG2-CG 4.41Å; I228-L232 VanDerWaalsContact O-CG 3.3Å; I228-L232 WeakPolarHBondContact O-CG 3.33Å; I228-L232 PolarHBondContact O-N 3.42Å; F229-L232 HydrophobicContact CD1-CD1 4.17Å; F229-L232 HydrophobicContact CE1-CD1 4.46Å; F229-L232 PolarHBondContact O-N 3.17Å; L232-V234 VanDerWaalsContact C-N 3.31Å; L232-V234 PolarHBondContact O-N 2.93Å; L232-E235 PolarHBondContact O-N 2.65Å; L232-E236 WeakPolarHBondContact O-CB 3.39Å; L232-E236 PolarHBondContact O-N 2.94Å; L232-L255 HydrophobicContact CD2-CD1 3.69Å; L232-Q258 HydrophobicContact CD2-CB 4.37Å; L232-R259 HydrophobicContact CD1-CB 4.23Å; L232-R259 HydrophobicContact CD1-CG 4.31Å; L232-F262 HydrophobicContact CD1-CD2 4.24Å; L232-W375 HydrophobicContact CD2-CH2 4.03Å; L232-W375 HydrophobicContact CD2-CZ3 4.17Å; L232-W375 HydrophobicContact CG-CH2 4.13Å; L232-W375 HydrophobicContact CG-CZ3 4.05Å
233	N	97.1	Very high	96.6	Very high	53 Å²	53	65.8 Å²	65.8	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-65.7	-33.5	176.1	-70.4	-29.6	0	0	0	112.3	F229 D230 G231 K237 R259	F229-N233 WeakPolarHBondContact O-CB 3.29Å; F229-N233 PolarHBondContact O-N 3.26Å; F229-N233 PolarHBondContact O-ND2 3.38Å; D230-N233 PolarHBondContact O-N 3.18Å; G231-N233 VanDerWaalsContact C-N 3.35Å; G231-N233 PolarHBondContact O-N 3.11Å; N233-K237 WeakPolarHBondContact O-CG 3.33Å; N233-K237 PolarHBondContact O-N 3Å; N233-R259 PolarHBondContact OD1-NH1 3.39Å; N233-R259 PolarHBondContact OD1-NH2 3.09Å
234	V	96.4	Very high	96.5	Very high	74 Å²	74	68.3 Å²	68.3	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-69.6	-43.1	174.5	168.4	0	0	0	0	111	D230 G231 L232 K237 K238	D230-V234 WeakPolarHBondContact O-CG2 3.48Å; D230-V234 PolarHBondContact O-N 2.85Å; G231-V234 PolarHBondContact O-N 2.97Å; G231-V234 VanDerWaalsContact O-N 3.16Å; L232-V234 VanDerWaalsContact C-N 3.31Å; L232-V234 PolarHBondContact O-N 2.93Å; V234-K237 PolarHBondContact O-N 3.4Å; V234-K238 WeakPolarHBondContact O-CG 3.5Å; V234-K238 PolarHBondContact O-N 2.95Å; V234-K238 VanDerWaalsContact O-N 3.14Å
235	E	95.6	Very high	96.4	Very high	58 Å²	58	70.3 Å²	70.3	27%	0.271	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-40.6	175.7	-66	-51.4	129	0	0	111.9	G231 L232 K237 K238 I239 L255 W375	G231-E235 WeakPolarHBondContact O-CG 3.46Å; G231-E235 PolarHBondContact O-N 3.01Å; L232-E235 PolarHBondContact O-N 2.65Å; E235-K237 PolarHBondContact O-N 3.42Å; E235-K238 WeakPolarHBondContact O-CB 3.4Å; E235-K238 PolarHBondContact O-N 3.3Å; E235-K238 VanDerWaalsContact O-N 3.08Å; E235-K238 IonicContact OE1-NZ 2.65Å; E235-K238 PolarHBondContact OE1-NZ 3.31Å; E235-K238 IonicContact OE2-NZ 3.48Å; E235-I239 WeakPolarHBondContact O-CG1 3.43Å; E235-I239 PolarHBondContact O-N 3.46Å; E235-L255 HydrophobicContact CB-CD1 3.98Å; E235-W375 HydrophobicContact CG-CH2 4.38Å; E235-W375 HydrophobicContact CG-CZ2 4.01Å
236	E	96.3	Very high	96.3	Very high	57 Å²	57	75 Å²	75	27%	0.266	37%	0.373	S	S	.	.	H	α-helix	trans	-54.4	-52.7	173.7	-168.7	168.2	-156	0	0	111.4	L232 K238 I239 E240 M252 L255 R259	L232-E236 WeakPolarHBondContact O-CB 3.39Å; L232-E236 PolarHBondContact O-N 2.94Å; E236-K238 PolarHBondContact O-N 3.45Å; E236-I239 PolarHBondContact O-N 2.94Å; E236-I239 VanDerWaalsContact O-N 3.1Å; E236-E240 WeakPolarHBondContact O-CG 3.48Å; E236-E240 PolarHBondContact O-N 2.93Å; E236-M252 HydrophobicContact CG-CE 4.45Å; E236-L255 VanDerWaalsContact CA-CD2 3.49Å; E236-L255 HydrophobicContact CB-CD2 3.59Å; E236-L255 HydrophobicContact CG-CD2 4.05Å; E236-R259 IonicContact OE2-CZ 2.94Å; E236-R259 IonicContact OE2-NH2 3.24Å; E236-R259 PolarHBondContact OE2-NH2 3.35Å
237	K	96.6	Very high	96.1	Very high	126 Å²	126	77 Å²	77	55%	0.548	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-26.2	177.8	-72.4	173.7	-176.4	173.4	0	113.6	N233 V234 E235 K241	N233-K237 WeakPolarHBondContact O-CG 3.33Å; N233-K237 PolarHBondContact O-N 3Å; V234-K237 PolarHBondContact O-N 3.4Å; E235-K237 PolarHBondContact O-N 3.42Å; K237-K241 WeakPolarHBondContact O-CD 3.28Å; K237-K241 VanDerWaalsContact O-CG 3.3Å; K237-K241 WeakPolarHBondContact O-CG 3.49Å
238	K	95.4	Very high	96	Very high	108 Å²	108	75.7 Å²	75.7	47%	0.47	37%	0.373	S	S	.	.	H	α-helix	trans	-74	-46	174.1	-72.5	171.9	-174.5	169.4	0	110.4	V234 E235 E236 K241	V234-K238 WeakPolarHBondContact O-CG 3.5Å; V234-K238 PolarHBondContact O-N 2.95Å; V234-K238 VanDerWaalsContact O-N 3.14Å; E235-K238 WeakPolarHBondContact O-CB 3.4Å; E235-K238 PolarHBondContact O-N 3.3Å; E235-K238 VanDerWaalsContact O-N 3.08Å; E235-K238 IonicContact OE1-NZ 2.65Å; E235-K238 PolarHBondContact OE1-NZ 3.31Å; E235-K238 IonicContact OE2-NZ 3.48Å; E236-K238 PolarHBondContact O-N 3.45Å; K238-K241 PolarHBondContact O-N 2.9Å
239	I	95.5	Very high	95.9	Very high	15 Å²	15	82.1 Å²	82.1	8%	0.077	40%	0.403	C	S	.	.	H	α-helix	trans	-66	-39.6	179.5	-62.5	163.4	0	0	0	110.6	E235 E236 K241 M242 K248 L251 M252 L255	E235-I239 WeakPolarHBondContact O-CG1 3.43Å; E235-I239 PolarHBondContact O-N 3.46Å; E236-I239 PolarHBondContact O-N 2.94Å; E236-I239 VanDerWaalsContact O-N 3.1Å; I239-K241 PolarHBondContact O-N 2.92Å; I239-M242 HydrophobicContact CB-SD 4.49Å; I239-M242 HydrophobicContact CG1-SD 4.47Å; I239-M242 HydrophobicContact CG2-SD 4.43Å; I239-M242 VanDerWaalsContact O-CB 3.27Å; I239-M242 WeakPolarHBondContact O-CB 3.49Å; I239-M242 PolarHBondContact O-N 3.29Å; I239-K248 HydrophobicContact CG2-CG 3.96Å; I239-K248 WeakPolarHBondContact O-CE 3.44Å; I239-L251 HydrophobicContact CD1-CB 3.97Å; I239-L251 HydrophobicContact CG1-CB 4.23Å; I239-L251 HydrophobicContact CG2-CB 4.17Å; I239-M252 HydrophobicContact CB-CE 4.16Å; I239-M252 HydrophobicContact CG2-CB 4.34Å; I239-M252 HydrophobicContact CG2-CE 3.8Å; I239-L255 HydrophobicContact CD1-CB 4.36Å; I239-L255 HydrophobicContact CD1-CD2 4.19Å
240	E	95	Very high	95.8	Very high	107 Å²	107	87.2 Å²	87.2	50%	0.5	43%	0.425	S	S	.	.	H	α-helix	trans	-57	-36.5	176.4	-76.8	179.1	159.1	0	0	113.1	E236 M242 K248 M252	E236-E240 WeakPolarHBondContact O-CG 3.48Å; E236-E240 PolarHBondContact O-N 2.93Å; E240-M242 VanDerWaalsContact C-N 3.27Å; E240-M242 PolarHBondContact O-N 3.44Å; E240-K248 PolarHBondContact O-NZ 3Å; E240-K248 VanDerWaalsContact O-NZ 3.09Å; E240-M252 HydrophobicContact CG-CE 4.13Å
241	K	96	Very high	95.7	Very high	177 Å²	177	85.5 Å²	85.5	77%	0.77	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.3	178.7	-69.4	173.4	-173.6	179.9	0	113.6	K237 K238 I239	K237-K241 WeakPolarHBondContact O-CD 3.28Å; K237-K241 VanDerWaalsContact O-CG 3.3Å; K237-K241 WeakPolarHBondContact O-CG 3.49Å; K238-K241 PolarHBondContact O-N 2.9Å; I239-K241 PolarHBondContact O-N 2.92Å
242	M	94.6	Very high	95.6	Very high	55 Å²	55	87.3 Å²	87.3	27%	0.271	42%	0.423	S	S	.	.	S	Bend	trans	-69.4	146.5	175.8	-63.8	175	64.8	0	0	110.1	I239 E240 K248 L251	I239-M242 HydrophobicContact CB-SD 4.49Å; I239-M242 HydrophobicContact CG1-SD 4.47Å; I239-M242 HydrophobicContact CG2-SD 4.43Å; I239-M242 VanDerWaalsContact O-CB 3.27Å; I239-M242 WeakPolarHBondContact O-CB 3.49Å; I239-M242 PolarHBondContact O-N 3.29Å; E240-M242 VanDerWaalsContact C-N 3.27Å; E240-M242 PolarHBondContact O-N 3.44Å; M242-K248 HydrophobicContact CB-CD 4.36Å; M242-K248 HydrophobicContact CB-CG 4.38Å; M242-K248 WeakPolarHBondContact O-CD 3.49Å; M242-K248 PolarHBondContact O-NZ 3.3Å; M242-L251 HydrophobicContact CE-CD1 3.81Å; M242-L251 HydrophobicContact SD-CD1 3.89Å
243	P	94.9	Very high	95.6	Very high	105 Å²	105	89.8 Å²	89.8	68%	0.682	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-60.5	149.1	172	27.6	-34.6	0	0	0	110.4	S245	P243-S245 PolarHBondContact O-N 3.37Å; P243-S245 VanDerWaalsContact O-N 3.15Å
244	E	94.8	Very high	95.5	Very high	147 Å²	147	91.9 Å²	91.9	69%	0.687	45%	0.451	S	S	*	.	S	Bend	trans	-56.8	119.6	176.5	-66.2	-55	143.3	0	0	110.5	K248	E244-K248 IonicContact OE1-NZ 2.99Å; E244-K248 PolarHBondContact OE1-NZ 2.89Å; E244-K248 IonicContact OE2-NZ 2.69Å
245	S	95.8	Very high	95.4	Very high	43 Å²	43	88.8 Å²	88.8	30%	0.301	43%	0.432	S	S	.	.			trans	-159.2	158.5	-177.2	69	0	0	0	0	110.5	P243 E247 K248 E249	P243-S245 PolarHBondContact O-N 3.37Å; P243-S245 VanDerWaalsContact O-N 3.15Å; S245-E247 PolarHBondContact O-N 3.02Å; S245-K248 WeakPolarHBondContact O-CB 3.36Å; S245-K248 PolarHBondContact O-N 3.28Å; S245-K248 VanDerWaalsContact O-N 3.08Å; S245-K248 PolarHBondContact OG-N 3.48Å; S245-K248 VanDerWaalsContact OG-N 3.13Å; S245-E249 PolarHBondContact O-N 3.45Å
246	E	95.6	Very high	95.4	Very high	168 Å²	168	89.5 Å²	89.5	79%	0.785	44%	0.44	S	S	*	.	H	α-helix	trans	-56.9	-32.7	172.4	-172.3	-178	173.9	0	0	111.7	E249 K250	E246-E249 PolarHBondContact O-N 2.84Å; E246-K250 WeakPolarHBondContact O-CB 3.38Å; E246-K250 PolarHBondContact O-N 3.19Å
247	E	94.6	Very high	95.3	Very high	127 Å²	127	92.9 Å²	92.9	59%	0.593	45%	0.454	S	S	*	.	H	α-helix	trans	-65.2	-43.1	175.7	-174	176.8	-172.2	0	0	111.9	S245 K250 L251	S245-E247 PolarHBondContact O-N 3.02Å; E247-K250 PolarHBondContact O-N 2.81Å; E247-L251 HydrophobicContact CG-CD1 4.09Å; E247-L251 HydrophobicContact CG-CG 4.48Å; E247-L251 WeakPolarHBondContact O-CB 3.32Å; E247-L251 VanDerWaalsContact O-CG 3.3Å; E247-L251 WeakPolarHBondContact O-CG 3.25Å; E247-L251 PolarHBondContact O-N 3.4Å
248	K	95.8	Very high	95.2	Very high	25 Å²	25	90.6 Å²	90.6	11%	0.109	45%	0.445	C	S	.	.	H	α-helix	trans	-60.3	-46.5	175.7	-178.1	-176	-177.8	171.4	0	111.3	I239 E240 M242 E244 S245 K250 L251 M252	I239-K248 HydrophobicContact CG2-CG 3.96Å; I239-K248 WeakPolarHBondContact O-CE 3.44Å; E240-K248 PolarHBondContact O-NZ 3Å; E240-K248 VanDerWaalsContact O-NZ 3.09Å; M242-K248 HydrophobicContact CB-CD 4.36Å; M242-K248 HydrophobicContact CB-CG 4.38Å; M242-K248 WeakPolarHBondContact O-CD 3.49Å; M242-K248 PolarHBondContact O-NZ 3.3Å; E244-K248 IonicContact OE1-NZ 2.99Å; E244-K248 PolarHBondContact OE1-NZ 2.89Å; E244-K248 IonicContact OE2-NZ 2.69Å; S245-K248 WeakPolarHBondContact O-CB 3.36Å; S245-K248 PolarHBondContact O-N 3.28Å; S245-K248 VanDerWaalsContact O-N 3.08Å; S245-K248 PolarHBondContact OG-N 3.48Å; S245-K248 VanDerWaalsContact OG-N 3.13Å; K248-K250 VanDerWaalsContact C-N 3.34Å; K248-K250 PolarHBondContact O-N 2.75Å; K248-L251 PolarHBondContact O-N 3.42Å; K248-M252 WeakPolarHBondContact O-CB 3.35Å; K248-M252 PolarHBondContact O-N 3.22Å
249	E	94.9	Very high	95.2	Very high	134 Å²	134	88.7 Å²	88.7	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-60	-44.3	177.9	-68.8	-176.9	175	0	0	111.7	S245 E246 M252 A253	S245-E249 PolarHBondContact O-N 3.45Å; E246-E249 PolarHBondContact O-N 2.84Å; E249-M252 PolarHBondContact O-N 3.44Å; E249-A253 WeakPolarHBondContact O-CB 3.42Å; E249-A253 PolarHBondContact O-N 3.38Å
250	K	96.7	Very high	95.1	Very high	151 Å²	151	94 Å²	94	66%	0.657	46%	0.459	S	S	*	.	H	α-helix	trans	-63	-47.7	177.9	-176.1	-177.1	174.6	-172.6	0	112.1	E246 E247 K248 M252 A253 E254	E246-K250 WeakPolarHBondContact O-CB 3.38Å; E246-K250 PolarHBondContact O-N 3.19Å; E247-K250 PolarHBondContact O-N 2.81Å; K248-K250 VanDerWaalsContact C-N 3.34Å; K248-K250 PolarHBondContact O-N 2.75Å; K250-M252 VanDerWaalsContact C-N 3.32Å; K250-M252 PolarHBondContact O-N 3.44Å; K250-A253 PolarHBondContact O-N 2.97Å; K250-E254 PolarHBondContact O-N 3.1Å
251	L	95.6	Very high	95	Very high	57 Å²	57	93.6 Å²	93.6	30%	0.298	46%	0.457	S	S	.	.	H	α-helix	trans	-62.4	-40.6	178.5	-71.8	172.4	0	0	0	111.4	I239 M242 E247 K248 E254 L255	I239-L251 HydrophobicContact CD1-CB 3.97Å; I239-L251 HydrophobicContact CG1-CB 4.23Å; I239-L251 HydrophobicContact CG2-CB 4.17Å; M242-L251 HydrophobicContact CE-CD1 3.81Å; M242-L251 HydrophobicContact SD-CD1 3.89Å; E247-L251 HydrophobicContact CG-CD1 4.09Å; E247-L251 HydrophobicContact CG-CG 4.48Å; E247-L251 WeakPolarHBondContact O-CB 3.32Å; E247-L251 VanDerWaalsContact O-CG 3.3Å; E247-L251 WeakPolarHBondContact O-CG 3.25Å; E247-L251 PolarHBondContact O-N 3.4Å; K248-L251 PolarHBondContact O-N 3.42Å; L251-E254 PolarHBondContact O-N 2.96Å; L251-L255 WeakPolarHBondContact O-CB 3.27Å; L251-L255 PolarHBondContact O-N 3.01Å
252	M	94.9	Very high	94.9	Very high	47 Å²	47	85.9 Å²	85.9	23%	0.232	42%	0.424	C	S	.	.	H	α-helix	trans	-64.9	-43.7	176.4	-170	58.8	74.9	0	0	111.6	E236 I239 E240 K248 E249 K250 E254 L255 V256	E236-M252 HydrophobicContact CG-CE 4.45Å; I239-M252 HydrophobicContact CB-CE 4.16Å; I239-M252 HydrophobicContact CG2-CB 4.34Å; I239-M252 HydrophobicContact CG2-CE 3.8Å; E240-M252 HydrophobicContact CG-CE 4.13Å; K248-M252 WeakPolarHBondContact O-CB 3.35Å; K248-M252 PolarHBondContact O-N 3.22Å; E249-M252 PolarHBondContact O-N 3.44Å; K250-M252 VanDerWaalsContact C-N 3.32Å; K250-M252 PolarHBondContact O-N 3.44Å; M252-E254 VanDerWaalsContact C-N 3.31Å; M252-E254 PolarHBondContact O-N 3.41Å; M252-L255 PolarHBondContact O-N 2.93Å; M252-L255 HydrophobicContact SD-CD2 4.41Å; M252-V256 WeakPolarHBondContact O-CG2 3.13Å; M252-V256 PolarHBondContact O-N 2.92Å
253	A	95.8	Very high	94.9	Very high	51 Å²	51	86.7 Å²	86.7	42%	0.421	43%	0.432	S	S	.	.	H	α-helix	trans	-63.3	-36.6	176	0	0	0	0	0	112.7	E249 K250 K257	E249-A253 WeakPolarHBondContact O-CB 3.42Å; E249-A253 PolarHBondContact O-N 3.38Å; K250-A253 PolarHBondContact O-N 2.97Å; A253-K257 WeakPolarHBondContact O-CG 3.31Å; A253-K257 PolarHBondContact O-N 2.91Å
254	E	95.1	Very high	94.8	Very high	97 Å²	97	82.1 Å²	82.1	45%	0.453	40%	0.402	S	S	.	.	H	α-helix	trans	-66.8	-43.1	173.9	-174.8	167.4	-179	0	0	111.7	K250 L251 M252 V256 K257 Q258	K250-E254 PolarHBondContact O-N 3.1Å; L251-E254 PolarHBondContact O-N 2.96Å; M252-E254 VanDerWaalsContact C-N 3.31Å; M252-E254 PolarHBondContact O-N 3.41Å; E254-V256 PolarHBondContact O-N 3.43Å; E254-K257 WeakPolarHBondContact O-CB 3.39Å; E254-K257 PolarHBondContact O-N 3.32Å; E254-Q258 WeakPolarHBondContact O-CG 3.16Å; E254-Q258 PolarHBondContact O-N 3.38Å
255	L	94.9	Very high	94.8	Very high	10 Å²	10	75.1 Å²	75.1	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-42.2	177.4	-169.7	75.3	0	0	0	112	L232 E235 E236 I239 L251 M252 K257 Q258 R259	L232-L255 HydrophobicContact CD2-CD1 3.69Å; E235-L255 HydrophobicContact CB-CD1 3.98Å; E236-L255 VanDerWaalsContact CA-CD2 3.49Å; E236-L255 HydrophobicContact CB-CD2 3.59Å; E236-L255 HydrophobicContact CG-CD2 4.05Å; I239-L255 HydrophobicContact CD1-CB 4.36Å; I239-L255 HydrophobicContact CD1-CD2 4.19Å; L251-L255 WeakPolarHBondContact O-CB 3.27Å; L251-L255 PolarHBondContact O-N 3.01Å; M252-L255 PolarHBondContact O-N 2.93Å; M252-L255 HydrophobicContact SD-CD2 4.41Å; L255-K257 VanDerWaalsContact C-N 3.34Å; L255-K257 PolarHBondContact O-N 3.39Å; L255-Q258 PolarHBondContact O-N 3.23Å; L255-R259 WeakPolarHBondContact O-CB 3.35Å; L255-R259 PolarHBondContact O-N 2.9Å
256	V	95.2	Very high	94.8	Very high	73 Å²	73	74.4 Å²	74.4	44%	0.442	36%	0.361	S	S	.	.	H	α-helix	trans	-59.1	-47	175.1	170.6	0	0	0	0	110.5	M252 E254 Q258 R259 E260	M252-V256 WeakPolarHBondContact O-CG2 3.13Å; M252-V256 PolarHBondContact O-N 2.92Å; E254-V256 PolarHBondContact O-N 3.43Å; V256-Q258 PolarHBondContact O-N 3.39Å; V256-R259 PolarHBondContact O-N 3.06Å; V256-E260 WeakPolarHBondContact O-CG 3.25Å; V256-E260 PolarHBondContact O-N 2.58Å
257	K	94.6	Very high	94.9	Very high	127 Å²	127	69.6 Å²	69.6	55%	0.552	34%	0.341	S	S	*	.	H	α-helix	trans	-60.8	-45.2	175.4	-72.3	175.3	-177.2	176.9	0	111.7	A253 E254 L255 R259 E260 H261	A253-K257 WeakPolarHBondContact O-CG 3.31Å; A253-K257 PolarHBondContact O-N 2.91Å; E254-K257 WeakPolarHBondContact O-CB 3.39Å; E254-K257 PolarHBondContact O-N 3.32Å; L255-K257 VanDerWaalsContact C-N 3.34Å; L255-K257 PolarHBondContact O-N 3.39Å; K257-R259 VanDerWaalsContact C-N 3.32Å; K257-R259 PolarHBondContact O-N 2.84Å; K257-E260 PolarHBondContact O-N 2.69Å; K257-H261 PolarHBondContact O-N 3.03Å; K257-H261 PolarHBondContact O-ND1 3.36Å
258	Q	93.9	Very high	95	Very high	78 Å²	78	68.7 Å²	68.7	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-44.1	177.8	-75.4	-176.7	-10.6	0	0	111.3	L232 E254 L255 V256 E260 H261 F262	L232-Q258 HydrophobicContact CD2-CB 4.37Å; E254-Q258 WeakPolarHBondContact O-CG 3.16Å; E254-Q258 PolarHBondContact O-N 3.38Å; L255-Q258 PolarHBondContact O-N 3.23Å; V256-Q258 PolarHBondContact O-N 3.39Å; Q258-E260 PolarHBondContact O-N 2.99Å; Q258-H261 PolarHBondContact O-N 3.02Å; Q258-F262 WeakPolarHBondContact O-CD2 3.44Å; Q258-F262 PolarHBondContact O-N 3.46Å
259	R	95.7	Very high	95.1	Very high	69 Å²	69	75.9 Å²	75.9	26%	0.26	37%	0.368	S	S	.	.	H	α-helix	trans	-58.8	-47	176.2	-170.6	178.4	-71.9	-125.9	2.6	111.4	F229 L232 N233 E236 L255 V256 K257 H261 F262 T263	F229-R259 HydrophobicContact CE1-CG 4.12Å; L232-R259 HydrophobicContact CD1-CB 4.23Å; L232-R259 HydrophobicContact CD1-CG 4.31Å; N233-R259 PolarHBondContact OD1-NH1 3.39Å; N233-R259 PolarHBondContact OD1-NH2 3.09Å; E236-R259 IonicContact OE2-CZ 2.94Å; E236-R259 IonicContact OE2-NH2 3.24Å; E236-R259 PolarHBondContact OE2-NH2 3.35Å; L255-R259 WeakPolarHBondContact O-CB 3.35Å; L255-R259 PolarHBondContact O-N 2.9Å; V256-R259 PolarHBondContact O-N 3.06Å; K257-R259 VanDerWaalsContact C-N 3.32Å; K257-R259 PolarHBondContact O-N 2.84Å; R259-H261 VanDerWaalsContact C-N 3.33Å; R259-H261 PolarHBondContact O-N 2.81Å; R259-F262 PolarHBondContact O-N 2.95Å; R259-T263 WeakPolarHBondContact O-CB 3.33Å; R259-T263 PolarHBondContact O-N 2.79Å; R259-T263 PolarHBondContact O-OG1 3.18Å
260	E	93.3	Very high	95.1	Very high	125 Å²	125	75.4 Å²	75.4	58%	0.584	36%	0.36	S	S	*	.	H	α-helix	trans	-59.6	-40.1	175.9	-71.8	178.5	174.4	0	0	113	V256 K257 Q258 S264	V256-E260 WeakPolarHBondContact O-CG 3.25Å; V256-E260 PolarHBondContact O-N 2.58Å; K257-E260 PolarHBondContact O-N 2.69Å; Q258-E260 PolarHBondContact O-N 2.99Å; E260-S264 WeakPolarHBondContact O-CB 3.17Å; E260-S264 PolarHBondContact O-N 3.18Å
261	H	91.7	Very high	95.2	Very high	100 Å²	100	68.3 Å²	68.3	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-42.9	176.6	-73.2	101.6	0	0	0	112.1	K257 Q258 R259 S264 L265	K257-H261 PolarHBondContact O-N 3.03Å; K257-H261 PolarHBondContact O-ND1 3.36Å; Q258-H261 PolarHBondContact O-N 3.02Å; R259-H261 VanDerWaalsContact C-N 3.33Å; R259-H261 PolarHBondContact O-N 2.81Å; H261-S264 WeakPolarHBondContact O-CB 3.31Å; H261-S264 PolarHBondContact O-N 3.48Å; H261-L265 PolarHBondContact O-N 2.88Å; H261-L265 VanDerWaalsContact O-N 3.16Å
262	F	94.8	Very high	95.3	Very high	14 Å²	14	69.6 Å²	69.6	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-72.3	-38.8	177.5	-75.1	-65.4	0	0	0	112.4	I228 L232 Q258 R259 S264 L265 F266 F369 V371	I228-F262 HydrophobicContact CD1-CD1 3.82Å; I228-F262 HydrophobicContact CD1-CE1 3.86Å; I228-F262 HydrophobicContact CG2-CB 3.98Å; I228-F262 HydrophobicContact CG2-CD1 3.96Å; I228-F262 HydrophobicContact CG2-CD2 3.92Å; I228-F262 HydrophobicContact CG2-CE1 4.47Å; I228-F262 HydrophobicContact CG2-CE2 4.43Å; I228-F262 HydrophobicContact CG2-CG 3.68Å; L232-F262 HydrophobicContact CD1-CD2 4.24Å; Q258-F262 WeakPolarHBondContact O-CD2 3.44Å; Q258-F262 PolarHBondContact O-N 3.46Å; R259-F262 PolarHBondContact O-N 2.95Å; F262-S264 PolarHBondContact O-N 2.64Å; F262-L265 HydrophobicContact CD1-CD2 4.21Å; F262-L265 WeakPolarHBondContact O-CA 3.35Å; F262-L265 VanDerWaalsContact O-CB 3.27Å; F262-L265 WeakPolarHBondContact O-CB 3.44Å; F262-L265 PolarHBondContact O-N 2.86Å; F262-F266 WeakPolarHBondContact O-CD2 3.3Å; F262-F266 PolarHBondContact O-N 2.98Å; F262-F369 HydrophobicContact CE1-CB 4.38Å; F262-V371 HydrophobicContact CE1-CG1 3.68Å; F262-V371 HydrophobicContact CE2-CG1 4.31Å; F262-V371 HydrophobicContact CZ-CG1 3.41Å; F262-V371 VanDerWaalsContact CZ-CG1 3.41Å
263	T	94.5	Very high	95.4	Very high	73 Å²	73	72 Å²	72	45%	0.448	35%	0.347	S	S	.	.	H	α-helix	trans	-55.9	-39.3	170	-57.8	0	0	0	0	111	R259 L265 F266 D267	R259-T263 WeakPolarHBondContact O-CB 3.33Å; R259-T263 PolarHBondContact O-N 2.79Å; R259-T263 PolarHBondContact O-OG1 3.18Å; T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 3.11Å; T263-F266 PolarHBondContact O-N 3.26Å; T263-D267 PolarHBondContact O-N 3.14Å
264	S	92.3	Very high	95.4	Very high	8 Å²	8	70.8 Å²	70.8	6%	0.056	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-23.8	173.7	-178.9	0	0	0	0	114.5	E260 H261 F262 R270	E260-S264 WeakPolarHBondContact O-CB 3.17Å; E260-S264 PolarHBondContact O-N 3.18Å; H261-S264 WeakPolarHBondContact O-CB 3.31Å; H261-S264 PolarHBondContact O-N 3.48Å; F262-S264 PolarHBondContact O-N 2.64Å; S264-R270 WeakPolarHBondContact OG-CD 3.23Å; S264-R270 PolarHBondContact OG-NE 3.01Å; S264-R270 PolarHBondContact OG-NH1 3.09Å
265	L	94.6	Very high	95.5	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-73.6	-39.2	176.2	179	66.6	0	0	0	110.6	W221 H261 F262 T263 D267 Y284 L287 L291 F369	W221-L265 HydrophobicContact CH2-CD1 3.92Å; W221-L265 HydrophobicContact CH2-CD2 3.97Å; W221-L265 HydrophobicContact CH2-CG 3.72Å; W221-L265 HydrophobicContact CZ2-CD1 4.44Å; W221-L265 HydrophobicContact CZ2-CG 4.04Å; H261-L265 PolarHBondContact O-N 2.88Å; H261-L265 VanDerWaalsContact O-N 3.16Å; F262-L265 HydrophobicContact CD1-CD2 4.21Å; F262-L265 WeakPolarHBondContact O-CA 3.35Å; F262-L265 VanDerWaalsContact O-CB 3.27Å; F262-L265 WeakPolarHBondContact O-CB 3.44Å; F262-L265 PolarHBondContact O-N 2.86Å; T263-L265 VanDerWaalsContact C-N 3.29Å; T263-L265 PolarHBondContact O-N 3.11Å; L265-D267 VanDerWaalsContact C-N 3.31Å; L265-Y284 VanDerWaalsContact O-CE2 3.26Å; L265-Y284 WeakPolarHBondContact O-CE2 3.39Å; L265-Y284 PolarHBondContact O-OH 3.32Å; L265-L287 HydrophobicContact CD1-CD2 4.29Å; L265-L291 HydrophobicContact CD1-CD1 4.32Å; L265-L291 HydrophobicContact CD2-CD1 4.36Å; L265-F369 HydrophobicContact CB-CD1 4.01Å; L265-F369 HydrophobicContact CB-CE1 3.98Å; L265-F369 HydrophobicContact CD1-CD1 3.83Å; L265-F369 HydrophobicContact CD1-CD2 3.84Å; L265-F369 HydrophobicContact CD1-CE1 3.87Å; L265-F369 HydrophobicContact CD1-CE2 3.89Å; L265-F369 HydrophobicContact CD1-CG 3.81Å; L265-F369 HydrophobicContact CD1-CZ 3.91Å; L265-F369 HydrophobicContact CD2-CB 3.98Å; L265-F369 HydrophobicContact CD2-CD1 3.87Å; L265-F369 HydrophobicContact CD2-CG 3.94Å; L265-F369 HydrophobicContact CG-CD1 4.12Å; L265-F369 HydrophobicContact CG-CE1 4.36Å; L265-F369 HydrophobicContact CG-CG 4.37Å
266	F	96.8	Very high	95.5	Very high	27 Å²	27	72.2 Å²	72.2	12%	0.118	35%	0.353	C	S	.	.	H	α-helix	trans	-85.2	-0.5	-178.6	-61.6	-70	0	0	0	113.9	W221 L224 E225 I228 F229 F262 T263 Y284	W221-F266 HydrophobicContact CD2-CD1 4.31Å; W221-F266 AromaticContact CD2-CE1 3.98Å; W221-F266 HydrophobicContact CD2-CE1 3.98Å; W221-F266 AromaticContact CE2-CD1 3.55Å; W221-F266 AromaticContact CE2-CE1 3.62Å; W221-F266 HydrophobicContact CE3-CE1 4.35Å; W221-F266 HydrophobicContact CH2-CD1 4.49Å; W221-F266 HydrophobicContact CH2-CE1 4.12Å; W221-F266 AromaticContact CZ2-CD1 3.66Å; W221-F266 HydrophobicContact CZ2-CD1 3.66Å; W221-F266 AromaticContact CZ2-CE1 3.7Å; W221-F266 HydrophobicContact CZ2-CE1 3.7Å; W221-F266 HydrophobicContact CZ3-CE1 4.43Å; W221-F266 AromaticContact NE1-CD1 3.55Å; W221-F266 AromaticContact NE1-CE1 3.99Å; L224-F266 HydrophobicContact CD2-CZ 4.42Å; L224-F266 HydrophobicContact CG-CZ 4.35Å; E225-F266 VanDerWaalsContact CA-CZ 3.45Å; E225-F266 HydrophobicContact CB-CD1 3.8Å; E225-F266 HydrophobicContact CB-CD2 4.36Å; E225-F266 HydrophobicContact CB-CE1 3.55Å; E225-F266 HydrophobicContact CB-CE2 4.15Å; E225-F266 HydrophobicContact CB-CG 4.22Å; E225-F266 HydrophobicContact CB-CZ 3.75Å; E225-F266 HydrophobicContact CG-CB 4.49Å; E225-F266 HydrophobicContact CG-CD1 3.89Å; E225-F266 HydrophobicContact CG-CD2 3.87Å; E225-F266 HydrophobicContact CG-CE1 4.08Å; E225-F266 HydrophobicContact CG-CE2 4.06Å; E225-F266 HydrophobicContact CG-CG 3.81Å; E225-F266 HydrophobicContact CG-CZ 4.17Å; I228-F266 HydrophobicContact CD1-CE2 4.13Å; I228-F266 HydrophobicContact CD1-CZ 4.01Å; F229-F266 AromaticContact CE2-CD2 3.94Å; F229-F266 HydrophobicContact CE2-CD2 3.94Å; F229-F266 HydrophobicContact CE2-CE2 4.36Å; F229-F266 HydrophobicContact CZ-CD2 4.49Å; F262-F266 WeakPolarHBondContact O-CD2 3.3Å; F262-F266 PolarHBondContact O-N 2.98Å; T263-F266 PolarHBondContact O-N 3.26Å; F266-Y284 VanDerWaalsContact CA-OH 3.26Å; F266-Y284 WeakPolarHBondContact CA-OH 3.33Å; F266-Y284 PolarHBondContact O-OH 3.13Å
267	D	96.8	Very high	95.4	Very high	67 Å²	67	74.2 Å²	74.2	36%	0.358	36%	0.356	S	S	.	.			trans	-93.1	97.7	173.7	-176	-11.3	0	0	0	111.7	T263 L265 K269 R270 H271	T263-D267 PolarHBondContact O-N 3.14Å; L265-D267 VanDerWaalsContact C-N 3.31Å; D267-K269 VanDerWaalsContact C-N 3.34Å; D267-K269 PolarHBondContact O-N 2.88Å; D267-K269 WeakPolarHBondContact OD1-CB 3.36Å; D267-K269 PolarHBondContact OD1-N 3.32Å; D267-R270 HydrophobicContact CB-CB 3.92Å; D267-R270 VanDerWaalsContact CG-CB 3.44Å; D267-R270 PolarHBondContact O-N 2.99Å; D267-R270 PolarHBondContact OD1-N 2.92Å; D267-R270 WeakPolarHBondContact OD2-CB 3.42Å; D267-H271 PolarHBondContact O-N 3.44Å
268	E	97.3	Very high	95.4	Very high	108 Å²	108	68.6 Å²	68.6	51%	0.505	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-37.7	177.3	-175.1	170.7	-151	0	0	112.7	R270 H271 D272 Y284	E268-R270 VanDerWaalsContact C-N 3.33Å; E268-R270 PolarHBondContact O-N 3.37Å; E268-H271 WeakPolarHBondContact O-CA 3.41Å; E268-H271 VanDerWaalsContact O-CB 3.3Å; E268-H271 WeakPolarHBondContact O-CB 3.18Å; E268-H271 PolarHBondContact O-N 3.25Å; E268-H271 VanDerWaalsContact O-N 3.12Å; E268-D272 PolarHBondContact O-N 2.83Å; E268-Y284 HydrophobicContact CB-CD1 3.89Å; E268-Y284 HydrophobicContact CB-CE1 3.84Å; E268-Y284 HydrophobicContact CB-CG 4.35Å; E268-Y284 HydrophobicContact CG-CD1 3.63Å; E268-Y284 HydrophobicContact CG-CE1 4.12Å; E268-Y284 HydrophobicContact CG-CG 3.95Å
269	K	97.3	Very high	95.4	Very high	177 Å²	177	70 Å²	70	77%	0.77	34%	0.34	S	S	*	.	H	α-helix	trans	-66.2	-39.5	179.4	-66.4	-178.3	-179.7	176.4	0	111.3	D267 H271 D272 H273	D267-K269 VanDerWaalsContact C-N 3.34Å; D267-K269 PolarHBondContact O-N 2.88Å; D267-K269 WeakPolarHBondContact OD1-CB 3.36Å; D267-K269 PolarHBondContact OD1-N 3.32Å; K269-H271 VanDerWaalsContact C-N 3.32Å; K269-D272 PolarHBondContact O-N 3.02Å; K269-H273 PolarHBondContact O-N 2.89Å
270	R	96.1	Very high	95.5	Very high	124 Å²	124	67.8 Å²	67.8	47%	0.468	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-37.8	173.8	-178.3	168.2	176.8	-178.4	-6.1	111.1	S264 D267 E268 H273 L274	S264-R270 WeakPolarHBondContact OG-CD 3.23Å; S264-R270 PolarHBondContact OG-NE 3.01Å; S264-R270 PolarHBondContact OG-NH1 3.09Å; D267-R270 HydrophobicContact CB-CB 3.92Å; D267-R270 VanDerWaalsContact CG-CB 3.44Å; D267-R270 PolarHBondContact O-N 2.99Å; D267-R270 PolarHBondContact OD1-N 2.92Å; D267-R270 WeakPolarHBondContact OD2-CB 3.42Å; E268-R270 VanDerWaalsContact C-N 3.33Å; E268-R270 PolarHBondContact O-N 3.37Å; R270-H273 PolarHBondContact O-N 3.3Å; R270-L274 WeakPolarHBondContact O-CG 3.47Å; R270-L274 PolarHBondContact O-N 2.97Å; R270-L274 VanDerWaalsContact O-N 3.12Å
271	H	97.6	Very high	95.7	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-58.2	-52.4	172.8	175.9	88.3	0	0	0	111.6	D267 E268 K269 H273 L274 V275 R280 L282 S283 Y284	D267-H271 PolarHBondContact O-N 3.44Å; E268-H271 WeakPolarHBondContact O-CA 3.41Å; E268-H271 VanDerWaalsContact O-CB 3.3Å; E268-H271 WeakPolarHBondContact O-CB 3.18Å; E268-H271 PolarHBondContact O-N 3.25Å; E268-H271 VanDerWaalsContact O-N 3.12Å; K269-H271 VanDerWaalsContact C-N 3.32Å; H271-H273 VanDerWaalsContact C-N 3.27Å; H271-H273 PolarHBondContact O-N 3.47Å; H271-L274 WeakPolarHBondContact O-CA 3.22Å; H271-L274 WeakPolarHBondContact O-CB 3.32Å; H271-L274 PolarHBondContact O-N 3.17Å; H271-V275 WeakPolarHBondContact NE2-CG2 3.34Å; H271-V275 PolarHBondContact O-N 3.35Å; H271-R280 VanDerWaalsContact ND1-CD 3.34Å; H271-R280 WeakPolarHBondContact ND1-CD 3.39Å; H271-R280 PolarHBondContact ND1-NH1 2.91Å; H271-L282 PolarHBondContact CE1-O 3.07Å; H271-L282 VanDerWaalsContact CE1-O 3.24Å; H271-L282 PolarHBondContact NE2-O 2.89Å; H271-S283 VanDerWaalsContact NE2-C 3.31Å; H271-Y284 HydrophobicContact CB-CD2 3.72Å; H271-Y284 HydrophobicContact CB-CE2 4.19Å; H271-Y284 AromaticContact CD2-CD2 3.9Å; H271-Y284 AromaticContact CG-CD2 3.53Å; H271-Y284 AromaticContact ND1-CD2 3.84Å; H271-Y284 WeakPolarHBondContact NE2-CA 3.42Å; H271-Y284 PolarHBondContact NE2-N 3.17Å
272	D	97.4	Very high	96	Very high	85 Å²	85	57.9 Å²	57.9	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-38.7	-180	-69.3	-16.6	0	0	0	112.2	E268 K269 L274 V275 S276	E268-D272 PolarHBondContact O-N 2.83Å; K269-D272 PolarHBondContact O-N 3.02Å; D272-L274 VanDerWaalsContact C-N 3.35Å; D272-L274 PolarHBondContact O-N 3.32Å; D272-V275 PolarHBondContact O-N 3.21Å; D272-S276 PolarHBondContact O-N 2.94Å
273	H	97.3	Very high	96.2	Very high	97 Å²	97	58.4 Å²	58.4	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-43.1	173.6	-177.9	64	0	0	0	112.3	K269 R270 H271 S276 K277	K269-H273 PolarHBondContact O-N 2.89Å; R270-H273 PolarHBondContact O-N 3.3Å; H271-H273 VanDerWaalsContact C-N 3.27Å; H271-H273 PolarHBondContact O-N 3.47Å; H273-S276 PolarHBondContact O-N 3.37Å; H273-S276 PolarHBondContact O-OG 2.99Å; H273-K277 VanDerWaalsContact NE2-CE 3.33Å; H273-K277 WeakPolarHBondContact NE2-CE 3.3Å; H273-K277 PolarHBondContact NE2-NZ 3.21Å; H273-K277 PolarHBondContact O-N 3.11Å
274	L	96.5	Very high	96.4	Very high	26 Å²	26	55.7 Å²	55.7	14%	0.136	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-34.9	176.9	-65.7	172.2	0	0	0	112.2	R270 H271 D272 K277 G278 E279 R280	R270-L274 WeakPolarHBondContact O-CG 3.47Å; R270-L274 PolarHBondContact O-N 2.97Å; R270-L274 VanDerWaalsContact O-N 3.12Å; H271-L274 WeakPolarHBondContact O-CA 3.22Å; H271-L274 WeakPolarHBondContact O-CB 3.32Å; H271-L274 PolarHBondContact O-N 3.17Å; D272-L274 VanDerWaalsContact C-N 3.35Å; D272-L274 PolarHBondContact O-N 3.32Å; L274-K277 PolarHBondContact O-N 2.71Å; L274-G278 PolarHBondContact O-N 3.12Å; L274-E279 HydrophobicContact CB-CB 4.3Å; L274-E279 HydrophobicContact CD2-CB 4.16Å; L274-E279 VanDerWaalsContact CD2-OE2 3.26Å; L274-E279 WeakPolarHBondContact CD2-OE2 3.26Å; L274-E279 PolarHBondContact O-N 2.93Å; L274-R280 HydrophobicContact CB-CB 4.36Å; L274-R280 HydrophobicContact CB-CG 3.93Å; L274-R280 HydrophobicContact CD1-CG 4.47Å; L274-R280 PolarHBondContact O-N 3.41Å; L274-R280 VanDerWaalsContact O-N 3.13Å
275	V	96.6	Very high	96.6	Very high	47 Å²	47	60.2 Å²	60.2	29%	0.285	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-45.5	172	174.7	0	0	0	0	110.2	H271 D272 K277 G278 R280	H271-V275 WeakPolarHBondContact NE2-CG2 3.34Å; H271-V275 PolarHBondContact O-N 3.35Å; D272-V275 PolarHBondContact O-N 3.21Å; V275-K277 PolarHBondContact O-N 3.12Å; V275-G278 PolarHBondContact O-N 3Å; V275-R280 HydrophobicContact CG2-CB 3.76Å
276	S	94.8	Very high	96.8	Very high	89 Å²	89	60.2 Å²	60.2	62%	0.622	29%	0.291	S	S	*	.	H	α-helix	trans	-60.3	-29.9	179.8	82.1	0	0	0	0	113.6	D272 H273	D272-S276 PolarHBondContact O-N 2.94Å; H273-S276 PolarHBondContact O-N 3.37Å; H273-S276 PolarHBondContact O-OG 2.99Å
277	K	94.3	Very high	96.9	Very high	116 Å²	116	59 Å²	59	50%	0.504	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.7	175.8	-72.9	-175.7	172	-177.5	0	114	H273 L274 V275 E279	H273-K277 VanDerWaalsContact NE2-CE 3.33Å; H273-K277 WeakPolarHBondContact NE2-CE 3.3Å; H273-K277 PolarHBondContact NE2-NZ 3.21Å; H273-K277 PolarHBondContact O-N 3.11Å; L274-K277 PolarHBondContact O-N 2.71Å; V275-K277 PolarHBondContact O-N 3.12Å; K277-E279 VanDerWaalsContact C-N 3.32Å; K277-E279 HydrophobicContact CB-CG 4.15Å; K277-E279 WeakPolarHBondContact CD-OE1 3.21Å
278	G	93.1	Very high	97	Very high	9 Å²	9	56.9 Å²	56.9	9%	0.093	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	33.9	-169.2	0	0	0	0	0	112.6	L274 V275 R281	L274-G278 PolarHBondContact O-N 3.12Å; V275-G278 PolarHBondContact O-N 3Å; G278-R281 VanDerWaalsContact O-CZ 3.23Å; G278-R281 PolarHBondContact O-NH1 3.26Å; G278-R281 PolarHBondContact O-NH2 3.02Å; G278-R281 VanDerWaalsContact O-NH2 3.13Å
279	E	94.9	Very high	97	Very high	107 Å²	107	51.8 Å²	51.8	50%	0.5	25%	0.25	S	C	.	.	S	Bend	trans	-90.9	-29.2	166	-67.5	179.9	-144.1	0	0	111.2	L274 K277	L274-E279 HydrophobicContact CB-CB 4.3Å; L274-E279 HydrophobicContact CD2-CB 4.16Å; L274-E279 VanDerWaalsContact CD2-OE2 3.26Å; L274-E279 WeakPolarHBondContact CD2-OE2 3.26Å; L274-E279 PolarHBondContact O-N 2.93Å; K277-E279 VanDerWaalsContact C-N 3.32Å; K277-E279 HydrophobicContact CB-CG 4.15Å; K277-E279 WeakPolarHBondContact CD-OE1 3.21Å
280	R	96.9	Very high	97.1	Very high	23 Å²	23	43.3 Å²	43.3	9%	0.087	21%	0.213	C	C	.	.			trans	-114.9	166.9	164.3	-65.4	-170.2	-172.7	-175.1	15.3	110.6	H271 L274 V275 L287 D362	H271-R280 VanDerWaalsContact ND1-CD 3.34Å; H271-R280 WeakPolarHBondContact ND1-CD 3.39Å; H271-R280 PolarHBondContact ND1-NH1 2.91Å; L274-R280 HydrophobicContact CB-CB 4.36Å; L274-R280 HydrophobicContact CB-CG 3.93Å; L274-R280 HydrophobicContact CD1-CG 4.47Å; L274-R280 PolarHBondContact O-N 3.41Å; L274-R280 VanDerWaalsContact O-N 3.13Å; V275-R280 HydrophobicContact CG2-CB 3.76Å; R280-L287 VanDerWaalsContact NH1-CD2 3.27Å; R280-D362 VanDerWaalsContact CA-OD1 3.29Å; R280-D362 WeakPolarHBondContact CA-OD1 3.45Å; R280-D362 VanDerWaalsContact CB-OD1 3.28Å; R280-D362 WeakPolarHBondContact CB-OD1 3.49Å; R280-D362 VanDerWaalsContact CG-OD1 3.31Å; R280-D362 WeakPolarHBondContact CG-OD1 3.48Å
281	R	97.6	Very high	97.2	Very high	15 Å²	15	37.4 Å²	37.4	6%	0.057	19%	0.191	C	C	.	.			trans	-127.6	-45.6	-177.9	-58.3	-69.5	178.2	-72.4	-6.4	112.2	L169 L200 G278 V359 V361 D362	L169-R281 VanDerWaalsContact CD1-CZ 3.42Å; L169-R281 VanDerWaalsContact CD1-NE 3.35Å; L169-R281 VanDerWaalsContact CD1-NH2 3.29Å; L200-R281 HydrophobicContact CD1-CB 4.29Å; L200-R281 HydrophobicContact CD2-CB 4.01Å; G278-R281 VanDerWaalsContact O-CZ 3.23Å; G278-R281 PolarHBondContact O-NH1 3.26Å; G278-R281 PolarHBondContact O-NH2 3.02Å; G278-R281 VanDerWaalsContact O-NH2 3.13Å; R281-V359 WeakPolarHBondContact CG-O 3.38Å; R281-V361 HydrophobicContact CG-CG1 3.83Å; R281-D362 VanDerWaalsContact CA-OD2 3.31Å; R281-D362 WeakPolarHBondContact CA-OD2 3.42Å; R281-D362 WeakPolarHBondContact CB-OD2 3.35Å; R281-D362 PolarHBondContact N-OD2 3.48Å
282	L	98.4	Very high	97.2	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.191	C	C	.	.	S	Bend	trans	-75.5	145.8	180	-65.2	177.4	0	0	0	111	L200 E204 L207 H271 A286 D362 L363	L200-L282 HydrophobicContact CD1-CD2 3.74Å; E204-L282 HydrophobicContact CB-CD2 3.96Å; E204-L282 HydrophobicContact CG-CD2 4.42Å; L207-L282 HydrophobicContact CD1-CD1 4.08Å; L207-L282 HydrophobicContact CD1-CD2 4.38Å; H271-L282 PolarHBondContact CE1-O 3.07Å; H271-L282 VanDerWaalsContact CE1-O 3.24Å; H271-L282 PolarHBondContact NE2-O 2.89Å; L282-A286 HydrophobicContact CB-CB 4.13Å; L282-A286 HydrophobicContact CD2-CB 4.37Å; L282-D362 HydrophobicContact CD1-CB 3.94Å; L282-D362 HydrophobicContact CG-CB 4.22Å; L282-D362 PolarHBondContact N-OD2 3.1Å; L282-L363 HydrophobicContact CD1-CD2 4.17Å
283	S	98.6	Very high	97.2	Very high	26 Å²	26	33.4 Å²	33.4	18%	0.182	17%	0.169	C	C	.	.			trans	-57.5	160.1	166.6	80.8	0	0	0	0	112.4	E204 E208 H271 K285 A286 L287	E204-S283 PolarHBondContact OE1-N 2.96Å; E208-S283 VanDerWaalsContact OE1-CB 3.31Å; E208-S283 WeakPolarHBondContact OE1-CB 3.45Å; E208-S283 PolarHBondContact OE1-OG 3.01Å; H271-S283 VanDerWaalsContact NE2-C 3.31Å; S283-K285 VanDerWaalsContact C-N 3.31Å; S283-K285 PolarHBondContact O-N 2.66Å; S283-A286 PolarHBondContact O-N 3.27Å; S283-A286 WeakPolarHBondContact OG-CB 3.43Å; S283-A286 PolarHBondContact OG-N 2.92Å; S283-A286 VanDerWaalsContact OG-N 3.13Å; S283-L287 PolarHBondContact O-N 2.86Å
284	Y	98.4	Very high	97.2	Very high	16 Å²	16	30.1 Å²	30.1	6%	0.063	15%	0.153	C	C	.	.	H	α-helix	trans	-59.1	-46.2	-178.4	-170	-126.5	0	0	0	111.1	W221 L265 F266 E268 H271 A286 L287 Q288	W221-Y284 AromaticContact CE2-CZ 3.9Å; W221-Y284 HydrophobicContact CZ2-CE2 4.05Å; W221-Y284 AromaticContact CZ2-CZ 3.71Å; W221-Y284 VanDerWaalsContact CZ2-OH 3.24Å; W221-Y284 WeakPolarHBondContact CZ2-OH 3.47Å; W221-Y284 AromaticContact NE1-CE1 3.82Å; W221-Y284 AromaticContact NE1-CZ 3.65Å; W221-Y284 PolarHBondContact NE1-OH 3.04Å; L265-Y284 VanDerWaalsContact O-CE2 3.26Å; L265-Y284 WeakPolarHBondContact O-CE2 3.39Å; L265-Y284 PolarHBondContact O-OH 3.32Å; F266-Y284 VanDerWaalsContact CA-OH 3.26Å; F266-Y284 WeakPolarHBondContact CA-OH 3.33Å; F266-Y284 PolarHBondContact O-OH 3.13Å; E268-Y284 HydrophobicContact CB-CD1 3.89Å; E268-Y284 HydrophobicContact CB-CE1 3.84Å; E268-Y284 HydrophobicContact CB-CG 4.35Å; E268-Y284 HydrophobicContact CG-CD1 3.63Å; E268-Y284 HydrophobicContact CG-CE1 4.12Å; E268-Y284 HydrophobicContact CG-CG 3.95Å; H271-Y284 HydrophobicContact CB-CD2 3.72Å; H271-Y284 HydrophobicContact CB-CE2 4.19Å; H271-Y284 AromaticContact CD2-CD2 3.9Å; H271-Y284 AromaticContact CG-CD2 3.53Å; H271-Y284 AromaticContact ND1-CD2 3.84Å; H271-Y284 WeakPolarHBondContact NE2-CA 3.42Å; H271-Y284 PolarHBondContact NE2-N 3.17Å; Y284-A286 PolarHBondContact O-N 3.33Å; Y284-L287 WeakPolarHBondContact O-CB 3.36Å; Y284-L287 PolarHBondContact O-N 2.86Å; Y284-Q288 VanDerWaalsContact CD1-NE2 3.29Å; Y284-Q288 WeakPolarHBondContact O-CG 3.37Å; Y284-Q288 PolarHBondContact O-N 3.28Å; Y284-Q288 VanDerWaalsContact O-N 3.13Å
285	K	98.4	Very high	97.2	Very high	103 Å²	103	29.6 Å²	29.6	45%	0.448	15%	0.15	S	C	.	.	H	α-helix	trans	-67.1	-36.5	179.1	-168.1	179.6	-172.8	-169.4	0	112.8	E208 L213 S283 L287 Q288 G289	E208-K285 HydrophobicContact CB-CD 4.19Å; E208-K285 HydrophobicContact CB-CG 4.35Å; E208-K285 HydrophobicContact CG-CB 4.11Å; E208-K285 HydrophobicContact CG-CD 4.44Å; E208-K285 HydrophobicContact CG-CG 4.34Å; E208-K285 WeakPolarHBondContact O-CE 3.45Å; E208-K285 PolarHBondContact O-NZ 3.33Å; L213-K285 HydrophobicContact CD1-CG 4.2Å; S283-K285 VanDerWaalsContact C-N 3.31Å; S283-K285 PolarHBondContact O-N 2.66Å; K285-L287 VanDerWaalsContact C-N 3.33Å; K285-L287 PolarHBondContact O-N 3Å; K285-Q288 WeakPolarHBondContact O-CB 3.48Å; K285-Q288 PolarHBondContact O-N 3.3Å; K285-G289 PolarHBondContact O-N 3.37Å
286	A	98.7	Very high	97.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-38.2	173.5	0	0	0	0	0	112.1	E204 L207 E208 L282 S283 Y284 Q288 G289 A290	E204-A286 HydrophobicContact CB-CB 4.35Å; E204-A286 HydrophobicContact CG-CB 3.71Å; L207-A286 HydrophobicContact CB-CB 3.81Å; L207-A286 HydrophobicContact CD1-CB 4.31Å; E208-A286 HydrophobicContact CG-CB 4.02Å; L282-A286 HydrophobicContact CB-CB 4.13Å; L282-A286 HydrophobicContact CD2-CB 4.37Å; S283-A286 PolarHBondContact O-N 3.27Å; S283-A286 WeakPolarHBondContact OG-CB 3.43Å; S283-A286 PolarHBondContact OG-N 2.92Å; S283-A286 VanDerWaalsContact OG-N 3.13Å; Y284-A286 PolarHBondContact O-N 3.33Å; A286-Q288 VanDerWaalsContact C-N 3.32Å; A286-Q288 PolarHBondContact O-N 3.17Å; A286-G289 PolarHBondContact O-N 3.36Å; A286-A290 PolarHBondContact O-N 3.31Å
287	L	98.4	Very high	97.3	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.3	-166.7	75.7	0	0	0	111.7	L265 R280 S283 Y284 K285 A290 L291 D362 L366	L265-L287 HydrophobicContact CD1-CD2 4.29Å; R280-L287 VanDerWaalsContact NH1-CD2 3.27Å; S283-L287 PolarHBondContact O-N 2.86Å; Y284-L287 WeakPolarHBondContact O-CB 3.36Å; Y284-L287 PolarHBondContact O-N 2.86Å; K285-L287 VanDerWaalsContact C-N 3.33Å; K285-L287 PolarHBondContact O-N 3Å; L287-A290 PolarHBondContact O-N 3.21Å; L287-L291 PolarHBondContact O-N 2.98Å; L287-D362 HydrophobicContact CD1-CB 4.01Å; L287-L366 HydrophobicContact CD1-CD2 3.52Å; L287-L366 HydrophobicContact CG-CD2 4.1Å
288	Q	98.3	Very high	97.2	Very high	22 Å²	22	28.4 Å²	28.4	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-45.8	174.2	-58.3	172.2	3.6	0	0	111.1	L213 W221 Y284 K285 A286 A290 L291 M292	L213-Q288 HydrophobicContact CD1-CB 4.38Å; L213-Q288 HydrophobicContact CD2-CB 3.82Å; W221-Q288 HydrophobicContact CD2-CB 4.36Å; W221-Q288 HydrophobicContact CD2-CG 3.55Å; W221-Q288 HydrophobicContact CE3-CB 3.9Å; W221-Q288 HydrophobicContact CE3-CG 3.51Å; W221-Q288 HydrophobicContact CG-CG 4.16Å; W221-Q288 HydrophobicContact CH2-CG 3.99Å; W221-Q288 HydrophobicContact CZ2-CG 4.04Å; W221-Q288 HydrophobicContact CZ3-CB 4.13Å; W221-Q288 HydrophobicContact CZ3-CG 3.74Å; Y284-Q288 VanDerWaalsContact CD1-NE2 3.29Å; Y284-Q288 WeakPolarHBondContact O-CG 3.37Å; Y284-Q288 PolarHBondContact O-N 3.28Å; Y284-Q288 VanDerWaalsContact O-N 3.13Å; K285-Q288 WeakPolarHBondContact O-CB 3.48Å; K285-Q288 PolarHBondContact O-N 3.3Å; A286-Q288 VanDerWaalsContact C-N 3.32Å; A286-Q288 PolarHBondContact O-N 3.17Å; Q288-A290 VanDerWaalsContact C-N 3.33Å; Q288-A290 PolarHBondContact O-N 3.05Å; Q288-L291 PolarHBondContact O-N 3.49Å; Q288-M292 PolarHBondContact O-N 3.35Å
289	G	98.2	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.4	-41	176.4	0	0	0	0	0	112.9	T210 K285 A286 M292 I293	T210-G289 WeakPolarHBondContact OG1-CA 3.23Å; K285-G289 PolarHBondContact O-N 3.37Å; A286-G289 PolarHBondContact O-N 3.36Å; G289-M292 WeakPolarHBondContact O-CB 3Å; G289-M292 PolarHBondContact O-N 2.92Å; G289-I293 WeakPolarHBondContact O-CG1 3.3Å; G289-I293 PolarHBondContact O-N 3.12Å
290	A	98.6	Very high	96.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.2	-40.5	176.1	0	0	0	0	0	112	L207 A286 L287 Q288 I293 Y294 L309 L363 L366	L207-A290 HydrophobicContact CD1-CB 4.18Å; L207-A290 HydrophobicContact CD2-CB 4.15Å; A286-A290 PolarHBondContact O-N 3.31Å; L287-A290 PolarHBondContact O-N 3.21Å; Q288-A290 VanDerWaalsContact C-N 3.33Å; Q288-A290 PolarHBondContact O-N 3.05Å; A290-I293 PolarHBondContact O-N 3.35Å; A290-Y294 VanDerWaalsContact O-CD2 3.3Å; A290-Y294 WeakPolarHBondContact O-CD2 3.2Å; A290-Y294 PolarHBondContact O-N 3.49Å; A290-L309 HydrophobicContact CB-CD1 4.28Å; A290-L363 HydrophobicContact CB-CD2 3.96Å; A290-L366 HydrophobicContact CB-CD1 3.67Å
291	L	98.1	Very high	96.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-40.8	173.4	-81.3	171	0	0	0	112.7	F220 W221 L265 L287 Q288 Y294 F295 L366 F369	F220-L291 HydrophobicContact CE1-CB 4.12Å; F220-L291 HydrophobicContact CZ-CB 4.16Å; W221-L291 HydrophobicContact CH2-CD1 3.96Å; W221-L291 HydrophobicContact CZ3-CD1 3.75Å; L265-L291 HydrophobicContact CD1-CD1 4.32Å; L265-L291 HydrophobicContact CD2-CD1 4.36Å; L287-L291 PolarHBondContact O-N 2.98Å; Q288-L291 PolarHBondContact O-N 3.49Å; L291-Y294 PolarHBondContact O-N 2.97Å; L291-F295 HydrophobicContact CB-CE2 4.39Å; L291-F295 HydrophobicContact CD2-CE2 4.05Å; L291-F295 HydrophobicContact CD2-CZ 4.41Å; L291-F295 VanDerWaalsContact O-CD2 3.26Å; L291-F295 WeakPolarHBondContact O-CD2 3.23Å; L291-F295 PolarHBondContact O-N 3.05Å; L291-L366 HydrophobicContact CD1-CD2 4.39Å; L291-L366 HydrophobicContact CD2-CB 4.34Å; L291-L366 HydrophobicContact CD2-CD2 3.91Å; L291-L366 HydrophobicContact CG-CD2 3.76Å; L291-F369 HydrophobicContact CD2-CB 4.34Å
292	M	97.2	Very high	96.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.4	-52.7	173.7	-177.7	75	-172.7	0	0	110.1	T210 L213 F218 F220 Q288 G289 Y294 F295 Y296 F302 L387	T210-M292 HydrophobicContact CG2-CB 4.08Å; T210-M292 HydrophobicContact CG2-CG 3.95Å; L213-M292 HydrophobicContact CD2-CB 4.38Å; F218-M292 HydrophobicContact CD1-CE 3.83Å; F218-M292 HydrophobicContact CD1-SD 4.3Å; F218-M292 HydrophobicContact CE1-CE 3.87Å; F218-M292 HydrophobicContact CE1-SD 4.18Å; F220-M292 HydrophobicContact CB-SD 3.67Å; F220-M292 HydrophobicContact CD1-CB 4.01Å; F220-M292 HydrophobicContact CD1-SD 3.98Å; F220-M292 HydrophobicContact CD2-SD 3.55Å; F220-M292 VanDerWaalsContact CD2-SD 3.55Å; F220-M292 HydrophobicContact CE1-CB 3.99Å; F220-M292 HydrophobicContact CE2-SD 4.15Å; F220-M292 HydrophobicContact CG-CB 4.44Å; F220-M292 HydrophobicContact CG-SD 3.44Å; F220-M292 WeakPolarHBondContact CG-SD 3.28Å; F220-M292 HydrophobicContact CZ-CB 4.41Å; Q288-M292 PolarHBondContact O-N 3.35Å; G289-M292 WeakPolarHBondContact O-CB 3Å; G289-M292 PolarHBondContact O-N 2.92Å; M292-Y294 VanDerWaalsContact C-N 3.28Å; M292-Y294 PolarHBondContact O-N 3.42Å; M292-F295 PolarHBondContact O-N 3.23Å; M292-Y296 HydrophobicContact CE-CD2 3.45Å; M292-Y296 VanDerWaalsContact CE-CD2 3.45Å; M292-Y296 HydrophobicContact CE-CE2 3.63Å; M292-Y296 HydrophobicContact CE-CG 4.18Å; M292-Y296 HydrophobicContact CG-CD2 4.07Å; M292-Y296 WeakPolarHBondContact O-CD2 3.29Å; M292-Y296 PolarHBondContact O-N 3.46Å; M292-Y296 HydrophobicContact SD-CD2 3.36Å; M292-Y296 WeakPolarHBondContact SD-CD2 3.5Å; M292-Y296 HydrophobicContact SD-CE2 3.3Å; M292-Y296 WeakPolarHBondContact SD-CE2 3.4Å; M292-F302 HydrophobicContact CE-CE2 3.88Å; M292-F302 HydrophobicContact CE-CZ 4.16Å; M292-F302 HydrophobicContact CG-CE2 4.17Å; M292-F302 HydrophobicContact CG-CZ 3.96Å; M292-L387 HydrophobicContact CE-CD1 4.15Å
293	I	97.7	Very high	96.4	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-58.2	-41.2	177.2	-67.8	163.3	0	0	0	111	W206 L207 T210 G289 A290 R297 F302 P305 F306 L309	W206-I293 HydrophobicContact CH2-CD1 3.78Å; W206-I293 HydrophobicContact CZ3-CD1 4.14Å; L207-I293 HydrophobicContact CD2-CD1 3.61Å; T210-I293 HydrophobicContact CG2-CD1 4.31Å; T210-I293 HydrophobicContact CG2-CG1 4Å; G289-I293 WeakPolarHBondContact O-CG1 3.3Å; G289-I293 PolarHBondContact O-N 3.12Å; A290-I293 PolarHBondContact O-N 3.35Å; I293-R297 WeakPolarHBondContact O-CA 3.42Å; I293-R297 VanDerWaalsContact O-CB 3.26Å; I293-R297 WeakPolarHBondContact O-CB 3.25Å; I293-R297 PolarHBondContact O-N 3.06Å; I293-F302 HydrophobicContact CG1-CD1 3.88Å; I293-F302 HydrophobicContact CG1-CE1 4.12Å; I293-P305 HydrophobicContact CD1-CB 4.03Å; I293-P305 HydrophobicContact CG1-CB 4.24Å; I293-P305 HydrophobicContact CG2-CB 3.99Å; I293-F306 HydrophobicContact CG2-CB 3.86Å; I293-F306 HydrophobicContact CG2-CD2 4.42Å; I293-L309 HydrophobicContact CB-CD1 4.04Å; I293-L309 HydrophobicContact CD1-CD1 4.12Å; I293-L309 HydrophobicContact CG2-CD1 3.77Å
294	Y	97.6	Very high	96.4	Very high	29 Å²	29	32.4 Å²	32.4	11%	0.114	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-47.2	179.4	-96.4	-126.8	0	0	0	113.3	A290 L291 M292 R297 F306 L309 M313 L363 L366	A290-Y294 VanDerWaalsContact O-CD2 3.3Å; A290-Y294 WeakPolarHBondContact O-CD2 3.2Å; A290-Y294 PolarHBondContact O-N 3.49Å; L291-Y294 PolarHBondContact O-N 2.97Å; M292-Y294 VanDerWaalsContact C-N 3.28Å; M292-Y294 PolarHBondContact O-N 3.42Å; Y294-R297 PolarHBondContact O-NH1 3.13Å; Y294-F306 HydrophobicContact CD1-CE2 4.45Å; Y294-F306 HydrophobicContact CD2-CD2 4.1Å; Y294-F306 HydrophobicContact CD2-CE2 4.05Å; Y294-F306 HydrophobicContact CE2-CD2 4.33Å; Y294-F306 HydrophobicContact CE2-CE2 4.11Å; Y294-F306 HydrophobicContact CG-CE2 4.22Å; Y294-L309 HydrophobicContact CD2-CD1 4.02Å; Y294-L309 HydrophobicContact CE2-CB 4.22Å; Y294-L309 HydrophobicContact CE2-CD1 3.85Å; Y294-M313 WeakPolarHBondContact OH-CE 3.44Å; Y294-M313 PolarHBondContact OH-SD 2.88Å; Y294-M313 VanDerWaalsContact OH-SD 3.32Å; Y294-L363 PolarHBondContact OH-O 2.82Å; Y294-L366 HydrophobicContact CD1-CB 4.5Å; Y294-L366 HydrophobicContact CD1-CD1 4.46Å; Y294-L366 HydrophobicContact CD2-CD1 4.04Å; Y294-L366 HydrophobicContact CE1-CB 4.28Å; Y294-L366 HydrophobicContact CE1-CD1 4.36Å; Y294-L366 HydrophobicContact CE2-CD1 3.96Å; Y294-L366 HydrophobicContact CG-CD1 4.29Å
295	F	97.1	Very high	96.4	Very high	14 Å²	14	32.2 Å²	32.2	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-71.1	-37.9	-177.1	-74.3	-50.1	0	0	0	112.3	F220 L224 L291 M292 L370 V371 R373 V376	F220-F295 HydrophobicContact CE2-CD2 4.01Å; F220-F295 AromaticContact CZ-CD2 3.75Å; F220-F295 HydrophobicContact CZ-CD2 3.75Å; F220-F295 HydrophobicContact CZ-CE2 4.21Å; L224-F295 HydrophobicContact CD1-CE2 4.12Å; L224-F295 HydrophobicContact CD2-CE2 4.05Å; L291-F295 HydrophobicContact CB-CE2 4.39Å; L291-F295 HydrophobicContact CD2-CE2 4.05Å; L291-F295 HydrophobicContact CD2-CZ 4.41Å; L291-F295 VanDerWaalsContact O-CD2 3.26Å; L291-F295 WeakPolarHBondContact O-CD2 3.23Å; L291-F295 PolarHBondContact O-N 3.05Å; M292-F295 PolarHBondContact O-N 3.23Å; F295-L370 HydrophobicContact CE1-CD2 4.14Å; F295-V371 HydrophobicContact CE1-CG2 3.95Å; F295-V371 HydrophobicContact CZ-CG2 3.88Å; F295-R373 PolarHBondContact O-NH1 3.35Å; F295-R373 VanDerWaalsContact O-NH1 3.17Å; F295-V376 HydrophobicContact CB-CG1 3.81Å; F295-V376 HydrophobicContact CB-CG2 4.4Å; F295-V376 HydrophobicContact CD1-CG1 4.49Å; F295-V376 HydrophobicContact CD1-CG2 3.54Å; F295-V376 HydrophobicContact CE1-CG2 3.93Å; F295-V376 HydrophobicContact CG-CG1 4.12Å; F295-V376 HydrophobicContact CG-CG2 3.98Å
296	Y	96.1	Very high	96.4	Very high	15 Å²	15	29.8 Å²	29.8	6%	0.059	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	20.6	-176.3	-56.1	-75.8	0	0	0	113.9	F218 F220 M292 E298 E299 V376 P377 L379	F218-Y296 HydrophobicContact CE1-CE2 4.17Å; F218-Y296 AromaticContact CE1-CZ 3.99Å; F218-Y296 WeakPolarHBondContact CZ-OH 3.37Å; F220-Y296 AromaticContact CD2-CE2 3.79Å; F220-Y296 HydrophobicContact CD2-CE2 3.79Å; F220-Y296 AromaticContact CE2-CE2 3.79Å; F220-Y296 HydrophobicContact CE2-CE2 3.79Å; M292-Y296 HydrophobicContact CE-CD2 3.45Å; M292-Y296 VanDerWaalsContact CE-CD2 3.45Å; M292-Y296 HydrophobicContact CE-CE2 3.63Å; M292-Y296 HydrophobicContact CE-CG 4.18Å; M292-Y296 HydrophobicContact CG-CD2 4.07Å; M292-Y296 WeakPolarHBondContact O-CD2 3.29Å; M292-Y296 PolarHBondContact O-N 3.46Å; M292-Y296 HydrophobicContact SD-CD2 3.36Å; M292-Y296 WeakPolarHBondContact SD-CD2 3.5Å; M292-Y296 HydrophobicContact SD-CE2 3.3Å; M292-Y296 WeakPolarHBondContact SD-CE2 3.4Å; Y296-E298 PolarHBondContact O-N 2.97Å; Y296-E299 WeakPolarHBondContact O-CB 3.35Å; Y296-E299 WeakPolarHBondContact O-CG 3.43Å; Y296-E299 PolarHBondContact O-N 3.49Å; Y296-V376 HydrophobicContact CE1-CG1 3.92Å; Y296-V376 HydrophobicContact CE2-CG1 4.35Å; Y296-P377 WeakPolarHBondContact CE1-O 3.27Å; Y296-P377 WeakPolarHBondContact OH-CB 3.42Å; Y296-P377 PolarHBondContact OH-O 3.42Å; Y296-L379 HydrophobicContact CD1-CD1 3.53Å; Y296-L379 HydrophobicContact CD1-CD2 4.39Å; Y296-L379 HydrophobicContact CD1-CG 3.82Å; Y296-L379 HydrophobicContact CE1-CD1 3.95Å; Y296-L379 HydrophobicContact CE1-CD2 4.13Å; Y296-L379 HydrophobicContact CE1-CG 3.67Å; Y296-L379 HydrophobicContact CG-CD1 4.29Å
297	R	95.9	Very high	96.4	Very high	78 Å²	78	34.1 Å²	34.1	29%	0.294	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-19.4	-177.4	65.2	-174.9	-179.1	-83.8	5.3	116.6	I293 Y294 Q303 F306 R373	I293-R297 WeakPolarHBondContact O-CA 3.42Å; I293-R297 VanDerWaalsContact O-CB 3.26Å; I293-R297 WeakPolarHBondContact O-CB 3.25Å; I293-R297 PolarHBondContact O-N 3.06Å; Y294-R297 PolarHBondContact O-NH1 3.13Å; R297-Q303 WeakPolarHBondContact O-CA 3.31Å; R297-Q303 WeakPolarHBondContact O-CG 3.34Å; R297-F306 HydrophobicContact CB-CB 3.72Å; R297-F306 HydrophobicContact CB-CD1 4Å; R297-F306 HydrophobicContact CB-CD2 3.67Å; R297-F306 HydrophobicContact CB-CE2 4.31Å; R297-F306 HydrophobicContact CB-CG 3.5Å; R297-F306 VanDerWaalsContact CB-CG 3.5Å; R297-F306 HydrophobicContact CG-CD2 4.43Å; R297-F306 HydrophobicContact CG-CG 4.38Å; R297-R373 VanDerWaalsContact CZ-NH2 3.32Å
298	E	92.7	Very high	96.4	Very high	134 Å²	134	34.1 Å²	34.1	63%	0.626	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84	-19.1	179.5	-68.3	173.2	-168.1	0	0	112	Y296 Q303 R373	Y296-E298 PolarHBondContact O-N 2.97Å; E298-Q303 PolarHBondContact O-NE2 3.02Å; E298-R373 IonicContact OE1-NH2 3.68Å
299	E	91.4	Very high	96.4	Very high	39 Å²	39	33 Å²	33	18%	0.182	16%	0.157	C	C	.	.	S	Bend	trans	-65.5	137.1	175.4	-58.7	-56.7	151.5	0	0	110.4	Y296 R301 F302 Q303 L379 Y388	Y296-E299 WeakPolarHBondContact O-CB 3.35Å; Y296-E299 WeakPolarHBondContact O-CG 3.43Å; Y296-E299 PolarHBondContact O-N 3.49Å; E299-R301 VanDerWaalsContact C-N 3.31Å; E299-R301 PolarHBondContact O-N 3.21Å; E299-R301 VanDerWaalsContact O-N 3.11Å; E299-F302 HydrophobicContact CB-CD2 4.18Å; E299-F302 PolarHBondContact O-N 3.13Å; E299-Q303 PolarHBondContact O-N 3.06Å; E299-L379 HydrophobicContact CG-CD1 3.62Å; E299-Y388 WeakPolarHBondContact OE2-CE1 3.37Å; E299-Y388 VanDerWaalsContact OE2-CZ 3.24Å; E299-Y388 PolarHBondContact OE2-OH 3.24Å
300	P	91.3	Very high	96.4	Very high	67 Å²	67	35.1 Å²	35.1	44%	0.435	17%	0.169	S	C	.	.	H	α-helix	trans	-50.8	-43.9	-169.6	-30.7	36.3	0	0	0	114.8	F302 Y388	P300-F302 VanDerWaalsContact C-N 3.27Å; P300-F302 PolarHBondContact O-N 3.22Å; P300-Y388 HydrophobicContact CG-CD1 4.13Å
301	R	91.4	Very high	96.4	Very high	23 Å²	23	35.4 Å²	35.4	9%	0.087	17%	0.171	C	C	.	.	H	α-helix	trans	-67.6	-23.2	179	-72.2	-179.8	73.4	-169.3	-0.4	113.9	E103 E299 P305 F386 L387 M389	E103-R301 IonicContact OE1-CZ 2.83Å; E103-R301 IonicContact OE1-NE 3.86Å; E103-R301 PolarHBondContact OE1-NE 3.27Å; E103-R301 IonicContact OE1-NH2 3.41Å; E103-R301 PolarHBondContact OE1-NH2 3.36Å; E103-R301 IonicContact OE2-NE 2.78Å; E103-R301 PolarHBondContact OE2-NE 3.49Å; E299-R301 VanDerWaalsContact C-N 3.31Å; E299-R301 PolarHBondContact O-N 3.21Å; E299-R301 VanDerWaalsContact O-N 3.11Å; R301-P305 WeakPolarHBondContact O-CD 3.28Å; R301-P305 WeakPolarHBondContact O-CG 3.31Å; R301-F386 WeakPolarHBondContact CD-O 3.45Å; R301-F386 PolarHBondContact NH1-O 3.02Å; R301-L387 VanDerWaalsContact CG-O 3.3Å; R301-L387 WeakPolarHBondContact CG-O 3.33Å; R301-M389 WeakPolarHBondContact CD-O 3.34Å
302	F	95.1	Very high	96.4	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.022	17%	0.171	C	C	.	.	H	α-helix	trans	-99.1	-6.5	-177.4	-66.8	-40.8	0	0	0	115.1	T210 P211 M292 I293 E299 P300 F306 L387	T210-F302 HydrophobicContact CG2-CE1 3.78Å; T210-F302 HydrophobicContact CG2-CZ 4.03Å; P211-F302 HydrophobicContact CG-CE1 3.7Å; P211-F302 HydrophobicContact CG-CZ 3.78Å; M292-F302 HydrophobicContact CE-CE2 3.88Å; M292-F302 HydrophobicContact CE-CZ 4.16Å; M292-F302 HydrophobicContact CG-CE2 4.17Å; M292-F302 HydrophobicContact CG-CZ 3.96Å; I293-F302 HydrophobicContact CG1-CD1 3.88Å; I293-F302 HydrophobicContact CG1-CE1 4.12Å; E299-F302 HydrophobicContact CB-CD2 4.18Å; E299-F302 PolarHBondContact O-N 3.13Å; P300-F302 VanDerWaalsContact C-N 3.27Å; P300-F302 PolarHBondContact O-N 3.22Å; F302-F306 VanDerWaalsContact O-CB 3.29Å; F302-F306 WeakPolarHBondContact O-CB 3.35Å; F302-F306 PolarHBondContact O-N 2.95Å; F302-L387 HydrophobicContact CD2-CD2 4.32Å; F302-L387 HydrophobicContact CE1-CD2 4.42Å; F302-L387 HydrophobicContact CE2-CD1 4.12Å; F302-L387 HydrophobicContact CE2-CD2 3.44Å; F302-L387 VanDerWaalsContact CE2-CD2 3.44Å; F302-L387 HydrophobicContact CE2-CG 4.38Å; F302-L387 HydrophobicContact CZ-CD2 3.51Å
303	Q	95.9	Very high	96.5	Very high	94 Å²	94	36.7 Å²	36.7	44%	0.439	18%	0.178	S	C	.	.	H	α-helix	trans	-60.6	-52.7	-179.9	-68.8	176.9	2.5	0	0	112.5	R297 E298 E299 F306 Q307	R297-Q303 WeakPolarHBondContact O-CA 3.31Å; R297-Q303 WeakPolarHBondContact O-CG 3.34Å; E298-Q303 PolarHBondContact O-NE2 3.02Å; E299-Q303 PolarHBondContact O-N 3.06Å; Q303-F306 PolarHBondContact O-N 3.23Å; Q303-Q307 WeakPolarHBondContact O-CG 3.43Å; Q303-Q307 PolarHBondContact O-N 2.98Å; Q303-Q307 VanDerWaalsContact O-N 3.15Å
304	V	97.4	Very high	96.6	Very high	37 Å²	37	39 Å²	39	22%	0.224	19%	0.19	C	C	.	.	H	α-helix	trans	-71.4	-41.7	178.8	-174.5	0	0	0	0	112	M106 N110 F306 Q307 L308	M106-V304 HydrophobicContact CB-CB 4.32Å; M106-V304 HydrophobicContact CB-CG1 3.81Å; N110-V304 HydrophobicContact CB-CG1 3.92Å; V304-F306 VanDerWaalsContact C-N 3.29Å; V304-F306 PolarHBondContact O-N 3.24Å; V304-Q307 WeakPolarHBondContact O-CB 3.29Å; V304-Q307 PolarHBondContact O-N 2.8Å; V304-Q307 VanDerWaalsContact O-N 3.13Å; V304-L308 PolarHBondContact O-N 2.56Å
305	P	98.1	Very high	96.6	Very high	12 Å²	12	37.6 Å²	37.6	8%	0.078	19%	0.185	C	C	.	.	H	α-helix	trans	-49.5	-45.2	167.8	-35.5	40.6	0	0	0	114.1	M106 W206 I293 R301 Q307 L308 L309	M106-P305 HydrophobicContact CE-CG 4.29Å; W206-P305 HydrophobicContact CH2-CB 3.73Å; W206-P305 HydrophobicContact CH2-CG 4.37Å; W206-P305 HydrophobicContact CZ2-CB 3.91Å; W206-P305 HydrophobicContact CZ2-CG 4.04Å; I293-P305 HydrophobicContact CD1-CB 4.03Å; I293-P305 HydrophobicContact CG1-CB 4.24Å; I293-P305 HydrophobicContact CG2-CB 3.99Å; R301-P305 WeakPolarHBondContact O-CD 3.28Å; R301-P305 WeakPolarHBondContact O-CG 3.31Å; P305-Q307 PolarHBondContact O-N 3.29Å; P305-L308 WeakPolarHBondContact O-CB 3.38Å; P305-L308 PolarHBondContact O-N 2.96Å; P305-L309 WeakPolarHBondContact O-CG 3.48Å; P305-L309 PolarHBondContact O-N 2.6Å
306	F	98.5	Very high	96.6	Very high	53 Å²	53	37 Å²	37	23%	0.232	18%	0.182	C	C	.	.	H	α-helix	trans	-65.6	-39.1	177.8	179.7	-102.4	0	0	0	112.4	I293 Y294 R297 F302 Q303 V304 L308 L309 T310	I293-F306 HydrophobicContact CG2-CB 3.86Å; I293-F306 HydrophobicContact CG2-CD2 4.42Å; Y294-F306 HydrophobicContact CD1-CE2 4.45Å; Y294-F306 HydrophobicContact CD2-CD2 4.1Å; Y294-F306 HydrophobicContact CD2-CE2 4.05Å; Y294-F306 HydrophobicContact CE2-CD2 4.33Å; Y294-F306 HydrophobicContact CE2-CE2 4.11Å; Y294-F306 HydrophobicContact CG-CE2 4.22Å; R297-F306 HydrophobicContact CB-CB 3.72Å; R297-F306 HydrophobicContact CB-CD1 4Å; R297-F306 HydrophobicContact CB-CD2 3.67Å; R297-F306 HydrophobicContact CB-CE2 4.31Å; R297-F306 HydrophobicContact CB-CG 3.5Å; R297-F306 VanDerWaalsContact CB-CG 3.5Å; R297-F306 HydrophobicContact CG-CD2 4.43Å; R297-F306 HydrophobicContact CG-CG 4.38Å; F302-F306 VanDerWaalsContact O-CB 3.29Å; F302-F306 WeakPolarHBondContact O-CB 3.35Å; F302-F306 PolarHBondContact O-N 2.95Å; Q303-F306 PolarHBondContact O-N 3.23Å; V304-F306 VanDerWaalsContact C-N 3.29Å; V304-F306 PolarHBondContact O-N 3.24Å; F306-L308 VanDerWaalsContact C-N 3.31Å; F306-L308 PolarHBondContact O-N 3.26Å; F306-L309 PolarHBondContact O-N 3.38Å; F306-T310 WeakPolarHBondContact O-CB 3.41Å; F306-T310 PolarHBondContact O-N 3.02Å; F306-T310 PolarHBondContact O-OG1 3.15Å
307	Q	98.6	Very high	96.7	Very high	91 Å²	91	39.2 Å²	39.2	43%	0.425	20%	0.195	S	C	.	.	H	α-helix	trans	-63	-37.7	173.2	-68.3	173	11.2	0	0	112.1	N110 Q303 V304 P305 T310 S311	N110-Q307 PolarHBondContact ND2-OE1 3.47Å; N110-Q307 VanDerWaalsContact ND2-OE1 3.11Å; N110-Q307 VanDerWaalsContact OD1-C 3.24Å; N110-Q307 PolarHBondContact OD1-O 2.99Å; Q303-Q307 WeakPolarHBondContact O-CG 3.43Å; Q303-Q307 PolarHBondContact O-N 2.98Å; Q303-Q307 VanDerWaalsContact O-N 3.15Å; V304-Q307 WeakPolarHBondContact O-CB 3.29Å; V304-Q307 PolarHBondContact O-N 2.8Å; V304-Q307 VanDerWaalsContact O-N 3.13Å; P305-Q307 PolarHBondContact O-N 3.29Å; Q307-T310 PolarHBondContact O-N 2.71Å; Q307-S311 WeakPolarHBondContact O-CB 3.47Å; Q307-S311 PolarHBondContact O-N 3.13Å; Q307-S311 PolarHBondContact O-OG 2.65Å
308	L	98.6	Very high	96.9	Very high	2 Å²	2	36 Å²	36	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-50.8	175	175.6	60.6	0	0	0	110.7	F95 M106 V109 N110 I113 W206 V304 P305 F306 T310 S311 L312	F95-L308 HydrophobicContact CZ-CD2 4.32Å; M106-L308 HydrophobicContact CE-CD2 3.78Å; V109-L308 HydrophobicContact CG1-CD1 3.98Å; V109-L308 HydrophobicContact CG1-CD2 4.01Å; N110-L308 WeakPolarHBondContact OD1-CA 3.26Å; N110-L308 PolarHBondContact OD1-N 3.36Å; I113-L308 HydrophobicContact CB-CD1 4.21Å; I113-L308 HydrophobicContact CG1-CD1 3.82Å; I113-L308 HydrophobicContact CG2-CD1 4.43Å; W206-L308 HydrophobicContact CH2-CD2 4.25Å; W206-L308 HydrophobicContact CZ3-CD2 4.31Å; V304-L308 PolarHBondContact O-N 2.56Å; P305-L308 WeakPolarHBondContact O-CB 3.38Å; P305-L308 PolarHBondContact O-N 2.96Å; F306-L308 VanDerWaalsContact C-N 3.31Å; F306-L308 PolarHBondContact O-N 3.26Å; L308-T310 VanDerWaalsContact C-N 3.25Å; L308-T310 PolarHBondContact O-N 3.1Å; L308-S311 PolarHBondContact O-N 3.17Å; L308-L312 HydrophobicContact CD1-CD1 4.45Å; L308-L312 HydrophobicContact CD1-CG 4.25Å; L308-L312 HydrophobicContact CG-CD1 4.29Å; L308-L312 WeakPolarHBondContact O-CG 3.48Å; L308-L312 PolarHBondContact O-N 3.4Å
309	L	98.8	Very high	97.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-40.1	177.1	-63.1	-172.8	0	0	0	112	W206 L207 A290 I293 Y294 P305 F306 L312 M313 L363	W206-L309 HydrophobicContact CZ3-CD2 4.24Å; L207-L309 HydrophobicContact CD2-CD2 4.27Å; A290-L309 HydrophobicContact CB-CD1 4.28Å; I293-L309 HydrophobicContact CB-CD1 4.04Å; I293-L309 HydrophobicContact CD1-CD1 4.12Å; I293-L309 HydrophobicContact CG2-CD1 3.77Å; Y294-L309 HydrophobicContact CD2-CD1 4.02Å; Y294-L309 HydrophobicContact CE2-CB 4.22Å; Y294-L309 HydrophobicContact CE2-CD1 3.85Å; P305-L309 WeakPolarHBondContact O-CG 3.48Å; P305-L309 PolarHBondContact O-N 2.6Å; F306-L309 PolarHBondContact O-N 3.38Å; L309-L312 HydrophobicContact CD2-CD1 4.35Å; L309-L312 PolarHBondContact O-N 3.21Å; L309-M313 PolarHBondContact O-N 3.46Å; L309-M313 VanDerWaalsContact O-N 3.17Å; L309-L363 HydrophobicContact CB-CD1 4.28Å; L309-L363 HydrophobicContact CD2-CD1 4.03Å; L309-L363 HydrophobicContact CD2-CD2 4.18Å
310	T	98.7	Very high	97.4	Very high	43 Å²	43	29.6 Å²	29.6	26%	0.264	16%	0.156	S	C	.	.	H	α-helix	trans	-61.9	-46.2	174.5	-55.9	0	0	0	0	111.5	F306 Q307 L308 L312 M313 D314	F306-T310 WeakPolarHBondContact O-CB 3.41Å; F306-T310 PolarHBondContact O-N 3.02Å; F306-T310 PolarHBondContact O-OG1 3.15Å; Q307-T310 PolarHBondContact O-N 2.71Å; L308-T310 VanDerWaalsContact C-N 3.25Å; L308-T310 PolarHBondContact O-N 3.1Å; T310-L312 VanDerWaalsContact C-N 3.32Å; T310-L312 PolarHBondContact O-N 2.9Å; T310-M313 PolarHBondContact O-N 3.28Å; T310-D314 PolarHBondContact O-N 2.95Å
311	S	98.7	Very high	97.8	Very high	6 Å²	6	30.8 Å²	30.8	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-67.1	-32.1	-179.6	-56.8	0	0	0	0	112.7	N110 V117 Q307 L308 D314 M315	N110-S311 PolarHBondContact OD1-OG 2.92Å; V117-S311 VanDerWaalsContact CG2-O 3.31Å; V117-S311 WeakPolarHBondContact CG2-O 3.39Å; Q307-S311 WeakPolarHBondContact O-CB 3.47Å; Q307-S311 PolarHBondContact O-N 3.13Å; Q307-S311 PolarHBondContact O-OG 2.65Å; L308-S311 PolarHBondContact O-N 3.17Å; S311-D314 PolarHBondContact O-N 3.26Å; S311-M315 WeakPolarHBondContact O-CB 3.49Å; S311-M315 PolarHBondContact O-N 2.69Å
312	L	98.7	Very high	98.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-43.7	173.3	-66.9	172.8	0	0	0	111.6	I113 L199 V203 L308 L309 T310 M315 D316 F360 L363	I113-L312 HydrophobicContact CG2-CD2 4.13Å; L199-L312 HydrophobicContact CD2-CD2 3.91Å; V203-L312 HydrophobicContact CG1-CD1 3.96Å; V203-L312 HydrophobicContact CG2-CD1 4Å; L308-L312 HydrophobicContact CD1-CD1 4.45Å; L308-L312 HydrophobicContact CD1-CG 4.25Å; L308-L312 HydrophobicContact CG-CD1 4.29Å; L308-L312 WeakPolarHBondContact O-CG 3.48Å; L308-L312 PolarHBondContact O-N 3.4Å; L309-L312 HydrophobicContact CD2-CD1 4.35Å; L309-L312 PolarHBondContact O-N 3.21Å; T310-L312 VanDerWaalsContact C-N 3.32Å; T310-L312 PolarHBondContact O-N 2.9Å; L312-M315 HydrophobicContact CD2-CE 4.21Å; L312-M315 PolarHBondContact O-N 2.7Å; L312-D316 PolarHBondContact O-N 3.3Å; L312-F360 HydrophobicContact CB-CD1 4.39Å; L312-F360 HydrophobicContact CB-CD2 4Å; L312-F360 HydrophobicContact CB-CE2 4.21Å; L312-F360 HydrophobicContact CB-CG 4.1Å; L312-F360 HydrophobicContact CB-CZ 4.49Å; L312-F360 HydrophobicContact CD1-CD1 4.22Å; L312-F360 HydrophobicContact CD1-CE1 3.91Å; L312-F360 HydrophobicContact CD1-CZ 4.19Å; L312-F360 HydrophobicContact CD2-CD2 4.5Å; L312-F360 HydrophobicContact CD2-CE1 4.34Å; L312-F360 HydrophobicContact CD2-CE2 3.85Å; L312-F360 HydrophobicContact CD2-CZ 3.76Å; L312-F360 HydrophobicContact CG-CE2 4.46Å; L312-F360 HydrophobicContact CG-CZ 4.36Å; L312-L363 HydrophobicContact CB-CD1 4.2Å; L312-L363 HydrophobicContact CD1-CD1 4.48Å
313	M	98.7	Very high	98.2	Very high	28 Å²	28	31.3 Å²	31.3	14%	0.138	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-42.9	172.7	-69.7	-172.3	-65.5	0	0	111.9	Y294 L309 T310 M315 D316 N317 L363 F364	Y294-M313 WeakPolarHBondContact OH-CE 3.44Å; Y294-M313 PolarHBondContact OH-SD 2.88Å; Y294-M313 VanDerWaalsContact OH-SD 3.32Å; L309-M313 PolarHBondContact O-N 3.46Å; L309-M313 VanDerWaalsContact O-N 3.17Å; T310-M313 PolarHBondContact O-N 3.28Å; M313-M315 VanDerWaalsContact C-N 3.3Å; M313-M315 PolarHBondContact O-N 2.94Å; M313-D316 PolarHBondContact O-N 3.03Å; M313-N317 WeakPolarHBondContact O-CB 3.49Å; M313-N317 PolarHBondContact O-N 3.44Å; M313-L363 HydrophobicContact CG-CB 3.62Å; M313-L363 HydrophobicContact CG-CD1 4.15Å; M313-L363 HydrophobicContact SD-CB 3.82Å; M313-F364 HydrophobicContact CB-CE1 4.12Å; M313-F364 HydrophobicContact CB-CE2 3.86Å; M313-F364 HydrophobicContact CB-CZ 3.64Å; M313-F364 HydrophobicContact CG-CD2 4.03Å; M313-F364 HydrophobicContact CG-CE1 4.45Å; M313-F364 HydrophobicContact CG-CE2 3.79Å; M313-F364 HydrophobicContact CG-CG 4.48Å; M313-F364 HydrophobicContact CG-CZ 4.03Å; M313-F364 WeakPolarHBondContact O-CZ 3.49Å; M313-F364 HydrophobicContact SD-CD1 4.35Å; M313-F364 HydrophobicContact SD-CD2 4.38Å; M313-F364 HydrophobicContact SD-CG 4.28Å
314	D	98.7	Very high	98.3	Very high	49 Å²	49	33 Å²	33	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-60.7	-40.2	177.8	-82.8	-16.3	0	0	0	111.9	V117 T310 S311 N317 L318	V117-D314 HydrophobicContact CG1-CB 3.92Å; V117-D314 HydrophobicContact CG2-CB 3.85Å; T310-D314 PolarHBondContact O-N 2.95Å; S311-D314 PolarHBondContact O-N 3.26Å; D314-N317 PolarHBondContact O-N 3.47Å; D314-L318 WeakPolarHBondContact O-CB 3.24Å; D314-L318 WeakPolarHBondContact O-CD1 3.32Å; D314-L318 VanDerWaalsContact O-CG 3.28Å; D314-L318 WeakPolarHBondContact O-CG 3.33Å; D314-L318 PolarHBondContact O-N 2.9Å
315	M	98.1	Very high	98.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.5	-48.9	175.7	-177.7	178	66.1	0	0	111.5	I116 V117 F120 I163 L199 S311 L312 M313 N317 L318 M319 F360	I116-M315 HydrophobicContact CG2-CG 4.15Å; I116-M315 HydrophobicContact CG2-SD 3.82Å; V117-M315 HydrophobicContact CG2-CB 4.19Å; F120-M315 HydrophobicContact CD2-CG 4.19Å; F120-M315 HydrophobicContact CE2-CG 3.92Å; I163-M315 HydrophobicContact CD1-CE 4.14Å; I163-M315 HydrophobicContact CD1-SD 4.05Å; I163-M315 HydrophobicContact CG1-CE 4.24Å; I163-M315 HydrophobicContact CG1-SD 4.5Å; I163-M315 HydrophobicContact CG2-CE 3.85Å; L199-M315 HydrophobicContact CD2-CE 4.06Å; S311-M315 WeakPolarHBondContact O-CB 3.49Å; S311-M315 PolarHBondContact O-N 2.69Å; L312-M315 HydrophobicContact CD2-CE 4.21Å; L312-M315 PolarHBondContact O-N 2.7Å; M313-M315 VanDerWaalsContact C-N 3.3Å; M313-M315 PolarHBondContact O-N 2.94Å; M315-N317 PolarHBondContact O-N 2.99Å; M315-L318 PolarHBondContact O-N 2.91Å; M315-M319 PolarHBondContact O-N 3.47Å; M315-F360 HydrophobicContact CE-CD2 4.48Å; M315-F360 HydrophobicContact CE-CE2 3.82Å
316	D	98	Very high	98.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-60.3	-44	176.8	-104.5	-26	0	0	0	112.5	L312 M313 L318 M319 T320 K358 V359 F360 F364	L312-D316 PolarHBondContact O-N 3.3Å; M313-D316 PolarHBondContact O-N 3.03Å; D316-L318 VanDerWaalsContact C-N 3.35Å; D316-M319 PolarHBondContact O-N 3.22Å; D316-T320 PolarHBondContact O-N 3.28Å; D316-T320 PolarHBondContact O-OG1 2.94Å; D316-K358 HydrophobicContact CB-CG 4.05Å; D316-K358 WeakPolarHBondContact OD2-CG 3.26Å; D316-V359 PolarHBondContact OD1-N 3.47Å; D316-V359 PolarHBondContact OD2-N 2.87Å; D316-V359 VanDerWaalsContact OD2-N 3.12Å; D316-F360 WeakPolarHBondContact OD2-CA 3.46Å; D316-F360 WeakPolarHBondContact OD2-CB 3.35Å; D316-F360 PolarHBondContact OD2-N 2.87Å; D316-F364 HydrophobicContact CB-CE2 4.12Å; D316-F364 HydrophobicContact CB-CZ 4.28Å
317	N	98.3	Very high	98.1	Very high	61 Å²	61	33.3 Å²	33.3	33%	0.326	16%	0.16	S	C	.	.	H	α-helix	trans	-61.8	-44.9	178.4	-175.1	25.2	0	0	0	110.8	M313 D314 M315 T320 K321	M313-N317 WeakPolarHBondContact O-CB 3.49Å; M313-N317 PolarHBondContact O-N 3.44Å; D314-N317 PolarHBondContact O-N 3.47Å; M315-N317 PolarHBondContact O-N 2.99Å; N317-T320 PolarHBondContact O-N 3.13Å; N317-K321 WeakPolarHBondContact O-CG 3.34Å; N317-K321 PolarHBondContact O-N 3.3Å; N317-K321 WeakPolarHBondContact OD1-CE 3.3Å
318	L	98.6	Very high	97.9	Very high	12 Å²	12	31.4 Å²	31.4	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-71.1	-36.4	179.8	-71.2	164.9	0	0	0	112.9	V117 F120 R121 V124 D314 M315 D316 T320 K321 W322	V117-L318 HydrophobicContact CB-CD1 4.35Å; V117-L318 HydrophobicContact CG1-CD1 3.66Å; V117-L318 VanDerWaalsContact O-CD1 3.27Å; V117-L318 WeakPolarHBondContact O-CD1 3.27Å; F120-L318 HydrophobicContact CB-CB 3.7Å; F120-L318 HydrophobicContact CB-CD1 4.02Å; F120-L318 HydrophobicContact CB-CG 4.44Å; F120-L318 HydrophobicContact CG-CB 4.41Å; R121-L318 HydrophobicContact CG-CD1 3.67Å; R121-L318 HydrophobicContact CG-CD2 3.73Å; R121-L318 HydrophobicContact CG-CG 4.38Å; V124-L318 HydrophobicContact CG2-CD2 4.38Å; D314-L318 WeakPolarHBondContact O-CB 3.24Å; D314-L318 WeakPolarHBondContact O-CD1 3.32Å; D314-L318 VanDerWaalsContact O-CG 3.28Å; D314-L318 WeakPolarHBondContact O-CG 3.33Å; D314-L318 PolarHBondContact O-N 2.9Å; M315-L318 PolarHBondContact O-N 2.91Å; D316-L318 VanDerWaalsContact C-N 3.35Å; L318-T320 VanDerWaalsContact C-N 3.29Å; L318-T320 PolarHBondContact O-N 3.28Å; L318-K321 HydrophobicContact CD2-CD 4.28Å; L318-K321 PolarHBondContact O-N 3.33Å; L318-W322 WeakPolarHBondContact O-CB 3.48Å; L318-W322 PolarHBondContact O-N 3.18Å
319	M	97.8	Very high	97.8	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-59	-42.7	170	-82.6	-171.7	52.3	0	0	111.6	F120 E160 I163 M315 D316 W322 R323	F120-M319 HydrophobicContact CD1-CG 4.26Å; F120-M319 HydrophobicContact CE1-CG 3.62Å; F120-M319 HydrophobicContact CE2-CG 3.95Å; F120-M319 HydrophobicContact CE2-SD 4.45Å; F120-M319 HydrophobicContact CZ-CG 3.44Å; F120-M319 VanDerWaalsContact CZ-CG 3.44Å; F120-M319 HydrophobicContact CZ-SD 3.97Å; E160-M319 HydrophobicContact CG-CE 4.49Å; I163-M319 HydrophobicContact CD1-CE 4.44Å; I163-M319 HydrophobicContact CD1-SD 3.43Å; I163-M319 WeakPolarHBondContact CD1-SD 3.3Å; M315-M319 PolarHBondContact O-N 3.47Å; D316-M319 PolarHBondContact O-N 3.22Å; M319-W322 PolarHBondContact O-N 3.34Å; M319-R323 WeakPolarHBondContact O-CG 3.26Å; M319-R323 PolarHBondContact O-N 2.87Å
320	T	97.9	Very high	97.5	Very high	32 Å²	32	32.7 Å²	32.7	20%	0.196	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-42.1	176.9	-57	0	0	0	0	111.5	D316 N317 L318 R323 Y324 V353	D316-T320 PolarHBondContact O-N 3.28Å; D316-T320 PolarHBondContact O-OG1 2.94Å; N317-T320 PolarHBondContact O-N 3.13Å; L318-T320 VanDerWaalsContact C-N 3.29Å; L318-T320 PolarHBondContact O-N 3.28Å; T320-R323 PolarHBondContact O-N 2.89Å; T320-Y324 WeakPolarHBondContact O-CB 3.46Å; T320-Y324 PolarHBondContact O-N 3.44Å; T320-V353 HydrophobicContact CG2-CG1 3.91Å
321	K	98.3	Very high	97.3	Very high	93 Å²	93	35 Å²	35	40%	0.404	17%	0.171	S	C	.	.	H	α-helix	trans	-61.9	-41.8	174	-74.5	173.6	178.7	178.5	0	112.1	V124 N317 L318 R323 Y324 N325	V124-K321 HydrophobicContact CG2-CB 4.1Å; N317-K321 WeakPolarHBondContact O-CG 3.34Å; N317-K321 PolarHBondContact O-N 3.3Å; N317-K321 WeakPolarHBondContact OD1-CE 3.3Å; L318-K321 HydrophobicContact CD2-CD 4.28Å; L318-K321 PolarHBondContact O-N 3.33Å; K321-R323 PolarHBondContact O-N 2.97Å; K321-Y324 PolarHBondContact O-N 3.09Å; K321-N325 PolarHBondContact O-N 3.41Å; K321-N325 PolarHBondContact O-OD1 3.48Å
322	W	98.4	Very high	97.1	Very high	27 Å²	27	39.9 Å²	39.9	10%	0.102	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-45.8	175.2	179.8	91.2	0	0	0	111	Y77 F81 V124 F127 F156 L318 M319 Y324 N325 H326	Y77-W322 AromaticContact CD1-NE1 3.9Å; Y77-W322 AromaticContact CE1-NE1 3.3Å; Y77-W322 VanDerWaalsContact CE1-NE1 3.3Å; Y77-W322 AromaticContact CZ-NE1 3.88Å; F81-W322 HydrophobicContact CZ-CZ2 4.05Å; V124-W322 HydrophobicContact CG2-CB 3.99Å; F127-W322 AromaticContact CE2-CD1 3.42Å; F127-W322 VanDerWaalsContact CE2-CD1 3.42Å; F127-W322 HydrophobicContact CE2-CD2 4.22Å; F127-W322 AromaticContact CE2-CE2 3.95Å; F127-W322 AromaticContact CE2-CG 3.91Å; F127-W322 HydrophobicContact CE2-CG 3.91Å; F127-W322 AromaticContact CE2-NE1 3.44Å; F127-W322 WeakPolarHBondContact CE2-O 3.35Å; F127-W322 HydrophobicContact CZ-CD2 4.36Å; F127-W322 AromaticContact CZ-CE2 3.78Å; F127-W322 HydrophobicContact CZ-CZ2 4.15Å; F127-W322 AromaticContact CZ-NE1 3.56Å; F156-W322 HydrophobicContact CD2-CH2 4.2Å; F156-W322 HydrophobicContact CD2-CZ3 4.27Å; F156-W322 HydrophobicContact CE1-CZ3 4.39Å; F156-W322 AromaticContact CE2-CE3 3.89Å; F156-W322 HydrophobicContact CE2-CE3 3.89Å; F156-W322 AromaticContact CE2-CH2 3.73Å; F156-W322 HydrophobicContact CE2-CH2 3.73Å; F156-W322 AromaticContact CE2-CZ3 3.37Å; F156-W322 HydrophobicContact CE2-CZ3 3.37Å; F156-W322 HydrophobicContact CZ-CE3 4.11Å; F156-W322 HydrophobicContact CZ-CH2 4.09Å; F156-W322 AromaticContact CZ-CZ3 3.44Å; F156-W322 HydrophobicContact CZ-CZ3 3.44Å; F156-W322 VanDerWaalsContact CZ-CZ3 3.44Å; L318-W322 WeakPolarHBondContact O-CB 3.48Å; L318-W322 PolarHBondContact O-N 3.18Å; M319-W322 PolarHBondContact O-N 3.34Å; W322-Y324 VanDerWaalsContact C-N 3.32Å; W322-Y324 PolarHBondContact O-N 3.21Å; W322-N325 PolarHBondContact O-N 3.5Å; W322-H326 WeakPolarHBondContact O-CB 3.25Å; W322-H326 PolarHBondContact O-N 3.27Å
323	R	97.4	Very high	96.8	Very high	11 Å²	11	40.9 Å²	40.9	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-60.5	-42	174.3	-68.4	179.6	-162.2	-85.5	-3	111.9	E160 M319 T320 K321 H326 V327 T352 V353	E160-R323 IonicContact OE1-CZ 2.96Å; E160-R323 VanDerWaalsContact OE1-CZ 3.24Å; E160-R323 IonicContact OE1-NH1 3.42Å; E160-R323 PolarHBondContact OE1-NH1 3.21Å; E160-R323 IonicContact OE1-NH2 2.6Å; E160-R323 PolarHBondContact OE1-NH2 3.07Å; M319-R323 WeakPolarHBondContact O-CG 3.26Å; M319-R323 PolarHBondContact O-N 2.87Å; T320-R323 PolarHBondContact O-N 2.89Å; K321-R323 PolarHBondContact O-N 2.97Å; R323-H326 WeakPolarHBondContact O-CB 3.41Å; R323-H326 PolarHBondContact O-N 3.12Å; R323-V327 VanDerWaalsContact O-CG2 3.25Å; R323-V327 WeakPolarHBondContact O-CG2 3.49Å; R323-V327 PolarHBondContact O-N 2.88Å; R323-T352 WeakPolarHBondContact CD-O 3.23Å; R323-V353 HydrophobicContact CB-CG2 4.06Å
324	Y	97.7	Very high	96.4	Very high	131 Å²	131	40.5 Å²	40.5	51%	0.514	19%	0.192	S	C	.	.	H	α-helix	trans	-67.4	-44.7	-179.9	-175.7	-103.7	0	0	0	112.5	T320 K321 W322 H326 V327 C328 V353	T320-Y324 WeakPolarHBondContact O-CB 3.46Å; T320-Y324 PolarHBondContact O-N 3.44Å; K321-Y324 PolarHBondContact O-N 3.09Å; W322-Y324 VanDerWaalsContact C-N 3.32Å; W322-Y324 PolarHBondContact O-N 3.21Å; Y324-H326 VanDerWaalsContact C-N 3.28Å; Y324-H326 PolarHBondContact O-N 3.02Å; Y324-V327 VanDerWaalsContact O-CB 3.32Å; Y324-V327 WeakPolarHBondContact O-CB 3.44Å; Y324-V327 PolarHBondContact O-N 2.88Å; Y324-V327 VanDerWaalsContact O-N 3.1Å; Y324-C328 PolarHBondContact O-N 3.01Å; Y324-C328 PolarHBondContact O-SG 3.47Å; Y324-C328 VanDerWaalsContact O-SG 3.38Å; Y324-V353 HydrophobicContact CD2-CG1 4.25Å; Y324-V353 HydrophobicContact CD2-CG2 4.46Å
325	N	97.5	Very high	96.1	Very high	48 Å²	48	39.3 Å²	39.3	26%	0.257	19%	0.191	S	C	.	.	H	α-helix	trans	-61.2	-40.8	174.5	-77.2	20.9	0	0	0	111	V124 F127 K321 W322 V327 C328 I329	V124-N325 WeakPolarHBondContact CG1-ND2 3.37Å; V124-N325 PolarHBondContact O-ND2 2.73Å; F127-N325 HydrophobicContact CB-CB 4.49Å; F127-N325 HydrophobicContact CD2-CB 3.47Å; F127-N325 VanDerWaalsContact CD2-CB 3.47Å; F127-N325 HydrophobicContact CE2-CB 3.9Å; F127-N325 HydrophobicContact CG-CB 4.15Å; K321-N325 PolarHBondContact O-N 3.41Å; K321-N325 PolarHBondContact O-OD1 3.48Å; W322-N325 PolarHBondContact O-N 3.5Å; N325-V327 VanDerWaalsContact C-N 3.35Å; N325-V327 PolarHBondContact O-N 3.34Å; N325-C328 PolarHBondContact O-N 3.03Å; N325-I329 PolarHBondContact O-N 3.45Å
326	H	96.3	Very high	95.7	Very high	56 Å²	56	43.7 Å²	43.7	26%	0.259	22%	0.222	S	C	.	.	H	α-helix	trans	-58.5	-45.1	172.4	-176.6	-139.1	0	0	0	112	F127 W322 R323 Y324 C328 I329 V330	F127-H326 HydrophobicContact CE1-CB 4.19Å; F127-H326 HydrophobicContact CE2-CB 4.24Å; F127-H326 HydrophobicContact CZ-CB 3.6Å; W322-H326 WeakPolarHBondContact O-CB 3.25Å; W322-H326 PolarHBondContact O-N 3.27Å; R323-H326 WeakPolarHBondContact O-CB 3.41Å; R323-H326 PolarHBondContact O-N 3.12Å; Y324-H326 VanDerWaalsContact C-N 3.28Å; Y324-H326 PolarHBondContact O-N 3.02Å; H326-C328 VanDerWaalsContact C-N 3.34Å; H326-C328 PolarHBondContact O-N 3.34Å; H326-I329 PolarHBondContact O-N 3.41Å; H326-V330 WeakPolarHBondContact O-CG2 3.42Å; H326-V330 PolarHBondContact O-N 3.12Å
327	V	95.6	Very high	95	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-56.8	-46.3	175	167.9	0	0	0	0	111.5	R323 Y324 N325 V330 H331 Y346 L349 R350 V353	R323-V327 VanDerWaalsContact O-CG2 3.25Å; R323-V327 WeakPolarHBondContact O-CG2 3.49Å; R323-V327 PolarHBondContact O-N 2.88Å; Y324-V327 VanDerWaalsContact O-CB 3.32Å; Y324-V327 WeakPolarHBondContact O-CB 3.44Å; Y324-V327 PolarHBondContact O-N 2.88Å; Y324-V327 VanDerWaalsContact O-N 3.1Å; N325-V327 VanDerWaalsContact C-N 3.35Å; N325-V327 PolarHBondContact O-N 3.34Å; V327-V330 PolarHBondContact O-N 3.45Å; V327-H331 WeakPolarHBondContact O-CB 3.04Å; V327-H331 PolarHBondContact O-N 2.97Å; V327-Y346 HydrophobicContact CG1-CD2 3.7Å; V327-Y346 HydrophobicContact CG1-CE2 3.46Å; V327-Y346 VanDerWaalsContact CG1-CE2 3.46Å; V327-L349 HydrophobicContact CG2-CB 3.51Å; V327-L349 WeakPolarHBondContact CG2-O 3.33Å; V327-R350 HydrophobicContact CG1-CB 4.26Å; V327-V353 HydrophobicContact CG2-CG2 4.01Å
328	C	96.1	Very high	94.4	Very high	50 Å²	50	49 Å²	49	34%	0.338	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-44.4	179.6	-68.8	0	0	0	0	111.9	Y324 N325 H326 H331 R332	Y324-C328 PolarHBondContact O-N 3.01Å; Y324-C328 PolarHBondContact O-SG 3.47Å; Y324-C328 VanDerWaalsContact O-SG 3.38Å; N325-C328 PolarHBondContact O-N 3.03Å; H326-C328 VanDerWaalsContact C-N 3.34Å; H326-C328 PolarHBondContact O-N 3.34Å; C328-H331 PolarHBondContact O-N 3.41Å; C328-R332 PolarHBondContact O-N 3.05Å
329	I	94.9	Very high	93.5	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.036	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-46.7	177.2	-74.8	167.6	0	0	0	111.2	F127 E131 N325 H326 H331 R332 M333	F127-I329 HydrophobicContact CB-CD1 3.49Å; F127-I329 VanDerWaalsContact CB-CD1 3.49Å; F127-I329 HydrophobicContact CD1-CD1 3.14Å; F127-I329 HydrophobicContact CE1-CD1 4.03Å; F127-I329 HydrophobicContact CG-CD1 3.53Å; E131-I329 HydrophobicContact CG-CD1 3.7Å; E131-I329 HydrophobicContact CG-CG1 3.65Å; E131-I329 WeakPolarHBondContact OE1-CG1 3.32Å; N325-I329 PolarHBondContact O-N 3.45Å; H326-I329 PolarHBondContact O-N 3.41Å; I329-H331 VanDerWaalsContact C-N 3.27Å; I329-H331 PolarHBondContact O-N 3.3Å; I329-R332 PolarHBondContact O-N 3.38Å; I329-R332 VanDerWaalsContact O-N 3.09Å; I329-M333 HydrophobicContact CG2-CE 4.47Å; I329-M333 HydrophobicContact CG2-CG 3.97Å; I329-M333 WeakPolarHBondContact O-CB 3.46Å; I329-M333 VanDerWaalsContact O-CG 3.25Å; I329-M333 WeakPolarHBondContact O-CG 3.39Å; I329-M333 PolarHBondContact O-N 3.25Å
330	V	93.4	Very high	92.6	Very high	22 Å²	22	51.1 Å²	51.1	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-40.7	178.6	173.1	0	0	0	0	110.6	H326 V327 R332 M333 I334 L349	H326-V330 WeakPolarHBondContact O-CG2 3.42Å; H326-V330 PolarHBondContact O-N 3.12Å; V327-V330 PolarHBondContact O-N 3.45Å; V330-R332 VanDerWaalsContact C-N 3.31Å; V330-R332 PolarHBondContact O-N 3Å; V330-M333 PolarHBondContact O-N 3.05Å; V330-I334 HydrophobicContact CG1-CD1 3.6Å; V330-I334 HydrophobicContact CG1-CG1 3.64Å; V330-I334 VanDerWaalsContact O-CG1 3.27Å; V330-I334 WeakPolarHBondContact O-CG1 3.22Å; V330-I334 PolarHBondContact O-N 3.26Å; V330-L349 HydrophobicContact CB-CD1 3.84Å; V330-L349 HydrophobicContact CG1-CD1 3.84Å; V330-L349 HydrophobicContact CG2-CD1 3.6Å
331	H	94.7	Very high	91.4	Very high	91 Å²	91	50.2 Å²	50.2	42%	0.421	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-42.6	175.3	-168.5	-156.3	0	0	0	111.9	V327 C328 I329 G335 Y346	V327-H331 WeakPolarHBondContact O-CB 3.04Å; V327-H331 PolarHBondContact O-N 2.97Å; C328-H331 PolarHBondContact O-N 3.41Å; I329-H331 VanDerWaalsContact C-N 3.27Å; I329-H331 PolarHBondContact O-N 3.3Å; H331-G335 WeakPolarHBondContact O-CA 3.37Å; H331-G335 PolarHBondContact O-N 3.2Å; H331-Y346 HydrophobicContact CB-CD2 3.6Å; H331-Y346 HydrophobicContact CB-CE2 3.83Å; H331-Y346 HydrophobicContact CB-CG 4.3Å; H331-Y346 AromaticContact CG-CD2 3.9Å; H331-Y346 AromaticContact CG-CE2 3.85Å
332	R	93.8	Very high	90.1	Very high	110 Å²	110	47.9 Å²	47.9	42%	0.415	27%	0.269	S	S	.	.	H	α-helix	trans	-66.9	-39.3	175.9	-171.9	171.4	65.3	103.5	15.8	112.8	E131 M133 A135 C328 I329 V330	E131-R332 VanDerWaalsContact O-CZ 3.28Å; E131-R332 PolarHBondContact O-NH1 3.31Å; E131-R332 PolarHBondContact O-NH2 3.39Å; M133-R332 PolarHBondContact O-NH1 2.88Å; M133-R332 PolarHBondContact O-NH2 3.16Å; A135-R332 WeakPolarHBondContact CB-O 3.48Å; C328-R332 PolarHBondContact O-N 3.05Å; I329-R332 PolarHBondContact O-N 3.38Å; I329-R332 VanDerWaalsContact O-N 3.09Å; V330-R332 VanDerWaalsContact C-N 3.31Å; V330-R332 PolarHBondContact O-N 3Å
333	M	93.1	Very high	89.1	Confident	20 Å²	20	46.9 Å²	46.9	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-78.9	-37.7	-174.3	-69.4	-62.7	-173.1	0	0	113.7	M133 F138 I329 V330	M133-M333 HydrophobicContact CB-CE 4.1Å; M133-M333 HydrophobicContact CE-CE 3.51Å; M133-M333 HydrophobicContact CE-SD 4.2Å; M133-M333 HydrophobicContact CG-CE 4.21Å; M133-M333 WeakPolarHBondContact O-CE 3.32Å; F138-M333 HydrophobicContact CB-SD 3.87Å; F138-M333 HydrophobicContact CD1-CB 3.96Å; F138-M333 HydrophobicContact CD1-SD 4.37Å; F138-M333 HydrophobicContact CE1-CB 4.24Å; F138-M333 HydrophobicContact CG-SD 4.14Å; I329-M333 HydrophobicContact CG2-CE 4.47Å; I329-M333 HydrophobicContact CG2-CG 3.97Å; I329-M333 WeakPolarHBondContact O-CB 3.46Å; I329-M333 VanDerWaalsContact O-CG 3.25Å; I329-M333 WeakPolarHBondContact O-CG 3.39Å; I329-M333 PolarHBondContact O-N 3.25Å; V330-M333 PolarHBondContact O-N 3.05Å
334	I	90.8	Very high	88.2	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.108	28%	0.284	C	S	.	.	H	α-helix	trans	-128.3	-5	-173.8	68.5	170.9	0	0	0	114.8	F138 V330 S336 K337	F138-I334 HydrophobicContact CD1-CG2 4.32Å; F138-I334 HydrophobicContact CE1-CG2 3.66Å; V330-I334 HydrophobicContact CG1-CD1 3.6Å; V330-I334 HydrophobicContact CG1-CG1 3.64Å; V330-I334 VanDerWaalsContact O-CG1 3.27Å; V330-I334 WeakPolarHBondContact O-CG1 3.22Å; V330-I334 PolarHBondContact O-N 3.26Å; I334-S336 PolarHBondContact O-N 3.34Å; I334-K337 HydrophobicContact CB-CB 4.31Å; I334-K337 WeakPolarHBondContact CD1-O 3.32Å; I334-K337 VanDerWaalsContact O-CB 3.25Å; I334-K337 WeakPolarHBondContact O-CB 3.36Å; I334-K337 VanDerWaalsContact O-CG 3.3Å; I334-K337 WeakPolarHBondContact O-CG 3.33Å; I334-K337 PolarHBondContact O-N 2.98Å
335	G	92	Very high	87.5	Confident	23 Å²	23	43.1 Å²	43.1	24%	0.237	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-129.2	-176.1	0	0	0	0	0	111.5	H331	H331-G335 WeakPolarHBondContact O-CA 3.37Å; H331-G335 PolarHBondContact O-N 3.2Å
336	S	88.4	Confident	87.1	Confident	93 Å²	93	42.1 Å²	42.1	65%	0.65	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	8.2	176.1	-48	0	0	0	0	114.2	I334	I334-S336 PolarHBondContact O-N 3.34Å
337	K	85	Confident	86.6	Confident	114 Å²	114	44.5 Å²	44.5	50%	0.496	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-67	147.4	178.5	-64.9	174.9	179.9	174.5	0	110.2	I334	I334-K337 HydrophobicContact CB-CB 4.31Å; I334-K337 WeakPolarHBondContact CD1-O 3.32Å; I334-K337 VanDerWaalsContact O-CB 3.25Å; I334-K337 WeakPolarHBondContact O-CB 3.36Å; I334-K337 VanDerWaalsContact O-CG 3.3Å; I334-K337 WeakPolarHBondContact O-CG 3.33Å; I334-K337 PolarHBondContact O-N 2.98Å
338	A	84.8	Confident	86.3	Confident	59 Å²	59	45.3 Å²	45.3	49%	0.488	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-61.8	145	172.7	0	0	0	0	0	111.4	R142 S343	R142-A338 PolarHBondContact NH2-O 3.33Å; A338-S343 CarbonylContact C-O 3.15Å; A338-S343 VanDerWaalsContact CA-O 3.23Å; A338-S343 WeakPolarHBondContact CA-O 3.27Å; A338-S343 WeakPolarHBondContact CB-O 3.46Å
339	G	80.4	Confident	86.1	Confident	17 Å²	17	44.1 Å²	44.1	18%	0.175	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-70.7	159.8	176.1	0	0	0	0	0	112.6	G341 G342 S343	G339-G341 VanDerWaalsContact C-N 3.26Å; G339-G341 PolarHBondContact O-N 3.25Å; G339-G342 WeakPolarHBondContact O-CA 3.13Å; G339-G342 PolarHBondContact O-N 2.91Å; G339-S343 PolarHBondContact N-O 2.89Å
340	T	77.6	Confident	86.1	Confident	45 Å²	45	51 Å²	51	28%	0.276	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.7	176	48.2	0	0	0	0	112.5	R142 M146 A148 G342	R142-T340 HydrophobicContact CG-CG2 4.47Å; M146-T340 WeakPolarHBondContact O-CB 3.29Å; A148-T340 PolarHBondContact O-OG1 2.86Å; T340-G342 PolarHBondContact O-N 3.37Å; T340-G342 VanDerWaalsContact O-N 3.11Å
341	G	72.6	Confident	86.1	Confident	13 Å²	13	52 Å²	52	13%	0.134	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	11.1	170.5	0	0	0	0	0	114.9	Y173 G339 S343	Y173-G341 PolarHBondContact OH-O 3.34Å; G339-G341 VanDerWaalsContact C-N 3.26Å; G339-G341 PolarHBondContact O-N 3.25Å; G341-S343 PolarHBondContact O-N 2.95Å
342	G	72.5	Confident	86	Confident	43 Å²	43	48 Å²	48	44%	0.443	27%	0.273	S	S	.	.	S	Bend	trans	83.3	-1.1	177.7	0	0	0	0	0	115.7	Y173 G339 T340	Y173-G342 WeakPolarHBondContact OH-CA 3.45Å; Y173-G342 PolarHBondContact OH-O 3.39Å; G339-G342 WeakPolarHBondContact O-CA 3.13Å; G339-G342 PolarHBondContact O-N 2.91Å; T340-G342 PolarHBondContact O-N 3.37Å; T340-G342 VanDerWaalsContact O-N 3.11Å
343	S	76.8	Confident	86.2	Confident	7 Å²	7	44.9 Å²	44.9	5%	0.049	27%	0.266	C	S	.	.	S	Bend	trans	-74.9	166.5	-171.4	75.1	0	0	0	0	112.1	Y173 A338 G339 G341 G345	Y173-S343 WeakPolarHBondContact OH-CA 3.34Å; Y173-S343 PolarHBondContact OH-N 3.03Å; A338-S343 CarbonylContact C-O 3.15Å; A338-S343 VanDerWaalsContact CA-O 3.23Å; A338-S343 WeakPolarHBondContact CA-O 3.27Å; A338-S343 WeakPolarHBondContact CB-O 3.46Å; G339-S343 PolarHBondContact N-O 2.89Å; G341-S343 PolarHBondContact O-N 2.95Å; S343-G345 PolarHBondContact O-N 3.26Å; S343-G345 WeakPolarHBondContact OG-CA 3.22Å; S343-G345 PolarHBondContact OG-N 3Å
344	S	78.4	Confident	86.3	Confident	60 Å²	60	46 Å²	46	42%	0.42	28%	0.276	S	S	.	.			trans	-62.7	6	165.7	59.2	0	0	0	0	112.7	Y346 Y348	S344-Y346 PolarHBondContact O-N 3.45Å; S344-Y348 PolarHBondContact OG-N 2.98Å; S344-Y348 VanDerWaalsContact OG-N 3.12Å
345	G	83.9	Confident	86.5	Confident	2 Å²	2	49.2 Å²	49.2	2%	0.021	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-113.5	175	0	0	0	0	0	109.8	S343 H347 Y348 L349	S343-G345 PolarHBondContact O-N 3.26Å; S343-G345 WeakPolarHBondContact OG-CA 3.22Å; S343-G345 PolarHBondContact OG-N 3Å; G345-H347 VanDerWaalsContact C-N 3.32Å; G345-H347 PolarHBondContact O-N 3.31Å; G345-Y348 PolarHBondContact O-N 3.06Å; G345-L349 WeakPolarHBondContact O-CG 3.26Å; G345-L349 PolarHBondContact O-N 3.44Å
346	Y	87.6	Confident	86.7	Confident	28 Å²	28	54.1 Å²	54.1	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-51.1	-45.2	179.1	166	-110.1	0	0	0	113.8	V327 H331 S344 Y348 L349 R350	V327-Y346 HydrophobicContact CG1-CD2 3.7Å; V327-Y346 HydrophobicContact CG1-CE2 3.46Å; V327-Y346 VanDerWaalsContact CG1-CE2 3.46Å; H331-Y346 HydrophobicContact CB-CD2 3.6Å; H331-Y346 HydrophobicContact CB-CE2 3.83Å; H331-Y346 HydrophobicContact CB-CG 4.3Å; H331-Y346 AromaticContact CG-CD2 3.9Å; H331-Y346 AromaticContact CG-CE2 3.85Å; S344-Y346 PolarHBondContact O-N 3.45Å; Y346-Y348 PolarHBondContact O-N 3Å; Y346-L349 PolarHBondContact O-N 2.85Å; Y346-R350 WeakPolarHBondContact O-CB 3.46Å; Y346-R350 PolarHBondContact O-N 3.2Å; Y346-R350 PolarHBondContact OH-NH1 3Å
347	H	87.3	Confident	87.1	Confident	106 Å²	106	50 Å²	50	49%	0.491	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-40.7	-175.1	-70.8	-67.1	0	0	0	113	G345 S351	G345-H347 VanDerWaalsContact C-N 3.32Å; G345-H347 PolarHBondContact O-N 3.31Å; H347-S351 PolarHBondContact O-N 3.47Å
348	Y	89.1	Confident	87.7	Confident	21 Å²	21	46.2 Å²	46.2	8%	0.082	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-51.7	172.9	166.1	-97.6	0	0	0	110.6	F151 Y173 S344 G345 Y346 R350 S351 T352	F151-Y348 HydrophobicContact CE1-CD1 4.18Å; F151-Y348 AromaticContact CE1-CE1 3.37Å; F151-Y348 HydrophobicContact CE1-CE1 3.37Å; F151-Y348 HydrophobicContact CE1-CE2 4.3Å; F151-Y348 AromaticContact CE1-CZ 3.44Å; F151-Y348 VanDerWaalsContact CE1-CZ 3.44Å; F151-Y348 WeakPolarHBondContact CE1-OH 3.36Å; F151-Y348 HydrophobicContact CE2-CD1 4.44Å; F151-Y348 HydrophobicContact CE2-CE1 4.29Å; F151-Y348 AromaticContact CZ-CD1 3.52Å; F151-Y348 HydrophobicContact CZ-CD1 3.52Å; F151-Y348 AromaticContact CZ-CE1 3.17Å; F151-Y348 HydrophobicContact CZ-CE1 3.17Å; F151-Y348 HydrophobicContact CZ-CE2 4.38Å; F151-Y348 HydrophobicContact CZ-CG 4.27Å; F151-Y348 AromaticContact CZ-CZ 3.66Å; Y173-Y348 HydrophobicContact CG-CD2 4.32Å; Y173-Y348 HydrophobicContact CG-CE2 4.41Å; S344-Y348 PolarHBondContact OG-N 2.98Å; S344-Y348 VanDerWaalsContact OG-N 3.12Å; G345-Y348 PolarHBondContact O-N 3.06Å; Y346-Y348 PolarHBondContact O-N 3Å; Y348-R350 VanDerWaalsContact C-N 3.26Å; Y348-R350 PolarHBondContact O-N 3.02Å; Y348-S351 WeakPolarHBondContact O-CB 3.3Å; Y348-S351 PolarHBondContact O-N 2.93Å; Y348-S351 PolarHBondContact O-OG 3.31Å; Y348-T352 HydrophobicContact CE1-CG2 3.99Å; Y348-T352 HydrophobicContact CE2-CG2 4.28Å; Y348-T352 PolarHBondContact O-N 2.98Å
349	L	91.2	Very high	88.3	Confident	24 Å²	24	43.5 Å²	43.5	13%	0.126	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-40.3	-177.8	-66.5	173.6	0	0	0	111.4	V327 V330 G345 Y346 S351 T352	V327-L349 HydrophobicContact CG2-CB 3.51Å; V327-L349 WeakPolarHBondContact CG2-O 3.33Å; V330-L349 HydrophobicContact CB-CD1 3.84Å; V330-L349 HydrophobicContact CG1-CD1 3.84Å; V330-L349 HydrophobicContact CG2-CD1 3.6Å; G345-L349 WeakPolarHBondContact O-CG 3.26Å; G345-L349 PolarHBondContact O-N 3.44Å; Y346-L349 PolarHBondContact O-N 2.85Å; L349-S351 VanDerWaalsContact C-N 3.28Å; L349-S351 PolarHBondContact O-N 3.39Å; L349-T352 WeakPolarHBondContact O-CB 3.34Å; L349-T352 PolarHBondContact O-N 3.46Å; L349-T352 PolarHBondContact O-OG1 3.44Å
350	R	94	Very high	89.2	Confident	151 Å²	151	42.7 Å²	42.7	57%	0.57	23%	0.228	S	C	*	.	H	α-helix	trans	-59.7	-37.2	175.5	-174.3	177.5	175	126.6	0.1	112.4	V327 Y346 Y348 T352 V353	V327-R350 HydrophobicContact CG1-CB 4.26Å; Y346-R350 WeakPolarHBondContact O-CB 3.46Å; Y346-R350 PolarHBondContact O-N 3.2Å; Y346-R350 PolarHBondContact OH-NH1 3Å; Y348-R350 VanDerWaalsContact C-N 3.26Å; Y348-R350 PolarHBondContact O-N 3.02Å; R350-T352 PolarHBondContact O-N 3.16Å; R350-V353 PolarHBondContact O-N 2.89Å; R350-V353 VanDerWaalsContact O-N 3.13Å
351	S	93.4	Very high	90.2	Very high	44 Å²	44	40.9 Å²	40.9	31%	0.308	22%	0.217	S	C	.	.	H	α-helix	trans	-66.1	-21.7	176	77.8	0	0	0	0	113.6	V171 H347 Y348 L349 V353	V171-S351 WeakPolarHBondContact CG1-OG 3.45Å; H347-S351 PolarHBondContact O-N 3.47Å; Y348-S351 WeakPolarHBondContact O-CB 3.3Å; Y348-S351 PolarHBondContact O-N 2.93Å; Y348-S351 PolarHBondContact O-OG 3.31Å; L349-S351 VanDerWaalsContact C-N 3.28Å; L349-S351 PolarHBondContact O-N 3.39Å; S351-V353 VanDerWaalsContact C-N 3.28Å
352	T	94	Very high	91.4	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.037	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.7	175.2	75.8	0	0	0	0	113.2	R323 Y348 L349 R350 S354 Y357	R323-T352 WeakPolarHBondContact CD-O 3.23Å; Y348-T352 HydrophobicContact CE1-CG2 3.99Å; Y348-T352 HydrophobicContact CE2-CG2 4.28Å; Y348-T352 PolarHBondContact O-N 2.98Å; L349-T352 WeakPolarHBondContact O-CB 3.34Å; L349-T352 PolarHBondContact O-N 3.46Å; L349-T352 PolarHBondContact O-OG1 3.44Å; R350-T352 PolarHBondContact O-N 3.16Å; T352-S354 VanDerWaalsContact C-N 3.27Å; T352-S354 PolarHBondContact O-N 3.33Å; T352-S354 VanDerWaalsContact O-N 3.1Å; T352-Y357 HydrophobicContact CG2-CE2 4.2Å; T352-Y357 WeakPolarHBondContact O-CD2 3.22Å
353	V	96.7	Very high	92.6	Very high	46 Å²	46	38.4 Å²	38.4	28%	0.279	19%	0.19	S	C	.	.	S	Bend	trans	-85.3	74.8	172	-170.7	0	0	0	0	108.1	T320 R323 Y324 V327 R350 S351	T320-V353 HydrophobicContact CG2-CG1 3.91Å; R323-V353 HydrophobicContact CB-CG2 4.06Å; Y324-V353 HydrophobicContact CD2-CG1 4.25Å; Y324-V353 HydrophobicContact CD2-CG2 4.46Å; V327-V353 HydrophobicContact CG2-CG2 4.01Å; R350-V353 PolarHBondContact O-N 2.89Å; R350-V353 VanDerWaalsContact O-N 3.13Å; S351-V353 VanDerWaalsContact C-N 3.28Å
354	S	95.3	Very high	93.7	Very high	44 Å²	44	41.1 Å²	41.1	31%	0.308	20%	0.201	S	C	.	.	S	Bend	trans	-151.8	152.7	-174.2	175.6	0	0	0	0	110.5	T352 R356 Y357	T352-S354 VanDerWaalsContact C-N 3.27Å; T352-S354 PolarHBondContact O-N 3.33Å; T352-S354 VanDerWaalsContact O-N 3.1Å; S354-R356 PolarHBondContact O-N 3.33Å; S354-R356 PolarHBondContact OG-N 2.98Å; S354-Y357 PolarHBondContact O-N 3.45Å
355	D	96.3	Very high	94.5	Very high	88 Å²	88	41.7 Å²	41.7	47%	0.471	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-60.9	-11.6	174.4	-67.3	-27	0	0	0	113.7	Y357 K358 V361	D355-Y357 PolarHBondContact O-N 2.87Å; D355-K358 PolarHBondContact O-N 3.24Å; D355-K358 VanDerWaalsContact O-N 3.12Å; D355-K358 VanDerWaalsContact OD1-CE 3.28Å; D355-K358 WeakPolarHBondContact OD1-CE 3.49Å; D355-K358 IonicContact OD1-NZ 3.91Å; D355-K358 PolarHBondContact OD1-NZ 3.47Å; D355-V361 HydrophobicContact CB-CG2 4.38Å
356	R	95.3	Very high	95.1	Very high	126 Å²	126	41.6 Å²	41.6	48%	0.475	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-54.9	-34.1	167	-71	178.6	176.7	-107.5	-2.9	112.9	L169 S354	L169-R356 HydrophobicContact CB-CB 4.42Å; S354-R356 PolarHBondContact O-N 3.33Å; S354-R356 PolarHBondContact OG-N 2.98Å
357	Y	96.8	Very high	95.4	Very high	5 Å²	5	43.2 Å²	43.2	2%	0.02	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-97.4	1	179.5	-70.3	-91.6	0	0	0	113.5	V165 R170 V171 T352 S354 D355	V165-Y357 HydrophobicContact CG1-CD1 3.79Å; V165-Y357 HydrophobicContact CG1-CE1 4.18Å; R170-Y357 HydrophobicContact CG-CE1 4.36Å; V171-Y357 HydrophobicContact CG2-CE2 4.13Å; V171-Y357 PolarHBondContact N-OH 3.28Å; T352-Y357 HydrophobicContact CG2-CE2 4.2Å; T352-Y357 WeakPolarHBondContact O-CD2 3.22Å; S354-Y357 PolarHBondContact O-N 3.45Å; D355-Y357 PolarHBondContact O-N 2.87Å
358	K	97.8	Very high	95.7	Very high	35 Å²	35	41.9 Å²	41.9	15%	0.152	22%	0.217	C	C	.	.			trans	-87.9	108.9	177.2	-173.5	-179.3	-77.7	163.6	0	108.6	D316 D355 V361 F364	D316-K358 HydrophobicContact CB-CG 4.05Å; D316-K358 WeakPolarHBondContact OD2-CG 3.26Å; D355-K358 PolarHBondContact O-N 3.24Å; D355-K358 VanDerWaalsContact O-N 3.12Å; D355-K358 VanDerWaalsContact OD1-CE 3.28Å; D355-K358 WeakPolarHBondContact OD1-CE 3.49Å; D355-K358 IonicContact OD1-NZ 3.91Å; D355-K358 PolarHBondContact OD1-NZ 3.47Å; K358-V361 HydrophobicContact CB-CB 4.27Å; K358-V361 HydrophobicContact CD-CB 3.97Å; K358-V361 HydrophobicContact CD-CG2 4.01Å; K358-V361 HydrophobicContact CG-CB 4.03Å; K358-F364 HydrophobicContact CD-CD2 3.74Å; K358-F364 HydrophobicContact CD-CE2 3.7Å; K358-F364 HydrophobicContact CD-CG 4.38Å; K358-F364 HydrophobicContact CD-CZ 4.31Å; K358-F364 HydrophobicContact CG-CD2 4.41Å; K358-F364 HydrophobicContact CG-CE2 4.06Å
359	V	98.1	Very high	95.9	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.012	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-38.8	-168.9	176.3	0	0	0	0	111.6	I163 V165 L200 R281 D316	I163-V359 HydrophobicContact CG2-CB 3.94Å; I163-V359 HydrophobicContact CG2-CG1 4.06Å; I163-V359 HydrophobicContact CG2-CG2 3.82Å; V165-V359 HydrophobicContact CB-CG2 4.46Å; V165-V359 HydrophobicContact CG2-CG2 3.64Å; L200-V359 HydrophobicContact CB-CG1 3.67Å; L200-V359 HydrophobicContact CD1-CG1 4.19Å; L200-V359 HydrophobicContact CD2-CG1 3.9Å; L200-V359 HydrophobicContact CG-CG1 4.12Å; R281-V359 WeakPolarHBondContact CG-O 3.38Å; D316-V359 PolarHBondContact OD1-N 3.47Å; D316-V359 PolarHBondContact OD2-N 2.87Å; D316-V359 VanDerWaalsContact OD2-N 3.12Å
360	F	98.4	Very high	96	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	35.1	178.8	-58.4	-79.5	0	0	0	111.9	I163 L199 L200 V203 L312 M315 D316 D362 L363 F364	I163-F360 HydrophobicContact CG2-CE2 4.06Å; L199-F360 HydrophobicContact CD2-CZ 4.24Å; L199-F360 HydrophobicContact CG-CZ 4.15Å; L200-F360 HydrophobicContact CB-CE1 4.48Å; L200-F360 HydrophobicContact CD1-CD1 4.1Å; L200-F360 HydrophobicContact CD1-CE1 4Å; V203-F360 HydrophobicContact CB-CE1 4.29Å; V203-F360 HydrophobicContact CG1-CE1 4.29Å; V203-F360 HydrophobicContact CG2-CE1 4.42Å; L312-F360 HydrophobicContact CB-CD1 4.39Å; L312-F360 HydrophobicContact CB-CD2 4Å; L312-F360 HydrophobicContact CB-CE2 4.21Å; L312-F360 HydrophobicContact CB-CG 4.1Å; L312-F360 HydrophobicContact CB-CZ 4.49Å; L312-F360 HydrophobicContact CD1-CD1 4.22Å; L312-F360 HydrophobicContact CD1-CE1 3.91Å; L312-F360 HydrophobicContact CD1-CZ 4.19Å; L312-F360 HydrophobicContact CD2-CD2 4.5Å; L312-F360 HydrophobicContact CD2-CE1 4.34Å; L312-F360 HydrophobicContact CD2-CE2 3.85Å; L312-F360 HydrophobicContact CD2-CZ 3.76Å; L312-F360 HydrophobicContact CG-CE2 4.46Å; L312-F360 HydrophobicContact CG-CZ 4.36Å; M315-F360 HydrophobicContact CE-CD2 4.48Å; M315-F360 HydrophobicContact CE-CE2 3.82Å; D316-F360 WeakPolarHBondContact OD2-CA 3.46Å; D316-F360 WeakPolarHBondContact OD2-CB 3.35Å; D316-F360 PolarHBondContact OD2-N 2.87Å; F360-D362 PolarHBondContact O-N 2.72Å; F360-D362 VanDerWaalsContact O-N 3.11Å; F360-L363 HydrophobicContact CB-CD1 3.86Å; F360-L363 HydrophobicContact CB-CG 4.08Å; F360-L363 HydrophobicContact CD1-CD1 4.19Å; F360-L363 HydrophobicContact CG-CD1 4.28Å; F360-L363 WeakPolarHBondContact O-CB 3.36Å; F360-L363 PolarHBondContact O-N 2.68Å; F360-F364 WeakPolarHBondContact O-CD2 3.41Å
361	V	98.4	Very high	96.1	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.036	21%	0.213	C	C	.	.	H	α-helix	trans	-53.1	-33.8	-178.9	65.4	0	0	0	0	112.9	R281 D355 K358 L363 F364 N365	R281-V361 HydrophobicContact CG-CG1 3.83Å; D355-V361 HydrophobicContact CB-CG2 4.38Å; K358-V361 HydrophobicContact CB-CB 4.27Å; K358-V361 HydrophobicContact CD-CB 3.97Å; K358-V361 HydrophobicContact CD-CG2 4.01Å; K358-V361 HydrophobicContact CG-CB 4.03Å; V361-L363 VanDerWaalsContact C-N 3.3Å; V361-L363 PolarHBondContact O-N 2.83Å; V361-F364 WeakPolarHBondContact O-CB 3.49Å; V361-F364 PolarHBondContact O-N 3.28Å; V361-N365 PolarHBondContact O-N 3.2Å; V361-N365 VanDerWaalsContact O-N 3.17Å
362	D	98.3	Very high	96.2	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-36.1	178.4	-62.6	-49.9	0	0	0	112.7	R280 R281 L282 L287 F360 F364 N365 L366	R280-D362 VanDerWaalsContact CA-OD1 3.29Å; R280-D362 WeakPolarHBondContact CA-OD1 3.45Å; R280-D362 VanDerWaalsContact CB-OD1 3.28Å; R280-D362 WeakPolarHBondContact CB-OD1 3.49Å; R280-D362 VanDerWaalsContact CG-OD1 3.31Å; R280-D362 WeakPolarHBondContact CG-OD1 3.48Å; R281-D362 VanDerWaalsContact CA-OD2 3.31Å; R281-D362 WeakPolarHBondContact CA-OD2 3.42Å; R281-D362 WeakPolarHBondContact CB-OD2 3.35Å; R281-D362 PolarHBondContact N-OD2 3.48Å; L282-D362 HydrophobicContact CD1-CB 3.94Å; L282-D362 HydrophobicContact CG-CB 4.22Å; L282-D362 PolarHBondContact N-OD2 3.1Å; L287-D362 HydrophobicContact CD1-CB 4.01Å; F360-D362 PolarHBondContact O-N 2.72Å; F360-D362 VanDerWaalsContact O-N 3.11Å; D362-F364 VanDerWaalsContact C-N 3.27Å; D362-F364 PolarHBondContact O-N 3.21Å; D362-N365 CarbonylContact O-C 3.53Å; D362-N365 PolarHBondContact O-N 3.24Å; D362-N365 VanDerWaalsContact O-N 3.1Å; D362-L366 WeakPolarHBondContact O-CG 3.39Å; D362-L366 PolarHBondContact O-N 3.2Å
363	L	98.5	Very high	96.1	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-34.1	178.8	-60.1	-173.9	0	0	0	112	L282 A290 Y294 L309 L312 M313 F360 V361 L366	L282-L363 HydrophobicContact CD1-CD2 4.17Å; A290-L363 HydrophobicContact CB-CD2 3.96Å; Y294-L363 PolarHBondContact OH-O 2.82Å; L309-L363 HydrophobicContact CB-CD1 4.28Å; L309-L363 HydrophobicContact CD2-CD1 4.03Å; L309-L363 HydrophobicContact CD2-CD2 4.18Å; L312-L363 HydrophobicContact CB-CD1 4.2Å; L312-L363 HydrophobicContact CD1-CD1 4.48Å; M313-L363 HydrophobicContact CG-CB 3.62Å; M313-L363 HydrophobicContact CG-CD1 4.15Å; M313-L363 HydrophobicContact SD-CB 3.82Å; F360-L363 HydrophobicContact CB-CD1 3.86Å; F360-L363 HydrophobicContact CB-CG 4.08Å; F360-L363 HydrophobicContact CD1-CD1 4.19Å; F360-L363 HydrophobicContact CG-CD1 4.28Å; F360-L363 WeakPolarHBondContact O-CB 3.36Å; F360-L363 PolarHBondContact O-N 2.68Å; V361-L363 VanDerWaalsContact C-N 3.3Å; V361-L363 PolarHBondContact O-N 2.83Å; L363-L366 HydrophobicContact CD2-CD1 4.22Å
364	F	98.2	Very high	96	Very high	63 Å²	63	49.9 Å²	49.9	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-70	-43.9	172.9	-65.7	-97.2	0	0	0	111	M313 D316 K358 F360 V361 D362 L366 A367	M313-F364 HydrophobicContact CB-CE1 4.12Å; M313-F364 HydrophobicContact CB-CE2 3.86Å; M313-F364 HydrophobicContact CB-CZ 3.64Å; M313-F364 HydrophobicContact CG-CD2 4.03Å; M313-F364 HydrophobicContact CG-CE1 4.45Å; M313-F364 HydrophobicContact CG-CE2 3.79Å; M313-F364 HydrophobicContact CG-CG 4.48Å; M313-F364 HydrophobicContact CG-CZ 4.03Å; M313-F364 WeakPolarHBondContact O-CZ 3.49Å; M313-F364 HydrophobicContact SD-CD1 4.35Å; M313-F364 HydrophobicContact SD-CD2 4.38Å; M313-F364 HydrophobicContact SD-CG 4.28Å; D316-F364 HydrophobicContact CB-CE2 4.12Å; D316-F364 HydrophobicContact CB-CZ 4.28Å; K358-F364 HydrophobicContact CD-CD2 3.74Å; K358-F364 HydrophobicContact CD-CE2 3.7Å; K358-F364 HydrophobicContact CD-CG 4.38Å; K358-F364 HydrophobicContact CD-CZ 4.31Å; K358-F364 HydrophobicContact CG-CD2 4.41Å; K358-F364 HydrophobicContact CG-CE2 4.06Å; F360-F364 WeakPolarHBondContact O-CD2 3.41Å; V361-F364 WeakPolarHBondContact O-CB 3.49Å; V361-F364 PolarHBondContact O-N 3.28Å; D362-F364 VanDerWaalsContact C-N 3.27Å; D362-F364 PolarHBondContact O-N 3.21Å; F364-L366 PolarHBondContact O-N 3.08Å; F364-A367 WeakPolarHBondContact O-CB 3.44Å; F364-A367 PolarHBondContact O-N 2.97Å
365	N	97	Very high	96	Very high	72 Å²	72	48.8 Å²	48.8	39%	0.385	25%	0.245	S	C	.	.	H	α-helix	trans	-71.3	-11.6	-178.4	-69	-23.1	0	0	0	113.1	V361 D362 A367 T368	V361-N365 PolarHBondContact O-N 3.2Å; V361-N365 VanDerWaalsContact O-N 3.17Å; D362-N365 CarbonylContact O-C 3.53Å; D362-N365 PolarHBondContact O-N 3.24Å; D362-N365 VanDerWaalsContact O-N 3.1Å; N365-A367 PolarHBondContact O-N 2.97Å; N365-T368 VanDerWaalsContact O-CB 3.22Å; N365-T368 WeakPolarHBondContact O-CB 3.41Å; N365-T368 PolarHBondContact O-N 3.47Å; N365-T368 PolarHBondContact O-OG1 3.14Å
366	L	94.9	Very high	96	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-57.4	-29	169.6	-66.9	-173.8	0	0	0	112.9	L287 A290 L291 Y294 D362 L363 F364 T368 F369	L287-L366 HydrophobicContact CD1-CD2 3.52Å; L287-L366 HydrophobicContact CG-CD2 4.1Å; A290-L366 HydrophobicContact CB-CD1 3.67Å; L291-L366 HydrophobicContact CD1-CD2 4.39Å; L291-L366 HydrophobicContact CD2-CB 4.34Å; L291-L366 HydrophobicContact CD2-CD2 3.91Å; L291-L366 HydrophobicContact CG-CD2 3.76Å; Y294-L366 HydrophobicContact CD1-CB 4.5Å; Y294-L366 HydrophobicContact CD1-CD1 4.46Å; Y294-L366 HydrophobicContact CD2-CD1 4.04Å; Y294-L366 HydrophobicContact CE1-CB 4.28Å; Y294-L366 HydrophobicContact CE1-CD1 4.36Å; Y294-L366 HydrophobicContact CE2-CD1 3.96Å; Y294-L366 HydrophobicContact CG-CD1 4.29Å; D362-L366 WeakPolarHBondContact O-CG 3.39Å; D362-L366 PolarHBondContact O-N 3.2Å; L363-L366 HydrophobicContact CD2-CD1 4.22Å; F364-L366 PolarHBondContact O-N 3.08Å; L366-T368 PolarHBondContact O-N 3.45Å; L366-T368 VanDerWaalsContact O-N 3.15Å; L366-F369 PolarHBondContact O-N 3.1Å
367	A	94.5	Very high	96	Very high	62 Å²	62	39.5 Å²	39.5	51%	0.512	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-58.3	-27	176.9	0	0	0	0	0	112.7	F364 N365 F369 L370	F364-A367 WeakPolarHBondContact O-CB 3.44Å; F364-A367 PolarHBondContact O-N 2.97Å; N365-A367 PolarHBondContact O-N 2.97Å; A367-F369 PolarHBondContact O-N 3.44Å; A367-L370 HydrophobicContact CB-CD1 4.43Å; A367-L370 WeakPolarHBondContact O-CG 3.3Å; A367-L370 PolarHBondContact O-N 2.86Å
368	T	93.1	Very high	95.7	Very high	79 Å²	79	47.9 Å²	47.9	49%	0.485	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-64.6	-25.3	175.3	-55.2	0	0	0	0	112.7	N365 L366	N365-T368 VanDerWaalsContact O-CB 3.22Å; N365-T368 WeakPolarHBondContact O-CB 3.41Å; N365-T368 PolarHBondContact O-N 3.47Å; N365-T368 PolarHBondContact O-OG1 3.14Å; L366-T368 PolarHBondContact O-N 3.45Å; L366-T368 VanDerWaalsContact O-N 3.15Å
369	F	94	Very high	95.1	Very high	20 Å²	20	47.5 Å²	47.5	9%	0.088	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-105.8	14.5	-174.1	-51	-61.4	0	0	0	113.2	F262 L265 L291 L366 A367	F262-F369 HydrophobicContact CE1-CB 4.38Å; L265-F369 HydrophobicContact CB-CD1 4.01Å; L265-F369 HydrophobicContact CB-CE1 3.98Å; L265-F369 HydrophobicContact CD1-CD1 3.83Å; L265-F369 HydrophobicContact CD1-CD2 3.84Å; L265-F369 HydrophobicContact CD1-CE1 3.87Å; L265-F369 HydrophobicContact CD1-CE2 3.89Å; L265-F369 HydrophobicContact CD1-CG 3.81Å; L265-F369 HydrophobicContact CD1-CZ 3.91Å; L265-F369 HydrophobicContact CD2-CB 3.98Å; L265-F369 HydrophobicContact CD2-CD1 3.87Å; L265-F369 HydrophobicContact CD2-CG 3.94Å; L265-F369 HydrophobicContact CG-CD1 4.12Å; L265-F369 HydrophobicContact CG-CE1 4.36Å; L265-F369 HydrophobicContact CG-CG 4.37Å; L291-F369 HydrophobicContact CD2-CB 4.34Å; L366-F369 PolarHBondContact O-N 3.1Å; A367-F369 PolarHBondContact O-N 3.44Å
370	L	93.9	Very high	94	Very high	95 Å²	95	51.1 Å²	51.1	50%	0.497	26%	0.261	S	S	.	.			trans	-70.5	137.9	175.9	-64	177.6	0	0	0	110.6	F295 A367	F295-L370 HydrophobicContact CE1-CD2 4.14Å; A367-L370 HydrophobicContact CB-CD1 4.43Å; A367-L370 WeakPolarHBondContact O-CG 3.3Å; A367-L370 PolarHBondContact O-N 2.86Å
371	V	94.9	Very high	92.2	Very high	18 Å²	18	54.7 Å²	54.7	11%	0.109	28%	0.284	C	S	.	.			trans	-125	161.1	-179.1	-63.7	0	0	0	0	110.4	I228 F262 F295 R373 W375 V376	I228-V371 HydrophobicContact CD1-CG1 3.79Å; I228-V371 HydrophobicContact CG1-CG1 3.92Å; F262-V371 HydrophobicContact CE1-CG1 3.68Å; F262-V371 HydrophobicContact CE2-CG1 4.31Å; F262-V371 HydrophobicContact CZ-CG1 3.41Å; F262-V371 VanDerWaalsContact CZ-CG1 3.41Å; F295-V371 HydrophobicContact CE1-CG2 3.95Å; F295-V371 HydrophobicContact CZ-CG2 3.88Å; V371-R373 PolarHBondContact O-N 2.93Å; V371-W375 HydrophobicContact CB-CB 4.27Å; V371-W375 HydrophobicContact CB-CE3 4.04Å; V371-W375 HydrophobicContact CG1-CE3 4.17Å; V371-W375 HydrophobicContact CG2-CB 4.07Å; V371-V376 HydrophobicContact CG2-CG2 4.08Å
372	P	95.3	Very high	90.3	Very high	59 Å²	59	61.5 Å²	61.5	38%	0.383	32%	0.32	S	S	.	.			trans	-51.6	140.5	171.4	-26.8	35.5	0	0	0	111.7	H374 W375	P372-H374 WeakPolarHBondContact CB-CE1 3.39Å; P372-H374 PolarHBondContact O-N 3.42Å; P372-W375 HydrophobicContact CB-CD2 4.49Å; P372-W375 HydrophobicContact CB-CG 4.28Å; P372-W375 HydrophobicContact CG-CD2 4.14Å; P372-W375 HydrophobicContact CG-CG 4.44Å; P372-W375 HydrophobicContact CG-CZ2 4.35Å; P372-W375 WeakPolarHBondContact O-CB 3.36Å; P372-W375 PolarHBondContact O-N 3.26Å
373	R	92.4	Very high	88.3	Confident	131 Å²	131	65.8 Å²	65.8	49%	0.494	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-30.8	-176.2	-71.6	-61.8	-157	160.8	17.7	114.3	F295 R297 E298 V371 W375 V376	F295-R373 PolarHBondContact O-NH1 3.35Å; F295-R373 VanDerWaalsContact O-NH1 3.17Å; R297-R373 VanDerWaalsContact CZ-NH2 3.32Å; E298-R373 IonicContact OE1-NH2 3.68Å; V371-R373 PolarHBondContact O-N 2.93Å; R373-W375 VanDerWaalsContact C-N 3.28Å; R373-W375 PolarHBondContact O-N 3.48Å; R373-V376 WeakPolarHBondContact O-CB 3.4Å; R373-V376 PolarHBondContact O-N 2.92Å
374	H	93.8	Very high	86.5	Confident	136 Å²	136	67.1 Å²	67.1	63%	0.63	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.1	-179.9	64.7	-82.2	0	0	0	113.8	P372	P372-H374 WeakPolarHBondContact CB-CE1 3.39Å; P372-H374 PolarHBondContact O-N 3.42Å
375	W	96.4	Very high	84.8	Confident	22 Å²	22	67.9 Å²	67.9	8%	0.083	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-20.2	172.3	-61.7	8.9	0	0	0	111.5	N227 I228 G231 L232 E235 V371 P372 R373	N227-W375 WeakPolarHBondContact CB-O 3.45Å; N227-W375 PolarHBondContact ND2-O 3.43Å; I228-W375 HydrophobicContact CG1-CE3 4.35Å; G231-W375 VanDerWaalsContact C-CH2 3.48Å; G231-W375 VanDerWaalsContact CA-CZ2 3.46Å; L232-W375 HydrophobicContact CD2-CH2 4.03Å; L232-W375 HydrophobicContact CD2-CZ3 4.17Å; L232-W375 HydrophobicContact CG-CH2 4.13Å; L232-W375 HydrophobicContact CG-CZ3 4.05Å; E235-W375 HydrophobicContact CG-CH2 4.38Å; E235-W375 HydrophobicContact CG-CZ2 4.01Å; V371-W375 HydrophobicContact CB-CB 4.27Å; V371-W375 HydrophobicContact CB-CE3 4.04Å; V371-W375 HydrophobicContact CG1-CE3 4.17Å; V371-W375 HydrophobicContact CG2-CB 4.07Å; P372-W375 HydrophobicContact CB-CD2 4.49Å; P372-W375 HydrophobicContact CB-CG 4.28Å; P372-W375 HydrophobicContact CG-CD2 4.14Å; P372-W375 HydrophobicContact CG-CG 4.44Å; P372-W375 HydrophobicContact CG-CZ2 4.35Å; P372-W375 WeakPolarHBondContact O-CB 3.36Å; P372-W375 PolarHBondContact O-N 3.26Å; R373-W375 VanDerWaalsContact C-N 3.28Å; R373-W375 PolarHBondContact O-N 3.48Å
376	V	96.3	Very high	83.3	Confident	14 Å²	14	68.3 Å²	68.3	9%	0.085	36%	0.361	C	S	.	.	S	Bend	trans	-64.3	129.1	176.1	179.9	0	0	0	0	109	F295 Y296 V371 R373 K378	F295-V376 HydrophobicContact CB-CG1 3.81Å; F295-V376 HydrophobicContact CB-CG2 4.4Å; F295-V376 HydrophobicContact CD1-CG1 4.49Å; F295-V376 HydrophobicContact CD1-CG2 3.54Å; F295-V376 HydrophobicContact CE1-CG2 3.93Å; F295-V376 HydrophobicContact CG-CG1 4.12Å; F295-V376 HydrophobicContact CG-CG2 3.98Å; Y296-V376 HydrophobicContact CE1-CG1 3.92Å; Y296-V376 HydrophobicContact CE2-CG1 4.35Å; V371-V376 HydrophobicContact CG2-CG2 4.08Å; R373-V376 WeakPolarHBondContact O-CB 3.4Å; R373-V376 PolarHBondContact O-N 2.92Å; V376-K378 PolarHBondContact O-N 2.95Å
377	P	95	Very high	81.7	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.032	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-54.2	132.7	179	-26.5	34.5	0	0	0	112	F218 R223 L224 Y296	F218-P377 HydrophobicContact CZ-CB 3.92Å; R223-P377 HydrophobicContact CB-CB 3.89Å; R223-P377 HydrophobicContact CB-CG 3.71Å; L224-P377 HydrophobicContact CB-CG 4.17Å; Y296-P377 WeakPolarHBondContact CE1-O 3.27Å; Y296-P377 WeakPolarHBondContact OH-CB 3.42Å; Y296-P377 PolarHBondContact OH-O 3.42Å
378	K	90.5	Very high	80	Confident	180 Å²	180	70.5 Å²	70.5	78%	0.783	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-76.9	135.3	-178	-66.5	-177.4	-179.9	177.7	0	110.7	V376	V376-K378 PolarHBondContact O-N 2.95Å
379	L	85.3	Confident	78.1	Confident	28 Å²	28	72.8 Å²	72.8	15%	0.147	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-74.1	125	165.5	-64.2	172.9	0	0	0	108.3	F218 Y296 E299 P381 L387	F218-L379 HydrophobicContact CD2-CD2 4.15Å; F218-L379 HydrophobicContact CE1-CD2 4.09Å; F218-L379 HydrophobicContact CE2-CD2 3.67Å; F218-L379 HydrophobicContact CZ-CD2 3.63Å; Y296-L379 HydrophobicContact CD1-CD1 3.53Å; Y296-L379 HydrophobicContact CD1-CD2 4.39Å; Y296-L379 HydrophobicContact CD1-CG 3.82Å; Y296-L379 HydrophobicContact CE1-CD1 3.95Å; Y296-L379 HydrophobicContact CE1-CD2 4.13Å; Y296-L379 HydrophobicContact CE1-CG 3.67Å; Y296-L379 HydrophobicContact CG-CD1 4.29Å; E299-L379 HydrophobicContact CG-CD1 3.62Å; L379-P381 WeakPolarHBondContact O-CD 3.3Å; L379-L387 HydrophobicContact CD1-CD1 3.51Å; L379-L387 HydrophobicContact CD2-CD1 3.4Å; L379-L387 VanDerWaalsContact CD2-CD1 3.4Å; L379-L387 HydrophobicContact CG-CD1 4.09Å
380	N	74.8	Confident	76.2	Confident	78 Å²	78	74.7 Å²	74.7	42%	0.417	38%	0.383	S	S	.	.			trans	-93.6	109.2	170.8	-173.8	-15.7	0	0	0	108.4	N382 V383 H384	N380-N382 PolarHBondContact O-N 3.31Å; N380-N382 VanDerWaalsContact O-N 3.14Å; N380-N382 PolarHBondContact OD1-N 3.32Å; N380-V383 HydrophobicContact CB-CB 4.22Å; N380-V383 HydrophobicContact CB-CG2 4.19Å; N380-V383 PolarHBondContact O-N 2.94Å; N380-H384 PolarHBondContact O-N 3.39Å
381	P	61.4	Low	74.2	Confident	75 Å²	75	75.6 Å²	75.6	49%	0.487	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.2	-174.4	-22.7	33.2	0	0	0	113.6	L379 V383	L379-P381 WeakPolarHBondContact O-CD 3.3Å; P381-V383 VanDerWaalsContact C-N 3.26Å; P381-V383 PolarHBondContact O-N 2.94Å
382	N	58.4	Low	71.9	Confident	150 Å²	150	78.3 Å²	78.3	80%	0.802	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.1	179.2	-65.1	-22.7	0	0	0	113.2	N380	N380-N382 PolarHBondContact O-N 3.31Å; N380-N382 VanDerWaalsContact O-N 3.14Å; N380-N382 PolarHBondContact OD1-N 3.32Å
383	V	56.7	Low	69.4	Low	92 Å²	92	79.3 Å²	79.3	56%	0.558	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-28.4	-177	-175.8	0	0	0	0	111.1	N380 P381	N380-V383 HydrophobicContact CB-CB 4.22Å; N380-V383 HydrophobicContact CB-CG2 4.19Å; N380-V383 PolarHBondContact O-N 2.94Å; P381-V383 VanDerWaalsContact C-N 3.26Å; P381-V383 PolarHBondContact O-N 2.94Å
384	H	60.5	Low	66.9	Low	30 Å²	30	78.5 Å²	78.5	14%	0.139	42%	0.417	C	S	.	.			trans	-125.2	65.4	-174.8	-58.2	-65.9	0	0	0	111.3	F218 N380 F386	F218-H384 AromaticContact CD2-CD2 3.77Å; F218-H384 AromaticContact CD2-CE1 3.83Å; F218-H384 AromaticContact CD2-NE2 3.51Å; N380-H384 PolarHBondContact O-N 3.39Å; H384-F386 PolarHBondContact O-N 3.44Å
385	T	61.4	Low	64.4	Low	80 Å²	80	76.9 Å²	76.9	49%	0.491	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-66	-17.9	171.1	-34	0	0	0	0	112.1	L387 Y388 M389	T385-L387 VanDerWaalsContact C-N 3.32Å; T385-L387 PolarHBondContact O-N 3.34Å; T385-Y388 WeakPolarHBondContact O-CB 3.47Å; T385-Y388 PolarHBondContact O-N 3Å; T385-Y388 VanDerWaalsContact O-N 3.08Å; T385-M389 HydrophobicContact CG2-SD 4.27Å
386	F	65.3	Low	61.7	Low	81 Å²	81	79.9 Å²	79.9	36%	0.355	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-57.7	-37.2	-173.9	-174.6	-130.7	0	0	0	113.9	P211 R301 H384 Y388 M389 E391	P211-F386 HydrophobicContact CB-CD1 3.75Å; P211-F386 HydrophobicContact CB-CE1 3.11Å; P211-F386 HydrophobicContact CB-CZ 3.94Å; P211-F386 HydrophobicContact CG-CE1 4.31Å; R301-F386 WeakPolarHBondContact CD-O 3.45Å; R301-F386 PolarHBondContact NH1-O 3.02Å; H384-F386 PolarHBondContact O-N 3.44Å; F386-Y388 PolarHBondContact O-N 3.01Å; F386-M389 PolarHBondContact O-N 3.09Å; F386-E391 HydrophobicContact CE2-CG 4.18Å; F386-E391 WeakPolarHBondContact CE2-OE1 3.41Å
387	L	62.8	Low	58.9	Low	6 Å²	6	88.7 Å²	88.7	3%	0.031	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-73.9	-6.8	-178.7	-65.7	176	0	0	0	113.9	P211 M292 R301 F302 L379 T385	P211-L387 HydrophobicContact CB-CD2 4.28Å; P211-L387 HydrophobicContact CG-CD2 4.09Å; M292-L387 HydrophobicContact CE-CD1 4.15Å; R301-L387 VanDerWaalsContact CG-O 3.3Å; R301-L387 WeakPolarHBondContact CG-O 3.33Å; F302-L387 HydrophobicContact CD2-CD2 4.32Å; F302-L387 HydrophobicContact CE1-CD2 4.42Å; F302-L387 HydrophobicContact CE2-CD1 4.12Å; F302-L387 HydrophobicContact CE2-CD2 3.44Å; F302-L387 VanDerWaalsContact CE2-CD2 3.44Å; F302-L387 HydrophobicContact CE2-CG 4.38Å; F302-L387 HydrophobicContact CZ-CD2 3.51Å; L379-L387 HydrophobicContact CD1-CD1 3.51Å; L379-L387 HydrophobicContact CD2-CD1 3.4Å; L379-L387 VanDerWaalsContact CD2-CD1 3.4Å; L379-L387 HydrophobicContact CG-CD1 4.09Å; T385-L387 VanDerWaalsContact C-N 3.32Å; T385-L387 PolarHBondContact O-N 3.34Å
388	Y	58	Low	55.9	Low	101 Å²	101	94.5 Å²	94.5	40%	0.396	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-102.7	-18.5	178.3	-59.4	-74.7	0	0	0	113.6	E299 P300 T385 F386	E299-Y388 WeakPolarHBondContact OE2-CE1 3.37Å; E299-Y388 VanDerWaalsContact OE2-CZ 3.24Å; E299-Y388 PolarHBondContact OE2-OH 3.24Å; P300-Y388 HydrophobicContact CG-CD1 4.13Å; T385-Y388 WeakPolarHBondContact O-CB 3.47Å; T385-Y388 PolarHBondContact O-N 3Å; T385-Y388 VanDerWaalsContact O-N 3.08Å; F386-Y388 PolarHBondContact O-N 3.01Å
389	M	53.3	Low	53.2	Low	127 Å²	127	90 Å²	90	63%	0.626	51%	0.509	S	S	*	.	S	Bend	trans	-111	114	-175.3	-67.1	-174.2	65.6	0	0	111.2	R301 T385 F386 E391	R301-M389 WeakPolarHBondContact CD-O 3.34Å; T385-M389 HydrophobicContact CG2-SD 4.27Å; F386-M389 PolarHBondContact O-N 3.09Å; M389-E391 PolarHBondContact O-N 3.13Å
390	A	54	Low	50.9	Low	61 Å²	61	94.2 Å²	94.2	50%	0.504	54%	0.541	S	S	.	.			trans	-67.5	127.7	172.3	0	0	0	0	0	110.1	E103 C392	E103-A390 WeakPolarHBondContact OE2-CA 3.5Å; E103-A390 VanDerWaalsContact OE2-CB 3.3Å; E103-A390 WeakPolarHBondContact OE2-CB 3.27Å; A390-C392 PolarHBondContact O-N 3.46Å
391	E	52.4	Low	49	Very low	113 Å²	113	98.9 Å²	98.9	53%	0.528	56%	0.56	S	S	.	*			trans	-75.7	117.4	172.9	-70.9	-175.5	150.5	0	0	109.3	F386 M389	F386-E391 HydrophobicContact CE2-CG 4.18Å; F386-E391 WeakPolarHBondContact CE2-OE1 3.41Å; M389-E391 PolarHBondContact O-N 3.13Å
392	C	46.6	Very low	48	Very low	76 Å²	76	102.6 Å²	102.6	51%	0.514	58%	0.576	S	S	.	*			trans	-93.8	109.9	170.6	-71.2	0	0	0	0	108.6	R104 A390 D394	R104-C392 PolarHBondContact NH1-SG 3.08Å; R104-C392 VanDerWaalsContact NH1-SG 3.37Å; A390-C392 PolarHBondContact O-N 3.46Å; C392-D394 PolarHBondContact O-N 3.03Å
393	C	42.9	Very low	47	Very low	79 Å²	79	101 Å²	101	53%	0.534	58%	0.576	S	S	.	*			trans	-76.1	107.6	160.6	-71.9	0	0	0	0	107.9	S395	C393-S395 PolarHBondContact O-N 3.17Å; C393-S395 VanDerWaalsContact O-N 3.08Å
394	D	38.6	Very low	46	Very low	115 Å²	115	108.3 Å²	108.3	62%	0.615	61%	0.612	S	S	*	*			trans	-71.6	96.2	168.8	-91.4	-18.7	0	0	0	108.9	C392 S396	C392-D394 PolarHBondContact O-N 3.03Å; D394-S396 PolarHBondContact O-N 3.47Å
395	S	41.8	Very low	45.2	Very low	101 Å²	101	112.3 Å²	112.3	71%	0.706	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	11.6	168.1	57.4	0	0	0	0	112.9	C393	C393-S395 PolarHBondContact O-N 3.17Å; C393-S395 VanDerWaalsContact O-N 3.08Å
396	S	39.2	Very low	44.4	Very low	86 Å²	86	113.9 Å²	113.9	60%	0.601	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	0.6	-173.9	52.5	0	0	0	0	115.2	D394	D394-S396 PolarHBondContact O-N 3.47Å
397	Y	37.2	Very low	43.2	Very low	198 Å²	198	115.8 Å²	115.8	78%	0.776	66%	0.66	S	S	*	*			trans	-113.1	57.6	173	-80.6	-85.8	0	0	0	112.2
398	C	33.3	Very low	42.1	Very low	128 Å²	128	122.2 Å²	122.2	87%	0.865	70%	0.697	S	S	*	*			trans	-109.5	71.4	149	-77	0	0	0	0	106.8	S400	C398-S400 PolarHBondContact O-N 3.15Å
399	S	33	Very low	41.1	Very low	84 Å²	84	123.6 Å²	123.6	59%	0.587	72%	0.716	S	S	*	*			trans	-65.5	117.6	162.4	48.2	0	0	0	0	107.4	E401	S399-E401 VanDerWaalsContact C-N 3.31Å; S399-E401 PolarHBondContact O-N 2.74Å
400	S	37.3	Very low	40.3	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	72%	0.722	S	S	*	*			trans	-57.7	95.3	160.6	49.4	0	0	0	0	108.7	C398 D402	C398-S400 PolarHBondContact O-N 3.15Å; S400-D402 PolarHBondContact O-N 3.23Å
401	E	35.1	Very low	39.3	Very low	176 Å²	176	127.8 Å²	127.8	82%	0.822	74%	0.737	S	S	*	*			trans	-83.2	91.7	158.8	-74.5	-172	165.7	0	0	107.5	S399	S399-E401 VanDerWaalsContact C-N 3.31Å; S399-E401 PolarHBondContact O-N 2.74Å
402	D	39.9	Very low	38.3	Very low	153 Å²	153	128.9 Å²	128.9	82%	0.818	75%	0.753	S	S	*	*			trans	-149.9	93.2	155.7	-98.5	-24.8	0	0	0	107.3	S400	S400-D402 PolarHBondContact O-N 3.23Å
403	S	38.1	Very low	37.6	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	77%	0.773	S	S	*	*			trans	-178.4	97.3	143.8	15.3	0	0	0	0	110.4
404	D	34.7	Very low	37.1	Very low	246 Å²	246	138.3 Å²	138.3	100%	1.316	80%	0.795	S	S	*	*				-161	0	127.5	-94.8	-17.6	0	0	0	110.3

Retrieved 404 of 404 residues in 634.7 ms (Link to these results)

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