A0A3Q0KMY9_SCHMA Loading...

Putative drug transporter

AlphaFold DB , UniProt , Accession A0A3Q0KMY9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 540 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	34.6	Very low	28.5	Very low	252 Å²	252	163.5 Å²	163.5	100%	1.241	86%	0.863	S	S	*	*				0	119	0	-83.1	169.6	169.1	0	0	107.9
2	T	27	Very low	28.3	Very low	133 Å²	133	169.1 Å²	169.1	82%	0.816	87%	0.866	S	S	*	*			trans	-70.2	139.8	-179.7	37	0	0	0	0	113.1
3	T	31.3	Very low	28.3	Very low	135 Å²	135	167.2 Å²	167.2	83%	0.828	87%	0.866	S	S	*	*			trans	176.6	99.7	133	30.8	0	0	0	0	107.7
4	R	24.1	Very low	28	Very low	259 Å²	259	165.8 Å²	165.8	98%	0.977	87%	0.869	S	S	*	*				45.3	110.4	85.4	-90.3	-172.2	176.8	179.7	-0.4	114.2
5	G	29.8	Very low	27.7	Very low	81 Å²	81	166.8 Å²	166.8	84%	0.835	87%	0.871	S	S	*	*			trans	-175	74.8	168.7	0	0	0	0	0	111
6	M	25.1	Very low	27.7	Very low	183 Å²	183	166.9 Å²	166.9	90%	0.901	87%	0.871	S	S	*	*			trans	-72.6	176.9	156.5	-106.7	-175.5	172.4	0	0	108.9
7	P	33.1	Very low	27.5	Very low	93 Å²	93	169.4 Å²	169.4	60%	0.604	87%	0.873	S	S	*	*			cis	-144	-169.3	-27.2	39.9	-20.2	0	0	0	113.4
8	L	25.2	Very low	27.3	Very low	149 Å²	149	166.1 Å²	166.1	78%	0.78	87%	0.867	S	S	*	*			trans	69.5	134.3	155.8	-61.3	164.4	0	0	0	116.1
9	D	31.5	Very low	27.3	Very low	153 Å²	153	167.9 Å²	167.9	82%	0.818	87%	0.871	S	S	*	*			cis	-145.2	145.2	41.5	-91.3	-42.9	0	0	0	113.3
10	Q	25.4	Very low	27.2	Very low	187 Å²	187	166.5 Å²	166.5	87%	0.874	87%	0.87	S	S	*	*			trans	-120.1	79	-174	-176.7	176.3	3.4	0	0	107
11	E	26.7	Very low	27	Very low	174 Å²	174	163.5 Å²	163.5	81%	0.813	86%	0.863	S	S	*	*			trans	-157.7	17.8	175.2	-127.6	176.8	-164.3	0	0	119.6
12	Y	25.9	Very low	26.5	Very low	230 Å²	230	157.1 Å²	157.1	90%	0.902	84%	0.841	S	S	*	*	S	Bend	trans	-135.8	24.9	-176.7	-105.2	-85.8	0	0	0	118.9
13	V	27.9	Very low	26.4	Very low	144 Å²	144	158.7 Å²	158.7	87%	0.873	85%	0.845	S	S	*	*	S	Bend	trans	-125.3	18.9	179.3	-166.2	0	0	0	0	114.6
14	T	24.5	Very low	26.2	Very low	148 Å²	148	157.1 Å²	157.1	91%	0.908	85%	0.846	S	S	*	*			trans	-115.7	40.5	178.9	-14.4	0	0	0	0	114.3
15	M	23.7	Very low	26.3	Very low	181 Å²	181	150.5 Å²	150.5	89%	0.892	84%	0.839	S	S	*	*	S	Bend	trans	-138.6	42.5	172	-143.6	-167.2	-67.2	0	0	114.3
16	I	26.7	Very low	26.4	Very low	169 Å²	169	151.3 Å²	151.3	87%	0.867	84%	0.838	S	S	*	*			trans	-144.6	76.2	158	-49.6	178.6	0	0	0	108.9
17	K	24.6	Very low	26.5	Very low	209 Å²	209	147 Å²	147	91%	0.909	83%	0.831	S	S	*	*			trans	-144.2	67.6	165.9	-88.6	-167.8	179	178.5	0	109.8
18	S	24.8	Very low	26.3	Very low	110 Å²	110	148.5 Å²	148.5	77%	0.769	84%	0.841	S	S	*	*			trans	-169.5	80	157.3	59	0	0	0	0	109.9
19	E	27.7	Very low	26.6	Very low	200 Å²	200	148.8 Å²	148.8	94%	0.935	84%	0.843	S	S	*	*			trans	-151.5	107	152.3	-114.4	162.9	-155.6	0	0	109.2
20	V	25	Very low	26.5	Very low	140 Å²	140	149.3 Å²	149.3	85%	0.848	85%	0.845	S	S	*	*			trans	-84.7	122.4	171.8	168.5	0	0	0	0	106.5
21	S	22.2	Very low	26.9	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	83%	0.834	S	S	*	*				166.7	134	124	53.7	0	0	0	0	114
22	C	24.1	Very low	27	Very low	117 Å²	117	144.7 Å²	144.7	79%	0.791	84%	0.837	S	S	*	*			trans	73.6	83.3	145	-62.7	0	0	0	0	120.2
23	D	24.4	Very low	27.2	Very low	166 Å²	166	142 Å²	142	89%	0.888	84%	0.836	S	S	*	*				29.7	98	121	-64	-20.7	0	0	0	118.2
24	A	28.2	Very low	27.2	Very low	103 Å²	103	144 Å²	144	85%	0.851	83%	0.833	S	S	*	*			trans	-78.4	114	157.4	0	0	0	0	0	109.8	A26	A24-A26 PolarHBondContact O-N 3.21Å
25	S	27.1	Very low	27.5	Very low	119 Å²	119	142.5 Å²	142.5	83%	0.832	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-52.1	117.5	174.5	53.8	0	0	0	0	113.3
26	A	30.5	Very low	28.2	Very low	99 Å²	99	141.6 Å²	141.6	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.8	138.2	167.3	0	0	0	0	0	111.2	A24	A24-A26 PolarHBondContact O-N 3.21Å
27	A	27.9	Very low	28.2	Very low	92 Å²	92	142.3 Å²	142.3	76%	0.76	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.5	153.1	-179	0	0	0	0	0	113.5	D29	A27-D29 PolarHBondContact O-N 2.96Å
28	P	29.6	Very low	28.3	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78	124.3	-168.5	30.6	-33.5	0	0	0	112.7	L30	P28-L30 PolarHBondContact O-N 2.82Å
29	D	29.6	Very low	28.3	Very low	155 Å²	155	148.2 Å²	148.2	83%	0.829	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.9	118.7	175.7	-167.3	8.5	0	0	0	110.9	A27 G31	A27-D29 PolarHBondContact O-N 2.96Å; D29-G31 VanDerWaalsContact C-N 3.26Å; D29-G31 PolarHBondContact O-N 2.78Å
30	L	29.8	Very low	28.2	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	81%	0.806	S	S	*	*			trans	-73.4	81.8	174.8	-89.5	146.4	0	0	0	108.8	P28 K32	P28-L30 PolarHBondContact O-N 2.82Å; L30-K32 PolarHBondContact O-N 2.86Å; L30-K32 VanDerWaalsContact O-N 3.15Å
31	G	34.9	Very low	28.1	Very low	62 Å²	62	145.7 Å²	145.7	64%	0.639	80%	0.801	S	S	*	*			trans	-49.1	118.3	178.2	0	0	0	0	0	112.6	D29 I33	D29-G31 VanDerWaalsContact C-N 3.26Å; D29-G31 PolarHBondContact O-N 2.78Å; G31-I33 PolarHBondContact O-N 3.44Å
32	K	28.8	Very low	28.5	Very low	202 Å²	202	145.2 Å²	145.2	88%	0.878	80%	0.798	S	S	*	*			trans	-46.9	120.2	174.9	-69	174.6	178.2	174.8	0	111.2	L30 K34	L30-K32 PolarHBondContact O-N 2.86Å; L30-K32 VanDerWaalsContact O-N 3.15Å; K32-K34 PolarHBondContact O-N 2.84Å
33	I	29.9	Very low	28.3	Very low	172 Å²	172	146.8 Å²	146.8	88%	0.882	80%	0.798	S	S	*	*			trans	-60.8	105.2	175.2	-60.8	167.1	0	0	0	108.7	G31	G31-I33 PolarHBondContact O-N 3.44Å
34	K	28.2	Very low	28.5	Very low	186 Å²	186	143.9 Å²	143.9	81%	0.809	79%	0.786	S	S	*	*			trans	-87.7	133.8	169.3	-81.1	-176	177	179.6	0	109.7	K32	K32-K34 PolarHBondContact O-N 2.84Å
35	P	28.9	Very low	28.3	Very low	117 Å²	117	145.5 Å²	145.5	76%	0.76	79%	0.786	S	S	*	*			trans	-64.7	140.5	177.8	24	-30.7	0	0	0	111.4	H37	P35-H37 PolarHBondContact O-N 3.36Å
36	R	38.9	Very low	28.3	Very low	162 Å²	162	146.2 Å²	146.2	61%	0.611	78%	0.779	S	S	*	*	S	Bend	trans	-71.8	21.3	-162	-147	176	-178.3	-158.1	-8.9	116.2	D205 D526	R36-D205 IonicContact CZ-OD1 3.94Å; R36-D205 IonicContact NH1-OD1 3.54Å; R36-D205 PolarHBondContact NH1-OD1 3.16Å; R36-D205 IonicContact NH2-OD1 3.56Å; R36-D205 PolarHBondContact NH2-OD1 2.96Å; R36-D205 IonicContact NH2-OD2 2.65Å; R36-D526 IonicContact CZ-OD2 3.78Å; R36-D526 IonicContact NH1-OD2 2.68Å; R36-D526 IonicContact NH2-OD2 2.69Å; R36-D526 PolarHBondContact NH2-OD2 2.84Å
37	H	28.1	Very low	28	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.856	77%	0.774	S	S	*	*			trans	-134.7	78.9	175.5	-68.3	-52.3	0	0	0	111.7	P35	P35-H37 PolarHBondContact O-N 3.36Å
38	Y	25.9	Very low	27.9	Very low	206 Å²	206	149.8 Å²	149.8	81%	0.808	78%	0.776	S	S	*	*			trans	-122.6	103.8	152.8	-146.9	-96.2	0	0	0	108.4	Q40	Y38-Q40 VanDerWaalsContact C-N 3.33Å; Y38-Q40 HydrophobicContact CD1-CG 3.93Å; Y38-Q40 PolarHBondContact O-N 3.2Å
39	R	25.3	Very low	27.8	Very low	237 Å²	237	152.5 Å²	152.5	89%	0.894	78%	0.777	S	S	*	*			trans	-71.5	90.7	172.3	-161.3	-179.3	-161.8	177.1	3.8	106.2	T41	R39-T41 PolarHBondContact O-N 3.13Å; R39-T41 VanDerWaalsContact O-N 3.14Å
40	Q	25.1	Very low	27.5	Very low	165 Å²	165	150.5 Å²	150.5	77%	0.771	77%	0.771	S	S	*	*			trans	-71.7	105.7	172.1	-80.7	-175.6	-34.7	0	0	108.3	Y38 S42	Y38-Q40 VanDerWaalsContact C-N 3.33Å; Y38-Q40 HydrophobicContact CD1-CG 3.93Å; Y38-Q40 PolarHBondContact O-N 3.2Å; Q40-S42 VanDerWaalsContact C-N 3.33Å; Q40-S42 PolarHBondContact O-N 2.89Å; Q40-S42 VanDerWaalsContact O-N 3.11Å
41	T	23.7	Very low	27.4	Very low	121 Å²	121	150.4 Å²	150.4	74%	0.742	77%	0.771	S	S	*	*			trans	-65	95.7	156.5	46	0	0	0	0	106.8	R39 D43	R39-T41 PolarHBondContact O-N 3.13Å; R39-T41 VanDerWaalsContact O-N 3.14Å; T41-D43 PolarHBondContact O-N 3.44Å
42	S	28.6	Very low	27	Very low	95 Å²	95	152.2 Å²	152.2	66%	0.664	77%	0.774	S	S	*	*			trans	-79.8	104.7	167.9	53.9	0	0	0	0	107.9	Q40 V44	Q40-S42 VanDerWaalsContact C-N 3.33Å; Q40-S42 PolarHBondContact O-N 2.89Å; Q40-S42 VanDerWaalsContact O-N 3.11Å; S42-V44 VanDerWaalsContact C-N 3.33Å; S42-V44 PolarHBondContact O-N 2.88Å
43	D	22	Very low	26.9	Very low	150 Å²	150	149.4 Å²	149.4	80%	0.802	77%	0.774	S	S	*	*			trans	-57	97.2	160.4	-67.1	-43.7	0	0	0	108.2	T41	T41-D43 PolarHBondContact O-N 3.44Å
44	V	28.6	Very low	26.7	Very low	105 Å²	105	152 Å²	152	64%	0.636	77%	0.774	S	S	*	*			trans	-102.5	91.8	164.8	-174.2	0	0	0	0	106.6	S42 I46	S42-V44 VanDerWaalsContact C-N 3.33Å; S42-V44 PolarHBondContact O-N 2.88Å; V44-I46 HydrophobicContact CG1-CD1 4.28Å; V44-I46 HydrophobicContact CG1-CG1 3.77Å; V44-I46 PolarHBondContact O-N 3.08Å
45	T	22	Very low	26.8	Very low	137 Å²	137	148.7 Å²	148.7	84%	0.84	78%	0.775	S	S	*	*			trans	-61.8	98.5	165.1	-49	0	0	0	0	108.1
46	I	27.3	Very low	26.6	Very low	134 Å²	134	148.7 Å²	148.7	69%	0.687	77%	0.773	S	S	*	*			trans	-93.7	135.3	168.3	-58.7	-176.6	0	0	0	108	V44	V44-I46 HydrophobicContact CG1-CD1 4.28Å; V44-I46 HydrophobicContact CG1-CG1 3.77Å; V44-I46 PolarHBondContact O-N 3.08Å
47	P	25.3	Very low	26.1	Very low	109 Å²	109	147.7 Å²	147.7	71%	0.708	79%	0.785	S	S	*	*			trans	-66.6	140	-167.2	-15.8	29.6	0	0	0	112.9	H49	P47-H49 PolarHBondContact O-N 3.03Å
48	I	25.7	Very low	26.1	Very low	156 Å²	156	143.9 Å²	143.9	80%	0.8	78%	0.779	S	S	*	*			trans	-64.5	100.9	173.6	-59.9	163.7	0	0	0	108.2	T50	I48-T50 HydrophobicContact CG2-CG2 4.15Å
49	H	26.5	Very low	26.2	Very low	182 Å²	182	144.1 Å²	144.1	84%	0.843	78%	0.784	S	S	*	*			trans	-85.1	108.1	151	-99.4	-75.1	0	0	0	107.4	P47 D51	P47-H49 PolarHBondContact O-N 3.03Å; H49-D51 PolarHBondContact O-N 2.82Å
50	T	24.5	Very low	26.6	Very low	113 Å²	113	138 Å²	138	69%	0.693	78%	0.777	S	S	*	*			trans	-60.3	108	164.3	41.4	0	0	0	0	108.8	I48	I48-T50 HydrophobicContact CG2-CG2 4.15Å
51	D	28.1	Very low	27	Very low	162 Å²	162	136.2 Å²	136.2	87%	0.866	78%	0.778	S	S	*	*			trans	-146	127.5	141.1	-93.6	-32.3	0	0	0	110.1	H49	H49-D51 PolarHBondContact O-N 2.82Å
52	S	25.8	Very low	27.6	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	79%	0.787	S	S	*	*			trans	-77	124.5	-169	47.3	0	0	0	0	112.7
53	T	27	Very low	27.9	Very low	143 Å²	143	140 Å²	140	88%	0.877	79%	0.788	S	S	*	*			trans	-169.5	76.9	139.5	11.3	0	0	0	0	110.3	S55	T53-S55 PolarHBondContact O-N 3.33Å
54	Y	26	Very low	29	Very low	225 Å²	225	142 Å²	142	88%	0.882	79%	0.79	S	S	*	*			trans	-77.3	104.2	163.3	-92	-88.6	0	0	0	108.7	T56	Y54-T56 PolarHBondContact O-N 3.22Å
55	S	29	Very low	29.5	Very low	117 Å²	117	142.3 Å²	142.3	82%	0.818	80%	0.796	S	S	*	*			trans	-79.1	103.5	158.9	49.8	0	0	0	0	108.5	T53	T53-S55 PolarHBondContact O-N 3.33Å
56	T	25.2	Very low	30.4	Very low	117 Å²	117	142.7 Å²	142.7	72%	0.718	78%	0.782	S	S	*	*			trans	-82.2	119.6	168.1	37	0	0	0	0	109.2	Y54	Y54-T56 PolarHBondContact O-N 3.22Å
57	T	27.8	Very low	31.1	Very low	142 Å²	142	146.2 Å²	146.2	87%	0.871	79%	0.787	S	S	*	*			trans	166	139.2	153.9	29.8	0	0	0	0	107.3
58	S	28.2	Very low	31.9	Very low	104 Å²	104	152.7 Å²	152.7	73%	0.727	80%	0.797	S	S	*	*			cis	-159.8	142.2	12.5	167.7	0	0	0	0	108	S60	S58-S60 PolarHBondContact O-N 2.91Å
59	K	28.2	Very low	32.6	Very low	211 Å²	211	147.9 Å²	147.9	92%	0.917	78%	0.777	S	S	*	*			trans	-69.6	90.2	168.9	-73.8	176.8	177	175.2	0	108.6
60	S	34.5	Very low	33.8	Very low	108 Å²	108	145.4 Å²	145.4	76%	0.755	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-83.6	118.8	177	174.4	0	0	0	0	111.2	S58	S58-S60 PolarHBondContact O-N 2.91Å
61	T	33.9	Very low	34.9	Very low	128 Å²	128	143.2 Å²	143.2	79%	0.785	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-56.7	129	176.6	37.7	0	0	0	0	113.1
62	M	34.8	Very low	35.6	Very low	190 Å²	190	136.2 Å²	136.2	94%	0.936	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-64.1	125.6	180	-67.3	-171	-172.3	0	0	112.3
63	P	36.6	Very low	36.3	Very low	105 Å²	105	139 Å²	139	68%	0.682	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-78.6	139.9	177.5	-9.2	25.4	0	0	0	112.5	C65	P63-C65 PolarHBondContact O-N 3.23Å
64	F	43.4	Very low	37.3	Very low	192 Å²	192	135.6 Å²	135.6	84%	0.842	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-55.3	-12.4	178.2	-168.2	-101.4	0	0	0	115.3	R66	F64-R66 PolarHBondContact O-N 3.45Å; F64-R66 VanDerWaalsContact O-N 3.09Å
65	C	38.9	Very low	38.2	Very low	112 Å²	112	128.3 Å²	128.3	76%	0.757	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-69	-9.1	-172.8	-152.5	0	0	0	0	114.7	P63 R67	P63-C65 PolarHBondContact O-N 3.23Å; C65-R67 VanDerWaalsContact C-N 3.35Å; C65-R67 PolarHBondContact O-N 3.05Å
66	R	42.6	Very low	38.9	Very low	145 Å²	145	129.2 Å²	129.2	55%	0.547	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-74.2	-18.9	-177.1	-143.9	176.7	-173.6	-131.6	-3.3	114.2	F64 W68 C72 T75	F64-R66 PolarHBondContact O-N 3.45Å; F64-R66 VanDerWaalsContact O-N 3.09Å; R66-W68 PolarHBondContact O-N 3.4Å; R66-C72 HydrophobicContact CG-CB 4.12Å; R66-T75 PolarHBondContact NH2-OG1 3.37Å
67	R	41.6	Very low	40.7	Very low	208 Å²	208	130 Å²	130	79%	0.785	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-76.8	-22.5	-168.2	-159.3	168.4	-173.4	175	1	114.7	C65	C65-R67 VanDerWaalsContact C-N 3.35Å; C65-R67 PolarHBondContact O-N 3.05Å
68	W	40.6	Very low	43.2	Very low	245 Å²	245	126.7 Å²	126.7	93%	0.928	64%	0.635	S	S	*	*	S	Bend	trans	-117.3	-7.4	-169	-79.7	2.7	0	0	0	116.5	R66 L70	R66-W68 PolarHBondContact O-N 3.4Å; W68-L70 PolarHBondContact O-N 3.45Å
69	C	42.3	Very low	45.8	Very low	56 Å²	56	124.5 Å²	124.5	38%	0.378	62%	0.615	S	S	.	*			trans	-83	120.6	175.3	-172.8	0	0	0	0	110.8	C71 C72 R73	C69-C71 PolarHBondContact O-N 3.18Å; C69-C72 HydrophobicContact CB-CB 3.93Å; C69-C72 WeakPolarHBondContact O-CA 3.45Å; C69-C72 WeakPolarHBondContact O-CB 3.4Å; C69-C72 PolarHBondContact O-N 3.04Å; C69-R73 PolarHBondContact O-N 3.39Å
70	L	50.4	Low	48.6	Very low	130 Å²	130	116.7 Å²	116.7	68%	0.681	58%	0.581	S	S	*	*	H	α-helix	trans	-55.3	-35.5	173.9	-80	160.3	0	0	0	112	W68 R73 Q74	W68-L70 PolarHBondContact O-N 3.45Å; L70-R73 PolarHBondContact O-N 3.05Å; L70-Q74 PolarHBondContact O-N 2.89Å; L70-Q74 VanDerWaalsContact O-N 3.09Å
71	C	47.2	Very low	51.2	Low	66 Å²	66	115 Å²	115	45%	0.446	56%	0.561	S	S	.	*	H	α-helix	trans	-64.8	-41.8	173.3	-62.6	0	0	0	0	111.7	C69 R73 Q74 T75	C69-C71 PolarHBondContact O-N 3.18Å; C71-R73 PolarHBondContact O-N 2.85Å; C71-Q74 PolarHBondContact O-N 2.98Å; C71-T75 PolarHBondContact O-N 3.22Å
72	C	42.4	Very low	53.9	Low	15 Å²	15	110.8 Å²	110.8	10%	0.101	53%	0.53	C	S	.	.	H	α-helix	trans	-66.8	-34.9	175.2	-77.3	0	0	0	0	112.6	R66 C69 Q74 T75 M76	R66-C72 HydrophobicContact CG-CB 4.12Å; C69-C72 HydrophobicContact CB-CB 3.93Å; C69-C72 WeakPolarHBondContact O-CA 3.45Å; C69-C72 WeakPolarHBondContact O-CB 3.4Å; C69-C72 PolarHBondContact O-N 3.04Å; C72-Q74 VanDerWaalsContact C-N 3.33Å; C72-T75 PolarHBondContact O-N 3.06Å; C72-T75 VanDerWaalsContact O-N 3.16Å; C72-T75 PolarHBondContact O-OG1 3.44Å; C72-M76 PolarHBondContact O-N 3.3Å
73	R	40.4	Very low	56.6	Low	160 Å²	160	102 Å²	102	60%	0.604	49%	0.487	S	S	*	.	H	α-helix	trans	-69.2	-31.9	176.8	-171.5	174.3	147.6	-150.8	-6.9	112	C69 L70 C71 T75 M76	C69-R73 PolarHBondContact O-N 3.39Å; L70-R73 PolarHBondContact O-N 3.05Å; C71-R73 PolarHBondContact O-N 2.85Å; R73-T75 VanDerWaalsContact C-N 3.33Å; R73-M76 WeakPolarHBondContact O-CB 3.43Å; R73-M76 PolarHBondContact O-N 2.83Å
74	Q	48.7	Very low	59.3	Low	71 Å²	71	97.6 Å²	97.6	33%	0.332	46%	0.458	S	S	.	.	H	α-helix	trans	-62.7	-39.1	168.2	-80.1	178.1	-13.7	0	0	112	L70 C71 C72 M76 W77 F267	L70-Q74 PolarHBondContact O-N 2.89Å; L70-Q74 VanDerWaalsContact O-N 3.09Å; C71-Q74 PolarHBondContact O-N 2.98Å; C72-Q74 VanDerWaalsContact C-N 3.33Å; Q74-M76 PolarHBondContact O-N 3.45Å; Q74-M76 VanDerWaalsContact O-N 3.08Å; Q74-W77 PolarHBondContact O-N 2.94Å; Q74-F267 PolarHBondContact NE2-O 3.3Å
75	T	45.8	Very low	61.7	Low	73 Å²	73	92.1 Å²	92.1	45%	0.448	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.3	175	70	0	0	0	0	114.5	R66 C71 C72 R73 W77	R66-T75 PolarHBondContact NH2-OG1 3.37Å; C71-T75 PolarHBondContact O-N 3.22Å; C72-T75 PolarHBondContact O-N 3.06Å; C72-T75 VanDerWaalsContact O-N 3.16Å; C72-T75 PolarHBondContact O-OG1 3.44Å; R73-T75 VanDerWaalsContact C-N 3.33Å; T75-W77 VanDerWaalsContact C-N 3.32Å
76	M	43.9	Very low	64.5	Low	136 Å²	136	86.8 Å²	86.8	67%	0.67	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-21.9	172.2	-66.7	-171.4	87.4	0	0	112.7	C72 R73 Q74	C72-M76 PolarHBondContact O-N 3.3Å; R73-M76 WeakPolarHBondContact O-CB 3.43Å; R73-M76 PolarHBondContact O-N 2.83Å; Q74-M76 PolarHBondContact O-N 3.45Å; Q74-M76 VanDerWaalsContact O-N 3.08Å
77	W	61.9	Low	67	Low	132 Å²	132	80.1 Å²	80.1	50%	0.5	37%	0.374	S	S	.	.	S	Bend	trans	-121.6	138.7	-176.7	-64.4	78.7	0	0	0	110.4	Q74 T75 F81	Q74-W77 PolarHBondContact O-N 2.94Å; T75-W77 VanDerWaalsContact C-N 3.32Å; W77-F81 HydrophobicContact CB-CD1 3.87Å; W77-F81 HydrophobicContact CB-CG 4.43Å; W77-F81 AromaticContact CD2-CD1 3.89Å; W77-F81 HydrophobicContact CD2-CD1 3.89Å; W77-F81 AromaticContact CD2-CE1 3.86Å; W77-F81 HydrophobicContact CD2-CE1 3.86Å; W77-F81 HydrophobicContact CD2-CG 4.32Å; W77-F81 HydrophobicContact CD2-CZ 4.26Å; W77-F81 HydrophobicContact CE3-CB 4.28Å; W77-F81 AromaticContact CE3-CD1 3.42Å; W77-F81 HydrophobicContact CE3-CD1 3.42Å; W77-F81 VanDerWaalsContact CE3-CD1 3.42Å; W77-F81 AromaticContact CE3-CD2 3.53Å; W77-F81 HydrophobicContact CE3-CD2 3.53Å; W77-F81 AromaticContact CE3-CE1 3.47Å; W77-F81 HydrophobicContact CE3-CE1 3.47Å; W77-F81 VanDerWaalsContact CE3-CE1 3.47Å; W77-F81 AromaticContact CE3-CE2 3.58Å; W77-F81 HydrophobicContact CE3-CE2 3.58Å; W77-F81 AromaticContact CE3-CG 3.45Å; W77-F81 HydrophobicContact CE3-CG 3.45Å; W77-F81 VanDerWaalsContact CE3-CG 3.45Å; W77-F81 AromaticContact CE3-CZ 3.55Å; W77-F81 HydrophobicContact CE3-CZ 3.55Å; W77-F81 HydrophobicContact CG-CD1 4.11Å; W77-F81 HydrophobicContact CG-CE1 4.33Å; W77-F81 HydrophobicContact CH2-CE2 4.3Å; W77-F81 HydrophobicContact CH2-CZ 4.17Å; W77-F81 HydrophobicContact CZ3-CD1 4.21Å; W77-F81 AromaticContact CZ3-CD2 3.67Å; W77-F81 HydrophobicContact CZ3-CD2 3.67Å; W77-F81 AromaticContact CZ3-CE1 3.93Å; W77-F81 HydrophobicContact CZ3-CE1 3.93Å; W77-F81 AromaticContact CZ3-CE2 3.34Å; W77-F81 HydrophobicContact CZ3-CE2 3.34Å; W77-F81 HydrophobicContact CZ3-CG 4.09Å; W77-F81 AromaticContact CZ3-CZ 3.48Å; W77-F81 HydrophobicContact CZ3-CZ 3.48Å; W77-F81 VanDerWaalsContact CZ3-CZ 3.48Å
78	S	79.8	Confident	69.6	Low	74 Å²	74	70.8 Å²	70.8	52%	0.517	34%	0.34	S	S	.	.			trans	-62.2	145.5	178.4	178.7	0	0	0	0	111.1	K80 F81 W82	S78-K80 PolarHBondContact O-N 3.23Å; S78-K80 VanDerWaalsContact O-N 3.11Å; S78-K80 PolarHBondContact OG-N 3.39Å; S78-F81 WeakPolarHBondContact O-CA 3.3Å; S78-F81 VanDerWaalsContact O-CB 3.3Å; S78-F81 WeakPolarHBondContact O-CB 3.31Å; S78-F81 PolarHBondContact O-N 2.98Å; S78-W82 PolarHBondContact O-N 3.32Å
79	N	83.9	Confident	72.2	Confident	58 Å²	58	60.4 Å²	60.4	31%	0.31	30%	0.304	S	S	.	.	H	α-helix	trans	-51	-35.4	171.4	-69	-36.3	0	0	0	112.2	F81 W82 M83 P270 V278	N79-F81 VanDerWaalsContact C-N 3.33Å; N79-F81 PolarHBondContact O-N 3.42Å; N79-W82 PolarHBondContact O-N 2.78Å; N79-M83 WeakPolarHBondContact O-CG 3.23Å; N79-M83 PolarHBondContact O-N 3.08Å; N79-M83 VanDerWaalsContact O-N 3.08Å; N79-P270 HydrophobicContact CB-CB 4.22Å; N79-P270 HydrophobicContact CB-CG 4.06Å; N79-V278 HydrophobicContact CB-CG2 4.26Å; N79-V278 WeakPolarHBondContact ND2-CG2 3.29Å
80	K	86.6	Confident	74.8	Confident	47 Å²	47	57.8 Å²	57.8	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-55.6	-44.2	172.3	176.5	171.5	62.9	-179.7	0	112.7	S78 W82 M83 V84 A201 T202 E206 Y210	S78-K80 PolarHBondContact O-N 3.23Å; S78-K80 VanDerWaalsContact O-N 3.11Å; S78-K80 PolarHBondContact OG-N 3.39Å; K80-W82 VanDerWaalsContact C-N 3.35Å; K80-W82 PolarHBondContact O-N 2.96Å; K80-M83 PolarHBondContact O-N 3.12Å; K80-V84 VanDerWaalsContact O-CG2 3.29Å; K80-V84 WeakPolarHBondContact O-CG2 3.07Å; K80-V84 PolarHBondContact O-N 2.89Å; K80-V84 VanDerWaalsContact O-N 3.07Å; K80-A201 WeakPolarHBondContact CD-O 3.34Å; K80-T202 HydrophobicContact CD-CG2 3.95Å; K80-T202 HydrophobicContact CG-CG2 4.4Å; K80-E206 IonicContact NZ-OE1 2.7Å; K80-E206 PolarHBondContact NZ-OE1 3.14Å; K80-E206 IonicContact NZ-OE2 2.66Å; K80-E206 PolarHBondContact NZ-OE2 3.47Å; K80-Y210 HydrophobicContact CD-CE2 4.25Å; K80-Y210 WeakPolarHBondContact CE-OH 3.33Å
81	F	89.5	Confident	77	Confident	73 Å²	73	51.8 Å²	51.8	32%	0.32	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-45	178.9	169.1	-94.9	0	0	0	111.1	W77 S78 N79 M83 V84 F85	W77-F81 HydrophobicContact CB-CD1 3.87Å; W77-F81 HydrophobicContact CB-CG 4.43Å; W77-F81 AromaticContact CD2-CD1 3.89Å; W77-F81 HydrophobicContact CD2-CD1 3.89Å; W77-F81 AromaticContact CD2-CE1 3.86Å; W77-F81 HydrophobicContact CD2-CE1 3.86Å; W77-F81 HydrophobicContact CD2-CG 4.32Å; W77-F81 HydrophobicContact CD2-CZ 4.26Å; W77-F81 HydrophobicContact CE3-CB 4.28Å; W77-F81 AromaticContact CE3-CD1 3.42Å; W77-F81 HydrophobicContact CE3-CD1 3.42Å; W77-F81 VanDerWaalsContact CE3-CD1 3.42Å; W77-F81 AromaticContact CE3-CD2 3.53Å; W77-F81 HydrophobicContact CE3-CD2 3.53Å; W77-F81 AromaticContact CE3-CE1 3.47Å; W77-F81 HydrophobicContact CE3-CE1 3.47Å; W77-F81 VanDerWaalsContact CE3-CE1 3.47Å; W77-F81 AromaticContact CE3-CE2 3.58Å; W77-F81 HydrophobicContact CE3-CE2 3.58Å; W77-F81 AromaticContact CE3-CG 3.45Å; W77-F81 HydrophobicContact CE3-CG 3.45Å; W77-F81 VanDerWaalsContact CE3-CG 3.45Å; W77-F81 AromaticContact CE3-CZ 3.55Å; W77-F81 HydrophobicContact CE3-CZ 3.55Å; W77-F81 HydrophobicContact CG-CD1 4.11Å; W77-F81 HydrophobicContact CG-CE1 4.33Å; W77-F81 HydrophobicContact CH2-CE2 4.3Å; W77-F81 HydrophobicContact CH2-CZ 4.17Å; W77-F81 HydrophobicContact CZ3-CD1 4.21Å; W77-F81 AromaticContact CZ3-CD2 3.67Å; W77-F81 HydrophobicContact CZ3-CD2 3.67Å; W77-F81 AromaticContact CZ3-CE1 3.93Å; W77-F81 HydrophobicContact CZ3-CE1 3.93Å; W77-F81 AromaticContact CZ3-CE2 3.34Å; W77-F81 HydrophobicContact CZ3-CE2 3.34Å; W77-F81 HydrophobicContact CZ3-CG 4.09Å; W77-F81 AromaticContact CZ3-CZ 3.48Å; W77-F81 HydrophobicContact CZ3-CZ 3.48Å; W77-F81 VanDerWaalsContact CZ3-CZ 3.48Å; S78-F81 WeakPolarHBondContact O-CA 3.3Å; S78-F81 VanDerWaalsContact O-CB 3.3Å; S78-F81 WeakPolarHBondContact O-CB 3.31Å; S78-F81 PolarHBondContact O-N 2.98Å; N79-F81 VanDerWaalsContact C-N 3.33Å; N79-F81 PolarHBondContact O-N 3.42Å; F81-M83 PolarHBondContact O-N 3.47Å; F81-V84 PolarHBondContact O-N 3.09Å; F81-F85 HydrophobicContact CE1-CB 4.42Å; F81-F85 HydrophobicContact CZ-CB 4.5Å; F81-F85 VanDerWaalsContact O-CB 3.25Å; F81-F85 WeakPolarHBondContact O-CB 3.46Å; F81-F85 PolarHBondContact O-N 2.88Å
82	W	89.7	Confident	79.3	Confident	39 Å²	39	50.9 Å²	50.9	15%	0.148	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-35.8	-179.3	-71.5	117.8	0	0	0	113.4	S78 N79 K80 F85 T86 S268	S78-W82 PolarHBondContact O-N 3.32Å; N79-W82 PolarHBondContact O-N 2.78Å; K80-W82 VanDerWaalsContact C-N 3.35Å; K80-W82 PolarHBondContact O-N 2.96Å; W82-F85 HydrophobicContact CE3-CD1 4.1Å; W82-F85 HydrophobicContact CZ3-CD1 4.14Å; W82-F85 HydrophobicContact CZ3-CE1 4.44Å; W82-T86 WeakPolarHBondContact O-CB 3.34Å; W82-T86 PolarHBondContact O-N 3.2Å; W82-T86 PolarHBondContact O-OG1 2.94Å; W82-S268 WeakPolarHBondContact CB-O 3.31Å; W82-S268 WeakPolarHBondContact CZ3-OG 3.41Å
83	M	92	Very high	81.8	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-50	172.6	-69	170.1	167.5	0	0	111.4	N79 K80 F81 T86 A87 A201 Y269 P270 V272	N79-M83 WeakPolarHBondContact O-CG 3.23Å; N79-M83 PolarHBondContact O-N 3.08Å; N79-M83 VanDerWaalsContact O-N 3.08Å; K80-M83 PolarHBondContact O-N 3.12Å; F81-M83 PolarHBondContact O-N 3.47Å; M83-T86 PolarHBondContact O-N 2.92Å; M83-A87 WeakPolarHBondContact O-CB 3.42Å; M83-A87 PolarHBondContact O-N 3.46Å; M83-A201 HydrophobicContact CE-CB 4.44Å; M83-A201 HydrophobicContact SD-CB 3.5Å; M83-A201 VanDerWaalsContact SD-CB 3.5Å; M83-Y269 HydrophobicContact CB-CE2 4.37Å; M83-Y269 HydrophobicContact CG-CE2 4.24Å; M83-P270 HydrophobicContact CE-CG 3.65Å; M83-P270 HydrophobicContact CG-CG 3.84Å; M83-P270 HydrophobicContact SD-CG 4.48Å; M83-V272 HydrophobicContact CE-CB 3.93Å; M83-V272 HydrophobicContact CE-CG1 4.14Å; M83-V272 HydrophobicContact CE-CG2 3.17Å
84	V	93.6	Very high	84.4	Confident	13 Å²	13	44.2 Å²	44.2	8%	0.079	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-43.2	179.9	171.4	0	0	0	0	110.8	K80 F81 T86 A87 S88 Y210	K80-V84 VanDerWaalsContact O-CG2 3.29Å; K80-V84 WeakPolarHBondContact O-CG2 3.07Å; K80-V84 PolarHBondContact O-N 2.89Å; K80-V84 VanDerWaalsContact O-N 3.07Å; F81-V84 PolarHBondContact O-N 3.09Å; V84-T86 VanDerWaalsContact C-N 3.34Å; V84-T86 PolarHBondContact O-N 3.35Å; V84-A87 PolarHBondContact O-N 3.47Å; V84-S88 VanDerWaalsContact O-CB 3.28Å; V84-S88 WeakPolarHBondContact O-CB 3.47Å; V84-S88 PolarHBondContact O-N 2.97Å; V84-S88 PolarHBondContact O-OG 3.36Å; V84-Y210 HydrophobicContact CB-CD1 4.13Å; V84-Y210 HydrophobicContact CB-CE1 4.33Å; V84-Y210 HydrophobicContact CG1-CD1 3.73Å; V84-Y210 HydrophobicContact CG1-CE1 4.16Å; V84-Y210 HydrophobicContact CG2-CD1 3.35Å; V84-Y210 HydrophobicContact CG2-CE1 3.64Å; V84-Y210 HydrophobicContact CG2-CG 4.25Å
85	F	94.7	Very high	86.5	Confident	77 Å²	77	41.3 Å²	41.3	34%	0.338	21%	0.208	S	C	.	.	H	α-helix	trans	-57.9	-48.2	176.1	178.2	-102	0	0	0	111.1	F81 W82 A87 S88 T89 I264	F81-F85 HydrophobicContact CE1-CB 4.42Å; F81-F85 HydrophobicContact CZ-CB 4.5Å; F81-F85 VanDerWaalsContact O-CB 3.25Å; F81-F85 WeakPolarHBondContact O-CB 3.46Å; F81-F85 PolarHBondContact O-N 2.88Å; W82-F85 HydrophobicContact CE3-CD1 4.1Å; W82-F85 HydrophobicContact CZ3-CD1 4.14Å; W82-F85 HydrophobicContact CZ3-CE1 4.44Å; F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 PolarHBondContact O-N 2.55Å; F85-S88 WeakPolarHBondContact O-CB 3.33Å; F85-S88 PolarHBondContact O-N 3.18Å; F85-T89 HydrophobicContact CE1-CG2 4.1Å; F85-T89 HydrophobicContact CE2-CG2 4.09Å; F85-T89 HydrophobicContact CZ-CG2 3.86Å; F85-T89 WeakPolarHBondContact O-CG2 3.42Å; F85-T89 PolarHBondContact O-N 2.97Å; F85-T89 PolarHBondContact O-OG1 3.33Å; F85-T89 VanDerWaalsContact O-OG1 3.06Å; F85-I264 HydrophobicContact CD1-CG2 4.12Å; F85-I264 HydrophobicContact CE1-CD1 4.38Å; F85-I264 HydrophobicContact CE1-CG2 3.81Å
86	T	95.7	Very high	88.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.2	-42.1	177.6	-55.9	0	0	0	0	111.6	W82 M83 V84 T89 W90 L154 H261 I265 Y269	W82-T86 WeakPolarHBondContact O-CB 3.34Å; W82-T86 PolarHBondContact O-N 3.2Å; W82-T86 PolarHBondContact O-OG1 2.94Å; M83-T86 PolarHBondContact O-N 2.92Å; V84-T86 VanDerWaalsContact C-N 3.34Å; V84-T86 PolarHBondContact O-N 3.35Å; T86-T89 WeakPolarHBondContact CA-OG1 3.48Å; T86-T89 PolarHBondContact O-N 3.28Å; T86-T89 PolarHBondContact O-OG1 3.05Å; T86-W90 VanDerWaalsContact O-CB 3.29Å; T86-W90 WeakPolarHBondContact O-CB 3.49Å; T86-W90 PolarHBondContact O-N 3.07Å; T86-L154 HydrophobicContact CG2-CD1 4.46Å; T86-H261 PolarHBondContact O-NE2 3.39Å; T86-I265 HydrophobicContact CG2-CD1 4.41Å; T86-I265 HydrophobicContact CG2-CG1 3.53Å; T86-Y269 HydrophobicContact CG2-CD2 3.71Å; T86-Y269 HydrophobicContact CG2-CE2 4.19Å
87	A	96.1	Very high	91.2	Very high	5 Å²	5	31.5 Å²	31.5	4%	0.041	16%	0.156	C	C	.	.	H	α-helix	trans	-67.4	-38.3	178.1	0	0	0	0	0	112.8	M83 V84 F85 W90 G91 L194 I198 L214	M83-A87 WeakPolarHBondContact O-CB 3.42Å; M83-A87 PolarHBondContact O-N 3.46Å; V84-A87 PolarHBondContact O-N 3.47Å; F85-A87 VanDerWaalsContact C-N 3.34Å; F85-A87 PolarHBondContact O-N 2.55Å; A87-W90 PolarHBondContact O-N 3.31Å; A87-G91 PolarHBondContact O-N 3.49Å; A87-L194 HydrophobicContact CB-CD1 3.83Å; A87-L194 HydrophobicContact CB-CD2 3.88Å; A87-L194 HydrophobicContact CB-CG 3.91Å; A87-I198 HydrophobicContact CB-CD1 3.44Å; A87-I198 VanDerWaalsContact CB-CD1 3.44Å; A87-L214 HydrophobicContact CB-CD2 3.55Å
88	S	96.3	Very high	92.5	Very high	12 Å²	12	27.3 Å²	27.3	8%	0.084	14%	0.14	C	C	.	.	H	α-helix	trans	-63.9	-45.1	173.5	-87.5	0	0	0	0	112	V84 F85 G91 F92 T217	V84-S88 VanDerWaalsContact O-CB 3.28Å; V84-S88 WeakPolarHBondContact O-CB 3.47Å; V84-S88 PolarHBondContact O-N 2.97Å; V84-S88 PolarHBondContact O-OG 3.36Å; F85-S88 WeakPolarHBondContact O-CB 3.33Å; F85-S88 PolarHBondContact O-N 3.18Å; S88-G91 PolarHBondContact O-N 2.92Å; S88-F92 VanDerWaalsContact O-CB 3.25Å; S88-F92 WeakPolarHBondContact O-CB 3.15Å; S88-F92 PolarHBondContact O-N 3.25Å; S88-T217 WeakPolarHBondContact CA-OG1 3.23Å; S88-T217 PolarHBondContact O-OG1 3.49Å; S88-T217 PolarHBondContact OG-OG1 3.41Å
89	T	96.1	Very high	92.8	Very high	27 Å²	27	24.6 Å²	24.6	17%	0.166	12%	0.122	C	C	.	.	H	α-helix	trans	-68.6	-37.5	177.1	50.1	0	0	0	0	111.8	F85 T86 F92 L93 H261	F85-T89 HydrophobicContact CE1-CG2 4.1Å; F85-T89 HydrophobicContact CE2-CG2 4.09Å; F85-T89 HydrophobicContact CZ-CG2 3.86Å; F85-T89 WeakPolarHBondContact O-CG2 3.42Å; F85-T89 PolarHBondContact O-N 2.97Å; F85-T89 PolarHBondContact O-OG1 3.33Å; F85-T89 VanDerWaalsContact O-OG1 3.06Å; T86-T89 WeakPolarHBondContact CA-OG1 3.48Å; T86-T89 PolarHBondContact O-N 3.28Å; T86-T89 PolarHBondContact O-OG1 3.05Å; T89-F92 PolarHBondContact O-N 2.88Å; T89-L93 WeakPolarHBondContact O-CB 3.37Å; T89-L93 VanDerWaalsContact O-CG 3.3Å; T89-L93 WeakPolarHBondContact O-CG 3.29Å; T89-L93 PolarHBondContact O-N 2.96Å; T89-H261 PolarHBondContact OG1-CD2 2.83Å; T89-H261 VanDerWaalsContact OG1-CD2 3.27Å; T89-H261 PolarHBondContact OG1-NE2 3.05Å
90	W	96.9	Very high	93.1	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-57.1	-56.5	171.2	179.6	-74.4	0	0	0	110.9	T86 A87 F92 L93 S94 L154 A157 N158 G187 C190 L194 W258 H261	T86-W90 VanDerWaalsContact O-CB 3.29Å; T86-W90 WeakPolarHBondContact O-CB 3.49Å; T86-W90 PolarHBondContact O-N 3.07Å; A87-W90 PolarHBondContact O-N 3.31Å; W90-F92 VanDerWaalsContact C-N 3.29Å; W90-F92 PolarHBondContact O-N 3.06Å; W90-L93 PolarHBondContact O-N 2.94Å; W90-L93 VanDerWaalsContact O-N 3.15Å; W90-S94 PolarHBondContact O-N 3.28Å; W90-S94 PolarHBondContact O-OG 3.45Å; W90-L154 HydrophobicContact CD2-CD2 4.36Å; W90-L154 HydrophobicContact CE3-CD2 3.68Å; W90-L154 HydrophobicContact CH2-CD2 4.5Å; W90-L154 HydrophobicContact CZ3-CD2 3.74Å; W90-A157 HydrophobicContact CH2-CB 3.54Å; W90-A157 HydrophobicContact CZ3-CB 4.14Å; W90-N158 WeakPolarHBondContact CZ3-OD1 3.39Å; W90-G187 WeakPolarHBondContact CH2-O 3.25Å; W90-G187 WeakPolarHBondContact CZ2-O 3.27Å; W90-C190 HydrophobicContact CH2-CB 4.11Å; W90-C190 HydrophobicContact CZ2-CB 4.16Å; W90-L194 HydrophobicContact CB-CD2 4.33Å; W90-L194 HydrophobicContact CG-CD2 4.15Å; W90-W258 HydrophobicContact CD2-CH2 4.25Å; W90-W258 HydrophobicContact CD2-CZ3 4.12Å; W90-W258 AromaticContact CE3-CZ3 3.97Å; W90-W258 HydrophobicContact CE3-CZ3 3.97Å; W90-W258 HydrophobicContact CZ3-CZ3 4.21Å; W90-H261 AromaticContact CE3-CE1 3.76Å; W90-H261 PolarHBondContact N-NE2 3.06Å
91	G	95.2	Very high	93.3	Very high	3 Å²	3	19.6 Å²	19.6	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-36.5	-179	0	0	0	0	0	113.1	A87 S88 N95	A87-G91 PolarHBondContact O-N 3.49Å; S88-G91 PolarHBondContact O-N 2.92Å; G91-N95 PolarHBondContact O-N 2.98Å; G91-N95 PolarHBondContact O-ND2 3.35Å
92	F	95.4	Very high	93.1	Very high	47 Å²	47	18.6 Å²	18.6	21%	0.206	10%	0.095	C	C	.	.	H	α-helix	trans	-60.1	-53.6	171.6	169.8	-98.6	0	0	0	111.4	S88 T89 W90 S94 N95 V96 I220 G221 F224	S88-F92 VanDerWaalsContact O-CB 3.25Å; S88-F92 WeakPolarHBondContact O-CB 3.15Å; S88-F92 PolarHBondContact O-N 3.25Å; T89-F92 PolarHBondContact O-N 2.88Å; W90-F92 VanDerWaalsContact C-N 3.29Å; W90-F92 PolarHBondContact O-N 3.06Å; F92-S94 PolarHBondContact O-N 3.22Å; F92-N95 PolarHBondContact O-N 3.36Å; F92-N95 VanDerWaalsContact O-N 3.14Å; F92-V96 HydrophobicContact CD1-CG2 4.25Å; F92-V96 HydrophobicContact CD2-CG2 4.35Å; F92-V96 HydrophobicContact CE1-CG2 3.8Å; F92-V96 HydrophobicContact CE2-CG2 3.9Å; F92-V96 HydrophobicContact CZ-CG2 3.61Å; F92-V96 WeakPolarHBondContact O-CG2 3.38Å; F92-V96 PolarHBondContact O-N 3.32Å; F92-I220 HydrophobicContact CD2-CB 4.43Å; F92-I220 HydrophobicContact CD2-CG2 4.21Å; F92-I220 HydrophobicContact CE2-CG2 3.97Å; F92-G221 VanDerWaalsContact CD2-CA 3.47Å; F92-F224 HydrophobicContact CE2-CD2 4.16Å; F92-F224 HydrophobicContact CE2-CG 4.32Å; F92-F224 HydrophobicContact CZ-CG 4.32Å
93	L	96.3	Very high	92.7	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.063	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-41.8	-177.5	-71.5	-176.7	0	0	0	112.8	T89 W90 N95 V96 E97 M254 L257 W258 H261	T89-L93 WeakPolarHBondContact O-CB 3.37Å; T89-L93 VanDerWaalsContact O-CG 3.3Å; T89-L93 WeakPolarHBondContact O-CG 3.29Å; T89-L93 PolarHBondContact O-N 2.96Å; W90-L93 PolarHBondContact O-N 2.94Å; W90-L93 VanDerWaalsContact O-N 3.15Å; L93-N95 PolarHBondContact O-N 2.99Å; L93-V96 PolarHBondContact O-N 3.48Å; L93-E97 WeakPolarHBondContact O-CB 3.28Å; L93-E97 PolarHBondContact O-N 2.9Å; L93-M254 HydrophobicContact CB-CE 4.37Å; L93-L257 HydrophobicContact CD1-CB 4.33Å; L93-L257 HydrophobicContact CD2-CB 3.79Å; L93-L257 HydrophobicContact CD2-CD1 3.88Å; L93-L257 HydrophobicContact CD2-CD2 4.4Å; L93-L257 HydrophobicContact CD2-CG 4.24Å; L93-W258 HydrophobicContact CB-CE3 4.49Å; L93-W258 HydrophobicContact CB-CH2 3.71Å; L93-W258 HydrophobicContact CB-CZ2 3.86Å; L93-W258 HydrophobicContact CB-CZ3 4.05Å; L93-W258 HydrophobicContact CD1-CD2 4.34Å; L93-W258 HydrophobicContact CD1-CE3 3.95Å; L93-W258 HydrophobicContact CD1-CZ3 4.06Å; L93-H261 HydrophobicContact CD1-CB 3.65Å
94	S	94.8	Very high	92.4	Very high	23 Å²	23	20.8 Å²	20.8	16%	0.161	11%	0.114	C	C	.	.	H	α-helix	trans	-59.1	-34	175.5	-56.9	0	0	0	0	112.6	W90 F92 R98	W90-S94 PolarHBondContact O-N 3.28Å; W90-S94 PolarHBondContact O-OG 3.45Å; F92-S94 PolarHBondContact O-N 3.22Å; S94-R98 PolarHBondContact O-N 3.28Å
95	N	92.8	Very high	92.2	Very high	11 Å²	11	20.2 Å²	20.2	6%	0.059	11%	0.111	C	C	.	.	H	α-helix	trans	-82.4	-32.3	177.9	-78.7	-86.8	0	0	0	112.9	G91 F92 L93 E97 A99 R218 L222	G91-N95 PolarHBondContact O-N 2.98Å; G91-N95 PolarHBondContact O-ND2 3.35Å; F92-N95 PolarHBondContact O-N 3.36Å; F92-N95 VanDerWaalsContact O-N 3.14Å; L93-N95 PolarHBondContact O-N 2.99Å; N95-E97 VanDerWaalsContact C-N 3.34Å; N95-A99 VanDerWaalsContact O-CB 3.27Å; N95-A99 WeakPolarHBondContact O-CB 3.39Å; N95-A99 PolarHBondContact O-N 3.49Å; N95-R218 WeakPolarHBondContact CB-O 3.36Å; N95-R218 WeakPolarHBondContact ND2-CB 3.41Å; N95-L222 HydrophobicContact CB-CD2 3.99Å; N95-L222 HydrophobicContact CB-CG 3.99Å
96	V	92.9	Very high	91.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.8	-50.1	167.8	171.7	0	0	0	0	109.6	F92 L93 R98 A99 V100 F224 F228 M254	F92-V96 HydrophobicContact CD1-CG2 4.25Å; F92-V96 HydrophobicContact CD2-CG2 4.35Å; F92-V96 HydrophobicContact CE1-CG2 3.8Å; F92-V96 HydrophobicContact CE2-CG2 3.9Å; F92-V96 HydrophobicContact CZ-CG2 3.61Å; F92-V96 WeakPolarHBondContact O-CG2 3.38Å; F92-V96 PolarHBondContact O-N 3.32Å; L93-V96 PolarHBondContact O-N 3.48Å; V96-R98 VanDerWaalsContact C-N 3.35Å; V96-R98 PolarHBondContact O-N 2.84Å; V96-A99 PolarHBondContact O-N 2.93Å; V96-V100 HydrophobicContact CG1-CG1 4.38Å; V96-V100 WeakPolarHBondContact O-CG2 3.46Å; V96-V100 PolarHBondContact O-N 3.49Å; V96-F224 HydrophobicContact CG2-CB 4.23Å; V96-F228 HydrophobicContact CG1-CD2 3.68Å; V96-F228 HydrophobicContact CG1-CE2 3.77Å; V96-F228 HydrophobicContact CG2-CE2 4.35Å; V96-M254 HydrophobicContact CG1-SD 3.95Å
97	E	94.5	Very high	91.4	Very high	3 Å²	3	23.5 Å²	23.5	1%	0.014	13%	0.125	C	C	.	.	H	α-helix	trans	-54.3	-50.9	179.6	-176	166.8	144.8	0	0	111.9	L93 N95 A99 V100 I101 N165 R181 M254 W258	L93-E97 WeakPolarHBondContact O-CB 3.28Å; L93-E97 PolarHBondContact O-N 2.9Å; N95-E97 VanDerWaalsContact C-N 3.34Å; E97-A99 VanDerWaalsContact C-N 3.29Å; E97-A99 PolarHBondContact O-N 2.98Å; E97-V100 WeakPolarHBondContact O-CG2 3.4Å; E97-V100 PolarHBondContact O-N 3.35Å; E97-I101 HydrophobicContact CG-CD1 3.58Å; E97-I101 HydrophobicContact CG-CG1 4.33Å; E97-I101 WeakPolarHBondContact O-CB 3.34Å; E97-I101 WeakPolarHBondContact O-CG1 3.44Å; E97-I101 PolarHBondContact O-N 3.36Å; E97-N165 PolarHBondContact OE2-ND2 2.89Å; E97-R181 IonicContact OE1-CZ 3.98Å; E97-R181 VanDerWaalsContact OE1-CZ 3.3Å; E97-R181 IonicContact OE1-NH1 2.76Å; E97-R181 PolarHBondContact OE1-NH1 3.14Å; E97-R181 IonicContact OE1-NH2 3.28Å; E97-R181 PolarHBondContact OE1-NH2 2.86Å; E97-M254 HydrophobicContact CB-CE 3.68Å; E97-M254 HydrophobicContact CB-CG 4.06Å; E97-M254 HydrophobicContact CB-SD 3.88Å; E97-M254 HydrophobicContact CG-CE 4.35Å; E97-M254 HydrophobicContact CG-CG 3.96Å; E97-M254 HydrophobicContact CG-SD 4.44Å; E97-W258 PolarHBondContact OE2-NE1 3.17Å
98	R	89.9	Confident	91.2	Very high	43 Å²	43	23.4 Å²	23.4	16%	0.162	12%	0.124	C	C	.	.	H	α-helix	trans	-55.6	-46.4	176.3	-178.9	-178	174.6	148.7	6.4	111.4	S94 V96 V100 L102 M352 E355	S94-R98 PolarHBondContact O-N 3.28Å; V96-R98 VanDerWaalsContact C-N 3.35Å; V96-R98 PolarHBondContact O-N 2.84Å; R98-V100 PolarHBondContact O-N 2.96Å; R98-L102 HydrophobicContact CG-CD1 3.6Å; R98-L102 HydrophobicContact CG-CG 4.26Å; R98-L102 WeakPolarHBondContact O-CB 3.27Å; R98-L102 WeakPolarHBondContact O-CG 3.17Å; R98-L102 PolarHBondContact O-N 3.45Å; R98-M352 PolarHBondContact NH1-SD 3.18Å; R98-M352 PolarHBondContact NH2-SD 3.43Å; R98-E355 IonicContact CZ-OE1 2.69Å; R98-E355 IonicContact CZ-OE2 2.75Å; R98-E355 IonicContact NE-OE1 3.3Å; R98-E355 IonicContact NH2-OE1 3.64Å; R98-E355 PolarHBondContact NH2-OE1 3.22Å; R98-E355 IonicContact NH2-OE2 2.84Å; R98-E355 PolarHBondContact NH2-OE2 3.26Å
99	A	86.7	Confident	91.1	Very high	17 Å²	17	22.8 Å²	22.8	14%	0.14	12%	0.12	C	C	.	.	H	α-helix	trans	-74.6	-21.5	-173.5	0	0	0	0	0	113.9	N95 V96 E97 P103 L222	N95-A99 VanDerWaalsContact O-CB 3.27Å; N95-A99 WeakPolarHBondContact O-CB 3.39Å; N95-A99 PolarHBondContact O-N 3.49Å; V96-A99 PolarHBondContact O-N 2.93Å; E97-A99 VanDerWaalsContact C-N 3.29Å; E97-A99 PolarHBondContact O-N 2.98Å; A99-P103 WeakPolarHBondContact O-CD 3.44Å; A99-P103 WeakPolarHBondContact O-CG 3.23Å; A99-L222 HydrophobicContact CB-CD2 4.27Å
100	V	88.8	Confident	90.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-93.8	-34.4	175.6	-60.9	0	0	0	0	113.4	V96 E97 R98 T104 F228 M232 P250 M254	V96-V100 HydrophobicContact CG1-CG1 4.38Å; V96-V100 WeakPolarHBondContact O-CG2 3.46Å; V96-V100 PolarHBondContact O-N 3.49Å; E97-V100 WeakPolarHBondContact O-CG2 3.4Å; E97-V100 PolarHBondContact O-N 3.35Å; R98-V100 PolarHBondContact O-N 2.96Å; V100-T104 PolarHBondContact O-OG1 3.15Å; V100-F228 HydrophobicContact CG1-CB 3.67Å; V100-F228 HydrophobicContact CG1-CD2 4.5Å; V100-M232 HydrophobicContact CB-CE 4.12Å; V100-M232 HydrophobicContact CG1-CE 4.24Å; V100-P250 HydrophobicContact CB-CB 4.44Å; V100-P250 HydrophobicContact CG2-CB 4Å; V100-M254 HydrophobicContact CG2-CG 4.39Å; V100-M254 HydrophobicContact CG2-SD 4.5Å
101	I	91.1	Very high	90.5	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-81.7	-46.9	-176.2	-67	-179	0	0	0	111.9	E97 T104 L105 Y168 P250	E97-I101 HydrophobicContact CG-CD1 3.58Å; E97-I101 HydrophobicContact CG-CG1 4.33Å; E97-I101 WeakPolarHBondContact O-CB 3.34Å; E97-I101 WeakPolarHBondContact O-CG1 3.44Å; E97-I101 PolarHBondContact O-N 3.36Å; I101-T104 PolarHBondContact O-N 2.97Å; I101-T104 PolarHBondContact O-OG1 3.21Å; I101-T104 VanDerWaalsContact O-OG1 3.14Å; I101-L105 HydrophobicContact CG2-CB 4.47Å; I101-L105 VanDerWaalsContact O-CB 3.29Å; I101-L105 WeakPolarHBondContact O-CB 3.5Å; I101-L105 PolarHBondContact O-N 3.36Å; I101-Y168 HydrophobicContact CG2-CE2 4.09Å; I101-P250 HydrophobicContact CG1-CB 3.77Å
102	L	86	Confident	90.4	Very high	52 Å²	52	35.8 Å²	35.8	27%	0.272	17%	0.173	S	C	.	.	H	α-helix	trans	-58.7	-44.9	-172.9	-71.7	-179.5	0	0	0	113.5	R98 T104 V126	R98-L102 HydrophobicContact CG-CD1 3.6Å; R98-L102 HydrophobicContact CG-CG 4.26Å; R98-L102 WeakPolarHBondContact O-CB 3.27Å; R98-L102 WeakPolarHBondContact O-CG 3.17Å; R98-L102 PolarHBondContact O-N 3.45Å; L102-T104 VanDerWaalsContact C-N 3.28Å; L102-T104 PolarHBondContact O-N 3.09Å; L102-V126 HydrophobicContact CD2-CG2 4.08Å
103	P	80.1	Confident	90.5	Very high	81 Å²	81	36.3 Å²	36.3	53%	0.526	17%	0.174	S	C	.	.	H	α-helix	trans	-67.3	-28	179.9	-21.4	34.8	0	0	0	113.7	A99	A99-P103 WeakPolarHBondContact O-CD 3.44Å; A99-P103 WeakPolarHBondContact O-CG 3.23Å
104	T	86	Confident	90.3	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.043	19%	0.187	C	C	.	.	H	α-helix	trans	-95.5	-18.6	-175	54.9	0	0	0	0	113	V100 I101 L102 W106 L107 Y108	V100-T104 PolarHBondContact O-OG1 3.15Å; I101-T104 PolarHBondContact O-N 2.97Å; I101-T104 PolarHBondContact O-OG1 3.21Å; I101-T104 VanDerWaalsContact O-OG1 3.14Å; L102-T104 VanDerWaalsContact C-N 3.28Å; L102-T104 PolarHBondContact O-N 3.09Å; T104-W106 PolarHBondContact O-N 3.49Å; T104-L107 PolarHBondContact O-N 3.44Å; T104-Y108 WeakPolarHBondContact O-CB 3.44Å; T104-Y108 PolarHBondContact O-N 3.5Å
105	L	89.6	Confident	90.1	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-45.6	-172.2	175.9	64.2	0	0	0	114.1	I101 L107 Y108 L109 Y122 T125 V126 Y168 V177	I101-L105 HydrophobicContact CG2-CB 4.47Å; I101-L105 VanDerWaalsContact O-CB 3.29Å; I101-L105 WeakPolarHBondContact O-CB 3.5Å; I101-L105 PolarHBondContact O-N 3.36Å; L105-L107 VanDerWaalsContact C-N 3.35Å; L105-Y108 WeakPolarHBondContact O-CB 3.46Å; L105-Y108 PolarHBondContact O-N 3.07Å; L105-L109 HydrophobicContact CD1-CD1 4.4Å; L105-L109 WeakPolarHBondContact O-CG 3.29Å; L105-L109 PolarHBondContact O-N 3.3Å; L105-Y122 HydrophobicContact CB-CD2 4.39Å; L105-Y122 HydrophobicContact CB-CE2 4.2Å; L105-Y122 HydrophobicContact CD2-CD2 3.92Å; L105-Y122 HydrophobicContact CD2-CE2 3.93Å; L105-Y122 HydrophobicContact CG-CD2 3.91Å; L105-Y122 HydrophobicContact CG-CE2 4.12Å; L105-T125 HydrophobicContact CD1-CG2 3.83Å; L105-T125 HydrophobicContact CD2-CG2 3.76Å; L105-T125 HydrophobicContact CG-CG2 4.39Å; L105-V126 HydrophobicContact CD2-CG2 3.79Å; L105-Y168 HydrophobicContact CD1-CE2 4.03Å; L105-V177 HydrophobicContact CD1-CG1 3.77Å
106	W	87.5	Confident	90.1	Very high	81 Å²	81	44.1 Å²	44.1	31%	0.307	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-42.3	178.9	-179.6	86.3	0	0	0	111.2	T104 Y108 L109 K110 N119 Y122	T104-W106 PolarHBondContact O-N 3.49Å; W106-Y108 VanDerWaalsContact C-N 3.31Å; W106-Y108 PolarHBondContact O-N 3.24Å; W106-L109 PolarHBondContact O-N 3.41Å; W106-K110 HydrophobicContact CE3-CD 4.29Å; W106-K110 HydrophobicContact CH2-CD 3.37Å; W106-K110 HydrophobicContact CZ2-CD 3.87Å; W106-K110 HydrophobicContact CZ3-CD 3.59Å; W106-K110 WeakPolarHBondContact O-CB 3.24Å; W106-K110 PolarHBondContact O-N 2.65Å; W106-N119 PolarHBondContact NE1-OD1 3.36Å; W106-Y122 HydrophobicContact CB-CD2 3.67Å; W106-Y122 HydrophobicContact CB-CE2 3.89Å; W106-Y122 HydrophobicContact CB-CG 4.27Å; W106-Y122 HydrophobicContact CG-CD2 4.44Å
107	L	85.9	Confident	90.1	Very high	64 Å²	64	45.9 Å²	45.9	34%	0.335	24%	0.238	S	C	.	.	H	α-helix	trans	-64.3	-37.6	175.8	-64.5	170.7	0	0	0	111.6	T104 L105 K110 E111 Y247	T104-L107 PolarHBondContact O-N 3.44Å; L105-L107 VanDerWaalsContact C-N 3.35Å; L107-K110 PolarHBondContact O-N 3.18Å; L107-E111 VanDerWaalsContact O-CB 3.25Å; L107-E111 WeakPolarHBondContact O-CB 3.48Å; L107-E111 PolarHBondContact O-N 3.44Å; L107-Y247 HydrophobicContact CB-CD1 3.93Å; L107-Y247 HydrophobicContact CB-CE1 3.53Å; L107-Y247 HydrophobicContact CD1-CE1 4.42Å
108	Y	91.9	Very high	89.9	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.012	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-49.4	175.5	-176.5	-159.8	0	0	0	110.9	T104 L105 W106 K110 Y112 W113 Y168 V177 Y247 N248	T104-Y108 WeakPolarHBondContact O-CB 3.44Å; T104-Y108 PolarHBondContact O-N 3.5Å; L105-Y108 WeakPolarHBondContact O-CB 3.46Å; L105-Y108 PolarHBondContact O-N 3.07Å; W106-Y108 VanDerWaalsContact C-N 3.31Å; W106-Y108 PolarHBondContact O-N 3.24Å; Y108-K110 VanDerWaalsContact C-N 3.33Å; Y108-K110 PolarHBondContact O-N 3Å; Y108-Y112 AromaticContact CD2-CD2 3.39Å; Y108-Y112 HydrophobicContact CD2-CD2 3.39Å; Y108-Y112 AromaticContact CD2-CE2 3.58Å; Y108-Y112 HydrophobicContact CD2-CE2 3.58Å; Y108-Y112 HydrophobicContact CD2-CG 4.29Å; Y108-Y112 AromaticContact CE2-CD2 3.42Å; Y108-Y112 HydrophobicContact CE2-CD2 3.42Å; Y108-Y112 VanDerWaalsContact CE2-CD2 3.42Å; Y108-Y112 AromaticContact CE2-CE2 3.45Å; Y108-Y112 HydrophobicContact CE2-CE2 3.45Å; Y108-Y112 VanDerWaalsContact CE2-CE2 3.45Å; Y108-Y112 HydrophobicContact CE2-CG 4.01Å; Y108-Y112 WeakPolarHBondContact O-CD2 3.4Å; Y108-Y112 PolarHBondContact O-N 3.46Å; Y108-W113 HydrophobicContact CD2-CZ3 4.36Å; Y108-W113 HydrophobicContact CE2-CH2 4.14Å; Y108-W113 HydrophobicContact CE2-CZ3 4.11Å; Y108-Y168 HydrophobicContact CD1-CE1 4.07Å; Y108-Y168 HydrophobicContact CD1-CE2 4.05Å; Y108-Y168 AromaticContact CD1-CZ 3.62Å; Y108-Y168 HydrophobicContact CE1-CD1 4.38Å; Y108-Y168 AromaticContact CE1-CE1 3.99Å; Y108-Y168 HydrophobicContact CE1-CE1 3.99Å; Y108-Y168 HydrophobicContact CE1-CE2 4.18Å; Y108-Y168 AromaticContact CE1-CZ 3.89Å; Y108-Y168 PolarHBondContact OH-O 2.95Å; Y108-V177 HydrophobicContact CD1-CG1 4.45Å; Y108-V177 HydrophobicContact CD1-CG2 4.4Å; Y108-V177 HydrophobicContact CE1-CG1 4.39Å; Y108-V177 HydrophobicContact CE1-CG2 3.84Å; Y108-Y247 VanDerWaalsContact CD2-CB 3.49Å; Y108-Y247 HydrophobicContact CD2-CG 4.46Å; Y108-N248 HydrophobicContact CE2-CB 4.36Å
109	L	94.4	Very high	89.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-40.4	178.6	-68.2	168.6	0	0	0	111.9	L105 W106 W113 A118 H121 P174 V177	L105-L109 HydrophobicContact CD1-CD1 4.4Å; L105-L109 WeakPolarHBondContact O-CG 3.29Å; L105-L109 PolarHBondContact O-N 3.3Å; W106-L109 PolarHBondContact O-N 3.41Å; L109-W113 HydrophobicContact CD2-CE3 4.07Å; L109-W113 HydrophobicContact CD2-CZ3 4.05Å; L109-W113 PolarHBondContact O-N 3.36Å; L109-A118 HydrophobicContact CB-CB 3.8Å; L109-H121 HydrophobicContact CD1-CB 4.13Å; L109-H121 HydrophobicContact CD2-CB 4.36Å; L109-P174 HydrophobicContact CD2-CB 4.18Å; L109-V177 HydrophobicContact CD2-CG2 4.39Å
110	K	90.8	Very high	89.9	Confident	92 Å²	92	52.3 Å²	52.3	40%	0.4	28%	0.277	S	S	.	.	H	α-helix	trans	-69	-43.6	-178.7	178.9	177.2	172	-173.1	0	112.6	W106 L107 Y108 G114 A118	W106-K110 HydrophobicContact CE3-CD 4.29Å; W106-K110 HydrophobicContact CH2-CD 3.37Å; W106-K110 HydrophobicContact CZ2-CD 3.87Å; W106-K110 HydrophobicContact CZ3-CD 3.59Å; W106-K110 WeakPolarHBondContact O-CB 3.24Å; W106-K110 PolarHBondContact O-N 2.65Å; L107-K110 PolarHBondContact O-N 3.18Å; Y108-K110 VanDerWaalsContact C-N 3.33Å; Y108-K110 PolarHBondContact O-N 3Å; K110-G114 WeakPolarHBondContact O-CA 3.45Å; K110-G114 PolarHBondContact O-N 3.1Å; K110-A118 HydrophobicContact CB-CB 3.87Å
111	E	89.4	Confident	90.1	Very high	125 Å²	125	54.7 Å²	54.7	58%	0.584	29%	0.288	S	S	*	.	H	α-helix	trans	-66.5	-43.7	-176.7	-177	65.5	-169.1	0	0	111.5	L107 Y247	L107-E111 VanDerWaalsContact O-CB 3.25Å; L107-E111 WeakPolarHBondContact O-CB 3.48Å; L107-E111 PolarHBondContact O-N 3.44Å; E111-Y247 HydrophobicContact CB-CD2 4.28Å; E111-Y247 HydrophobicContact CB-CE2 3.98Å; E111-Y247 HydrophobicContact CG-CD2 4.12Å; E111-Y247 HydrophobicContact CG-CE2 3.66Å
112	Y	94.2	Very high	90	Very high	87 Å²	87	58.6 Å²	58.6	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-88.4	-28.8	-174.5	-77.9	-97.3	0	0	0	114	Y108 N245 Y247	Y108-Y112 AromaticContact CD2-CD2 3.39Å; Y108-Y112 HydrophobicContact CD2-CD2 3.39Å; Y108-Y112 AromaticContact CD2-CE2 3.58Å; Y108-Y112 HydrophobicContact CD2-CE2 3.58Å; Y108-Y112 HydrophobicContact CD2-CG 4.29Å; Y108-Y112 AromaticContact CE2-CD2 3.42Å; Y108-Y112 HydrophobicContact CE2-CD2 3.42Å; Y108-Y112 VanDerWaalsContact CE2-CD2 3.42Å; Y108-Y112 AromaticContact CE2-CE2 3.45Å; Y108-Y112 HydrophobicContact CE2-CE2 3.45Å; Y108-Y112 VanDerWaalsContact CE2-CE2 3.45Å; Y108-Y112 HydrophobicContact CE2-CG 4.01Å; Y108-Y112 WeakPolarHBondContact O-CD2 3.4Å; Y108-Y112 PolarHBondContact O-N 3.46Å; Y112-N245 PolarHBondContact OH-ND2 3.13Å; Y112-N245 PolarHBondContact OH-OD1 3.09Å; Y112-Y247 HydrophobicContact CE2-CD2 4.09Å
113	W	96.3	Very high	90	Very high	59 Å²	59	58.2 Å²	58.2	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-132.5	4.8	-174.1	-56.4	-78.6	0	0	0	114.8	Y108 L109 V117 A171 P172 V173 P174 V177	Y108-W113 HydrophobicContact CD2-CZ3 4.36Å; Y108-W113 HydrophobicContact CE2-CH2 4.14Å; Y108-W113 HydrophobicContact CE2-CZ3 4.11Å; L109-W113 HydrophobicContact CD2-CE3 4.07Å; L109-W113 HydrophobicContact CD2-CZ3 4.05Å; L109-W113 PolarHBondContact O-N 3.36Å; W113-V117 HydrophobicContact CB-CB 3.89Å; W113-V117 HydrophobicContact CB-CG1 3.69Å; W113-V117 HydrophobicContact CB-CG2 4.11Å; W113-V117 HydrophobicContact CG-CG1 4.48Å; W113-V117 WeakPolarHBondContact O-CB 3.48Å; W113-V117 VanDerWaalsContact O-CG2 3.23Å; W113-V117 WeakPolarHBondContact O-CG2 3.25Å; W113-A171 HydrophobicContact CH2-CB 4.41Å; W113-P172 PolarHBondContact NE1-O 2.85Å; W113-V173 VanDerWaalsContact CZ2-C 3.48Å; W113-P174 HydrophobicContact CB-CG 4.04Å; W113-P174 HydrophobicContact CD2-CB 4.5Å; W113-P174 HydrophobicContact CD2-CG 3.63Å; W113-P174 HydrophobicContact CE3-CG 4.12Å; W113-P174 HydrophobicContact CG-CG 3.58Å; W113-V177 HydrophobicContact CH2-CG2 3.83Å; W113-V177 HydrophobicContact CZ3-CG2 4.01Å
114	G	93.3	Very high	90.6	Very high	32 Å²	32	58 Å²	58	33%	0.33	31%	0.309	S	S	.	.			trans	88.3	166.9	175	0	0	0	0	0	115.1	K110 D116 V117 A118	K110-G114 WeakPolarHBondContact O-CA 3.45Å; K110-G114 PolarHBondContact O-N 3.1Å; G114-D116 PolarHBondContact O-N 3.23Å; G114-V117 PolarHBondContact O-N 3.3Å; G114-A118 PolarHBondContact O-N 3.42Å
115	A	91	Very high	90.9	Very high	43 Å²	43	57.7 Å²	57.7	36%	0.355	31%	0.307	S	S	.	.	H	α-helix	trans	-65.5	-37.1	-172.6	0	0	0	0	0	113.7	V117 A118 N119	A115-V117 PolarHBondContact O-N 3.19Å; A115-A118 PolarHBondContact O-N 2.92Å; A115-N119 WeakPolarHBondContact O-CB 3.4Å; A115-N119 VanDerWaalsContact O-CG 3.27Å; A115-N119 PolarHBondContact O-N 2.81Å; A115-N119 PolarHBondContact O-ND2 3.25Å
116	D	92.4	Very high	91	Very high	135 Å²	135	59.9 Å²	59.9	72%	0.722	32%	0.32	S	S	*	.	H	α-helix	trans	-64.8	-41.1	179.8	-62.2	-34.5	0	0	0	111.6	G114 T120	G114-D116 PolarHBondContact O-N 3.23Å; D116-T120 WeakPolarHBondContact O-CG2 3.49Å; D116-T120 PolarHBondContact O-N 3.22Å; D116-T120 PolarHBondContact O-OG1 2.93Å
117	V	93.3	Very high	91.1	Very high	37 Å²	37	58.1 Å²	58.1	22%	0.224	32%	0.323	C	S	.	.	H	α-helix	trans	-67.7	-43.6	175.3	176.8	0	0	0	0	110.5	W113 G114 A115 N119 T120 H121 P174	W113-V117 HydrophobicContact CB-CB 3.89Å; W113-V117 HydrophobicContact CB-CG1 3.69Å; W113-V117 HydrophobicContact CB-CG2 4.11Å; W113-V117 HydrophobicContact CG-CG1 4.48Å; W113-V117 WeakPolarHBondContact O-CB 3.48Å; W113-V117 VanDerWaalsContact O-CG2 3.23Å; W113-V117 WeakPolarHBondContact O-CG2 3.25Å; G114-V117 PolarHBondContact O-N 3.3Å; A115-V117 PolarHBondContact O-N 3.19Å; V117-N119 PolarHBondContact O-N 3.45Å; V117-T120 WeakPolarHBondContact CA-OG1 3.45Å; V117-T120 PolarHBondContact O-N 3.37Å; V117-T120 PolarHBondContact O-OG1 2.81Å; V117-H121 VanDerWaalsContact O-CB 3.29Å; V117-H121 WeakPolarHBondContact O-CB 3.27Å; V117-H121 PolarHBondContact O-N 3.47Å; V117-H121 PolarHBondContact O-ND1 3.28Å; V117-P174 HydrophobicContact CG1-CB 3.86Å; V117-P174 HydrophobicContact CG1-CG 3.38Å
118	A	89	Confident	91.6	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-46.1	176.7	0	0	0	0	0	112.3	L109 K110 G114 A115 T120 H121 Y122	L109-A118 HydrophobicContact CB-CB 3.8Å; K110-A118 HydrophobicContact CB-CB 3.87Å; G114-A118 PolarHBondContact O-N 3.42Å; A115-A118 PolarHBondContact O-N 2.92Å; A118-T120 VanDerWaalsContact C-N 3.31Å; A118-T120 PolarHBondContact O-N 3.27Å; A118-H121 PolarHBondContact O-N 3.27Å; A118-Y122 WeakPolarHBondContact O-CB 3.46Å; A118-Y122 PolarHBondContact O-N 2.93Å
119	N	86.8	Confident	91.7	Very high	108 Å²	108	57.4 Å²	57.4	58%	0.578	32%	0.32	S	S	*	.	H	α-helix	trans	-64.9	-33.2	179.8	-71.2	-24	0	0	0	113.1	W106 A115 V117	W106-N119 PolarHBondContact NE1-OD1 3.36Å; A115-N119 WeakPolarHBondContact O-CB 3.4Å; A115-N119 VanDerWaalsContact O-CG 3.27Å; A115-N119 PolarHBondContact O-N 2.81Å; A115-N119 PolarHBondContact O-ND2 3.25Å; V117-N119 PolarHBondContact O-N 3.45Å
120	T	90	Very high	91.7	Very high	89 Å²	89	58.2 Å²	58.2	55%	0.546	33%	0.325	S	S	.	.	H	α-helix	trans	-84.3	-34.1	179.3	50.2	0	0	0	0	113.2	D116 V117 A118 T124	D116-T120 WeakPolarHBondContact O-CG2 3.49Å; D116-T120 PolarHBondContact O-N 3.22Å; D116-T120 PolarHBondContact O-OG1 2.93Å; V117-T120 WeakPolarHBondContact CA-OG1 3.45Å; V117-T120 PolarHBondContact O-N 3.37Å; V117-T120 PolarHBondContact O-OG1 2.81Å; A118-T120 VanDerWaalsContact C-N 3.31Å; A118-T120 PolarHBondContact O-N 3.27Å; T120-T124 PolarHBondContact O-OG1 3.18Å
121	H	92.6	Very high	91.9	Very high	50 Å²	50	57.8 Å²	57.8	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-99.1	-22.7	-172	-69.9	66.2	0	0	0	114	L109 V117 A118 T124 T125 P174	L109-H121 HydrophobicContact CD1-CB 4.13Å; L109-H121 HydrophobicContact CD2-CB 4.36Å; V117-H121 VanDerWaalsContact O-CB 3.29Å; V117-H121 WeakPolarHBondContact O-CB 3.27Å; V117-H121 PolarHBondContact O-N 3.47Å; V117-H121 PolarHBondContact O-ND1 3.28Å; A118-H121 PolarHBondContact O-N 3.27Å; H121-T124 PolarHBondContact O-N 2.82Å; H121-T125 VanDerWaalsContact O-CB 3.31Å; H121-T125 WeakPolarHBondContact O-CB 3.34Å; H121-T125 PolarHBondContact O-N 3.34Å; H121-T125 PolarHBondContact O-OG1 3.4Å; H121-P174 HydrophobicContact CB-CB 4.45Å; H121-P174 VanDerWaalsContact CD2-CB 3.5Å; H121-P174 WeakPolarHBondContact CD2-CB 3.31Å
122	Y	88.7	Confident	92.3	Very high	84 Å²	84	52.1 Å²	52.1	33%	0.329	30%	0.301	S	S	.	.	H	α-helix	trans	-58.8	-53.8	-178.4	173	-102.7	0	0	0	112	L105 W106 A118 T124 T125 V126	L105-Y122 HydrophobicContact CB-CD2 4.39Å; L105-Y122 HydrophobicContact CB-CE2 4.2Å; L105-Y122 HydrophobicContact CD2-CD2 3.92Å; L105-Y122 HydrophobicContact CD2-CE2 3.93Å; L105-Y122 HydrophobicContact CG-CD2 3.91Å; L105-Y122 HydrophobicContact CG-CE2 4.12Å; W106-Y122 HydrophobicContact CB-CD2 3.67Å; W106-Y122 HydrophobicContact CB-CE2 3.89Å; W106-Y122 HydrophobicContact CB-CG 4.27Å; W106-Y122 HydrophobicContact CG-CD2 4.44Å; A118-Y122 WeakPolarHBondContact O-CB 3.46Å; A118-Y122 PolarHBondContact O-N 2.93Å; Y122-T124 VanDerWaalsContact C-N 3.35Å; Y122-T124 PolarHBondContact O-N 3.05Å; Y122-T125 WeakPolarHBondContact O-CB 3.33Å; Y122-T125 PolarHBondContact O-N 2.98Å; Y122-T125 VanDerWaalsContact O-N 3.14Å; Y122-V126 HydrophobicContact CD2-CG2 4.47Å; Y122-V126 HydrophobicContact CE1-CG2 4.4Å; Y122-V126 HydrophobicContact CE2-CG2 4.06Å; Y122-V126 WeakPolarHBondContact O-CG2 3.37Å; Y122-V126 PolarHBondContact O-N 3.48Å
123	G	86.3	Confident	92.4	Very high	43 Å²	43	48.9 Å²	48.9	44%	0.443	29%	0.289	S	S	.	.	H	α-helix	trans	-59.8	-44.5	179.1	0	0	0	0	0	112.2	T125 V126 A127	G123-T125 VanDerWaalsContact C-N 3.31Å; G123-T125 PolarHBondContact O-N 2.9Å; G123-V126 PolarHBondContact O-N 3.43Å; G123-A127 VanDerWaalsContact O-CB 3.24Å; G123-A127 WeakPolarHBondContact O-CB 3.39Å; G123-A127 PolarHBondContact O-N 3.19Å
124	T	92.3	Very high	92.4	Very high	77 Å²	77	47.6 Å²	47.6	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-40.3	175.5	-53.6	0	0	0	0	112.1	T120 H121 Y122 A127 A128 I178	T120-T124 PolarHBondContact O-OG1 3.18Å; H121-T124 PolarHBondContact O-N 2.82Å; Y122-T124 VanDerWaalsContact C-N 3.35Å; Y122-T124 PolarHBondContact O-N 3.05Å; T124-A127 PolarHBondContact O-N 3.28Å; T124-A128 VanDerWaalsContact O-CB 3.3Å; T124-A128 WeakPolarHBondContact O-CB 3.4Å; T124-A128 PolarHBondContact O-N 3.42Å; T124-I178 HydrophobicContact CG2-CD1 3.85Å
125	T	93.5	Very high	92.6	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-67.5	-45.2	-179.7	-56.8	0	0	0	0	111.8	L105 H121 Y122 G123 A128 F129 V177 I178 R181	L105-T125 HydrophobicContact CD1-CG2 3.83Å; L105-T125 HydrophobicContact CD2-CG2 3.76Å; L105-T125 HydrophobicContact CG-CG2 4.39Å; H121-T125 VanDerWaalsContact O-CB 3.31Å; H121-T125 WeakPolarHBondContact O-CB 3.34Å; H121-T125 PolarHBondContact O-N 3.34Å; H121-T125 PolarHBondContact O-OG1 3.4Å; Y122-T125 WeakPolarHBondContact O-CB 3.33Å; Y122-T125 PolarHBondContact O-N 2.98Å; Y122-T125 VanDerWaalsContact O-N 3.14Å; G123-T125 VanDerWaalsContact C-N 3.31Å; G123-T125 PolarHBondContact O-N 2.9Å; T125-A128 PolarHBondContact O-N 3.25Å; T125-F129 PolarHBondContact O-N 3.08Å; T125-V177 HydrophobicContact CG2-CG1 4.06Å; T125-I178 WeakPolarHBondContact OG1-CG1 3.3Å; T125-R181 HydrophobicContact CG2-CB 4.04Å; T125-R181 HydrophobicContact CG2-CG 3.47Å; T125-R181 VanDerWaalsContact CG2-CG 3.47Å
126	V	90.5	Very high	93	Very high	47 Å²	47	50.4 Å²	50.4	29%	0.285	29%	0.287	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.5	175.7	0	0	0	0	110.6	L102 L105 Y122 G123 A128 F129 S130	L102-V126 HydrophobicContact CD2-CG2 4.08Å; L105-V126 HydrophobicContact CD2-CG2 3.79Å; Y122-V126 HydrophobicContact CD2-CG2 4.47Å; Y122-V126 HydrophobicContact CE1-CG2 4.4Å; Y122-V126 HydrophobicContact CE2-CG2 4.06Å; Y122-V126 WeakPolarHBondContact O-CG2 3.37Å; Y122-V126 PolarHBondContact O-N 3.48Å; G123-V126 PolarHBondContact O-N 3.43Å; V126-A128 PolarHBondContact O-N 3.48Å; V126-F129 PolarHBondContact O-N 3.38Å; V126-S130 PolarHBondContact O-N 3.31Å
127	A	91.5	Very high	93.2	Very high	44 Å²	44	44.1 Å²	44.1	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-64.4	-39	178.1	0	0	0	0	0	112.4	G123 T124 F129 S130 L131	G123-A127 VanDerWaalsContact O-CB 3.24Å; G123-A127 WeakPolarHBondContact O-CB 3.39Å; G123-A127 PolarHBondContact O-N 3.19Å; T124-A127 PolarHBondContact O-N 3.28Å; A127-F129 VanDerWaalsContact C-N 3.34Å; A127-F129 PolarHBondContact O-N 3.47Å; A127-S130 PolarHBondContact O-N 2.92Å; A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 PolarHBondContact O-N 2.81Å
128	A	95.3	Very high	93.4	Very high	12 Å²	12	44.1 Å²	44.1	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-42.6	179.2	0	0	0	0	0	112.2	T124 T125 V126 S132 I178 L182	T124-A128 VanDerWaalsContact O-CB 3.3Å; T124-A128 WeakPolarHBondContact O-CB 3.4Å; T124-A128 PolarHBondContact O-N 3.42Å; T125-A128 PolarHBondContact O-N 3.25Å; V126-A128 PolarHBondContact O-N 3.48Å; A128-S132 WeakPolarHBondContact O-CB 3.42Å; A128-S132 PolarHBondContact O-N 2.67Å; A128-S132 PolarHBondContact O-OG 3.4Å; A128-I178 HydrophobicContact CB-CG2 3.86Å; A128-L182 HydrophobicContact CB-CB 4.33Å
129	F	95.1	Very high	93.8	Very high	40 Å²	40	48.3 Å²	48.3	18%	0.175	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-55.6	174.3	-177.7	-98.8	0	0	0	111.1	T125 V126 A127 L131 S132 I133 R181 A188	T125-F129 PolarHBondContact O-N 3.08Å; V126-F129 PolarHBondContact O-N 3.38Å; A127-F129 VanDerWaalsContact C-N 3.34Å; A127-F129 PolarHBondContact O-N 3.47Å; F129-L131 PolarHBondContact O-N 2.97Å; F129-S132 PolarHBondContact O-N 2.92Å; F129-S132 PolarHBondContact O-OG 3.48Å; F129-I133 HydrophobicContact CD1-CD1 3.8Å; F129-I133 HydrophobicContact CE1-CD1 3.3Å; F129-I133 HydrophobicContact CE1-CG1 4.49Å; F129-I133 HydrophobicContact CE2-CD1 4.37Å; F129-I133 HydrophobicContact CZ-CD1 3.64Å; F129-I133 PolarHBondContact O-N 2.84Å; F129-I133 VanDerWaalsContact O-N 3.1Å; F129-R181 HydrophobicContact CB-CB 4.33Å; F129-R181 WeakPolarHBondContact CD2-O 3.24Å; F129-A188 HydrophobicContact CE2-CB 4.36Å; F129-A188 HydrophobicContact CZ-CB 4.08Å
130	S	93	Very high	94.4	Very high	17 Å²	17	43.9 Å²	43.9	12%	0.119	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-37.6	-177.8	-59.9	0	0	0	0	113.4	V126 A127 I133 L134	V126-S130 PolarHBondContact O-N 3.31Å; A127-S130 PolarHBondContact O-N 2.92Å; S130-I133 PolarHBondContact O-N 3.38Å; S130-L134 PolarHBondContact O-N 2.98Å
131	L	95	Very high	94.6	Very high	83 Å²	83	39.7 Å²	39.7	44%	0.435	23%	0.225	S	C	.	.	H	α-helix	trans	-67.4	-42.5	177.7	-178.9	63.3	0	0	0	111.4	A127 F129 I133 L134 I135	A127-L131 WeakPolarHBondContact O-CB 3.49Å; A127-L131 PolarHBondContact O-N 2.81Å; F129-L131 PolarHBondContact O-N 2.97Å; L131-I133 VanDerWaalsContact C-N 3.29Å; L131-I133 PolarHBondContact O-N 3.26Å; L131-L134 PolarHBondContact O-N 2.94Å; L131-I135 HydrophobicContact CD1-CD1 3.94Å; L131-I135 HydrophobicContact CD1-CG1 4.31Å; L131-I135 HydrophobicContact CG-CD1 3.9Å; L131-I135 WeakPolarHBondContact O-CG1 3.38Å; L131-I135 PolarHBondContact O-N 3.2Å
132	S	97.4	Very high	94.7	Very high	7 Å²	7	42.2 Å²	42.2	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-39.5	175.8	68.8	0	0	0	0	111.5	A128 F129 L134 I135 M136 L182 G185 I186	A128-S132 WeakPolarHBondContact O-CB 3.42Å; A128-S132 PolarHBondContact O-N 2.67Å; A128-S132 PolarHBondContact O-OG 3.4Å; F129-S132 PolarHBondContact O-N 2.92Å; F129-S132 PolarHBondContact O-OG 3.48Å; S132-L134 PolarHBondContact O-N 2.84Å; S132-I135 PolarHBondContact O-N 3.42Å; S132-M136 WeakPolarHBondContact O-CB 3.23Å; S132-M136 VanDerWaalsContact O-CG 3.26Å; S132-M136 WeakPolarHBondContact O-CG 3.33Å; S132-M136 PolarHBondContact O-N 3.43Å; S132-L182 WeakPolarHBondContact CB-O 3.35Å; S132-L182 PolarHBondContact OG-O 3.02Å; S132-L182 VanDerWaalsContact OG-O 3.13Å; S132-G185 VanDerWaalsContact OG-C 3.22Å; S132-G185 WeakPolarHBondContact OG-CA 3.41Å; S132-I186 PolarHBondContact OG-N 3.08Å
133	I	97.5	Very high	95.1	Very high	18 Å²	18	39.4 Å²	39.4	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-59	-49.1	173.4	-70	172.6	0	0	0	111.4	F129 S130 L131 I135 M136 T137 G185 A188 S189 N480	F129-I133 HydrophobicContact CD1-CD1 3.8Å; F129-I133 HydrophobicContact CE1-CD1 3.3Å; F129-I133 HydrophobicContact CE1-CG1 4.49Å; F129-I133 HydrophobicContact CE2-CD1 4.37Å; F129-I133 HydrophobicContact CZ-CD1 3.64Å; F129-I133 PolarHBondContact O-N 2.84Å; F129-I133 VanDerWaalsContact O-N 3.1Å; S130-I133 PolarHBondContact O-N 3.38Å; L131-I133 VanDerWaalsContact C-N 3.29Å; L131-I133 PolarHBondContact O-N 3.26Å; I133-I135 VanDerWaalsContact C-N 3.34Å; I133-I135 PolarHBondContact O-N 2.96Å; I133-M136 PolarHBondContact O-N 3.37Å; I133-T137 VanDerWaalsContact O-CB 3.25Å; I133-T137 WeakPolarHBondContact O-CB 3.41Å; I133-T137 PolarHBondContact O-N 3.14Å; I133-T137 PolarHBondContact O-OG1 3.08Å; I133-G185 VanDerWaalsContact CG1-O 3.25Å; I133-G185 WeakPolarHBondContact CG1-O 3.39Å; I133-A188 HydrophobicContact CD1-CB 3.96Å; I133-A188 HydrophobicContact CG1-CB 4.09Å; I133-S189 VanDerWaalsContact CA-OG 3.32Å; I133-S189 WeakPolarHBondContact CA-OG 3.42Å; I133-N480 HydrophobicContact CG2-CB 4.37Å; I133-N480 WeakPolarHBondContact CG2-ND2 3.29Å
134	L	96.8	Very high	95.5	Very high	32 Å²	32	37.6 Å²	37.6	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-58.7	-44.9	-179.5	175.7	60.1	0	0	0	112.2	S130 L131 S132 P138 T477 N480 V481 L484	S130-L134 PolarHBondContact O-N 2.98Å; L131-L134 PolarHBondContact O-N 2.94Å; S132-L134 PolarHBondContact O-N 2.84Å; L134-P138 WeakPolarHBondContact O-CD 3.44Å; L134-T477 HydrophobicContact CD1-CG2 4.15Å; L134-N480 HydrophobicContact CB-CB 4.36Å; L134-N480 HydrophobicContact CD1-CB 3.93Å; L134-V481 HydrophobicContact CD1-CG2 3.6Å; L134-L484 HydrophobicContact CD2-CD2 3.77Å
135	I	97.2	Very high	95.4	Very high	88 Å²	88	38.7 Å²	38.7	45%	0.451	21%	0.21	S	C	.	.	H	α-helix	trans	-74.6	-40.4	-177.3	-66	171.7	0	0	0	111.7	L131 S132 I133 P138 I139	L131-I135 HydrophobicContact CD1-CD1 3.94Å; L131-I135 HydrophobicContact CD1-CG1 4.31Å; L131-I135 HydrophobicContact CG-CD1 3.9Å; L131-I135 WeakPolarHBondContact O-CG1 3.38Å; L131-I135 PolarHBondContact O-N 3.2Å; S132-I135 PolarHBondContact O-N 3.42Å; I133-I135 VanDerWaalsContact C-N 3.34Å; I133-I135 PolarHBondContact O-N 2.96Å; I135-P138 WeakPolarHBondContact O-CD 3.37Å; I135-I139 HydrophobicContact CG2-CD1 4.36Å
136	M	98	Very high	95.4	Very high	47 Å²	47	42.8 Å²	42.8	23%	0.232	24%	0.239	C	C	.	.	H	α-helix	trans	-84.1	-22.6	-172.3	-66.9	-71.6	163.5	0	0	113.2	S132 I133 I139 Y140 I186 S189	S132-M136 WeakPolarHBondContact O-CB 3.23Å; S132-M136 VanDerWaalsContact O-CG 3.26Å; S132-M136 WeakPolarHBondContact O-CG 3.33Å; S132-M136 PolarHBondContact O-N 3.43Å; I133-M136 PolarHBondContact O-N 3.37Å; M136-I139 HydrophobicContact CE-CD1 4.07Å; M136-I139 WeakPolarHBondContact O-CA 3.41Å; M136-I139 WeakPolarHBondContact O-CB 3.24Å; M136-I139 PolarHBondContact O-N 3.49Å; M136-I139 HydrophobicContact SD-CB 4.43Å; M136-I139 HydrophobicContact SD-CD1 3.55Å; M136-I139 VanDerWaalsContact SD-CD1 3.55Å; M136-Y140 HydrophobicContact CB-CD2 4.37Å; M136-Y140 HydrophobicContact CB-CE2 4.44Å; M136-Y140 WeakPolarHBondContact O-CD2 3.49Å; M136-Y140 PolarHBondContact O-N 3.17Å; M136-I186 HydrophobicContact CB-CG2 4.24Å; M136-I186 HydrophobicContact CE-CD1 4.13Å; M136-I186 HydrophobicContact CE-CG1 4.42Å; M136-I186 HydrophobicContact CG-CB 4.1Å; M136-I186 HydrophobicContact CG-CG1 3.88Å; M136-I186 HydrophobicContact CG-CG2 3.75Å; M136-I186 HydrophobicContact SD-CG2 3.9Å; M136-S189 WeakPolarHBondContact CB-OG 3.42Å
137	T	98.1	Very high	95.3	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-54.4	-50.3	174.9	-67.9	0	0	0	0	112.5	I133 I139 Y140 G141 P192 R476 N480	I133-T137 VanDerWaalsContact O-CB 3.25Å; I133-T137 WeakPolarHBondContact O-CB 3.41Å; I133-T137 PolarHBondContact O-N 3.14Å; I133-T137 PolarHBondContact O-OG1 3.08Å; T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.47Å; T137-Y140 PolarHBondContact O-N 3.2Å; T137-G141 PolarHBondContact O-N 3.39Å; T137-P192 HydrophobicContact CG2-CG 3.56Å; T137-R476 HydrophobicContact CG2-CB 3.81Å; T137-N480 PolarHBondContact OG1-ND2 3.06Å
138	P	97.3	Very high	95.4	Very high	37 Å²	37	43.2 Å²	43.2	24%	0.24	25%	0.245	C	C	.	.	H	α-helix	trans	-54.6	-39.9	169.4	-27.2	32.6	0	0	0	114.5	L134 I135 G141 I142 T473 T477	L134-P138 WeakPolarHBondContact O-CD 3.44Å; I135-P138 WeakPolarHBondContact O-CD 3.37Å; P138-G141 PolarHBondContact O-N 2.91Å; P138-I142 WeakPolarHBondContact O-CB 3.31Å; P138-I142 VanDerWaalsContact O-CG1 3.22Å; P138-I142 WeakPolarHBondContact O-CG1 3.47Å; P138-I142 PolarHBondContact O-N 2.73Å; P138-T473 HydrophobicContact CB-CG2 4.47Å; P138-T477 HydrophobicContact CG-CG2 4.36Å; P138-T477 WeakPolarHBondContact CG-OG1 3.43Å
139	I	97.7	Very high	95.3	Very high	87 Å²	87	48 Å²	48	45%	0.446	26%	0.26	S	S	.	.	H	α-helix	trans	-68.8	-45.5	-175.8	-65.1	169.2	0	0	0	110.8	I135 M136 T137 G141 I142 A143	I135-I139 HydrophobicContact CG2-CD1 4.36Å; M136-I139 HydrophobicContact CE-CD1 4.07Å; M136-I139 WeakPolarHBondContact O-CA 3.41Å; M136-I139 WeakPolarHBondContact O-CB 3.24Å; M136-I139 PolarHBondContact O-N 3.49Å; M136-I139 HydrophobicContact SD-CB 4.43Å; M136-I139 HydrophobicContact SD-CD1 3.55Å; M136-I139 VanDerWaalsContact SD-CD1 3.55Å; T137-I139 VanDerWaalsContact C-N 3.29Å; T137-I139 PolarHBondContact O-N 3.47Å; I139-G141 VanDerWaalsContact C-N 3.29Å; I139-G141 PolarHBondContact O-N 3.36Å; I139-I142 PolarHBondContact O-N 2.94Å; I139-A143 WeakPolarHBondContact O-CB 3.26Å; I139-A143 PolarHBondContact O-N 2.88Å
140	Y	97.9	Very high	95.3	Very high	15 Å²	15	46.3 Å²	46.3	6%	0.059	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-41.5	171.9	-85.4	-83.1	0	0	0	111.8	M136 T137 A143 S144 L153 A157 I186 C190	M136-Y140 HydrophobicContact CB-CD2 4.37Å; M136-Y140 HydrophobicContact CB-CE2 4.44Å; M136-Y140 WeakPolarHBondContact O-CD2 3.49Å; M136-Y140 PolarHBondContact O-N 3.17Å; T137-Y140 PolarHBondContact O-N 3.2Å; Y140-A143 PolarHBondContact O-N 3.05Å; Y140-S144 PolarHBondContact O-N 3.38Å; Y140-L153 HydrophobicContact CD1-CB 4.13Å; Y140-L153 HydrophobicContact CD1-CD2 4.06Å; Y140-L153 HydrophobicContact CD1-CG 4.49Å; Y140-L153 HydrophobicContact CE1-CB 4.28Å; Y140-L153 HydrophobicContact CE1-CD2 4.36Å; Y140-A157 HydrophobicContact CE1-CB 4.02Å; Y140-A157 WeakPolarHBondContact OH-CA 3.49Å; Y140-A157 WeakPolarHBondContact OH-CB 3.24Å; Y140-I186 HydrophobicContact CE2-CG2 4.34Å; Y140-I186 WeakPolarHBondContact CE2-O 3.34Å; Y140-I186 PolarHBondContact OH-O 2.86Å; Y140-C190 HydrophobicContact CD1-CB 3.94Å; Y140-C190 HydrophobicContact CE1-CB 3.94Å; Y140-C190 HydrophobicContact CG-CB 4.45Å
141	G	95.6	Very high	95.4	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-50.6	175	0	0	0	0	0	113.9	T137 P138 I139 S144 Y145 T473	T137-G141 PolarHBondContact O-N 3.39Å; P138-G141 PolarHBondContact O-N 2.91Å; I139-G141 VanDerWaalsContact C-N 3.29Å; I139-G141 PolarHBondContact O-N 3.36Å; G141-S144 PolarHBondContact O-N 2.85Å; G141-Y145 WeakPolarHBondContact O-CB 3.25Å; G141-Y145 PolarHBondContact O-N 3.33Å; G141-T473 WeakPolarHBondContact CA-OG1 3.14Å
142	I	95	Very high	95.5	Very high	103 Å²	103	46 Å²	46	53%	0.528	25%	0.251	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.5	-68.9	163.3	0	0	0	110.2	P138 I139 S144 Y145 S146	P138-I142 WeakPolarHBondContact O-CB 3.31Å; P138-I142 VanDerWaalsContact O-CG1 3.22Å; P138-I142 WeakPolarHBondContact O-CG1 3.47Å; P138-I142 PolarHBondContact O-N 2.73Å; I139-I142 PolarHBondContact O-N 2.94Å; I142-S144 VanDerWaalsContact C-N 3.33Å; I142-S144 PolarHBondContact O-N 3.27Å; I142-Y145 PolarHBondContact O-N 3.39Å; I142-S146 WeakPolarHBondContact O-CB 3.44Å; I142-S146 PolarHBondContact O-N 3.12Å; I142-S146 PolarHBondContact O-OG 2.67Å; I142-S146 VanDerWaalsContact O-OG 3.09Å
143	A	96	Very high	95.4	Very high	25 Å²	25	46.2 Å²	46.2	21%	0.207	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-43.8	177.9	0	0	0	0	0	111.9	I139 Y140 S146 G147 V148 L153	I139-A143 WeakPolarHBondContact O-CB 3.26Å; I139-A143 PolarHBondContact O-N 2.88Å; Y140-A143 PolarHBondContact O-N 3.05Å; A143-S146 PolarHBondContact O-N 3.46Å; A143-G147 PolarHBondContact O-N 3.02Å; A143-V148 HydrophobicContact CB-CB 4.38Å; A143-V148 HydrophobicContact CB-CG2 4.2Å; A143-V148 VanDerWaalsContact O-CB 3.28Å; A143-V148 WeakPolarHBondContact O-CB 3.2Å; A143-V148 WeakPolarHBondContact O-CG2 3.33Å; A143-V148 PolarHBondContact O-N 3.09Å; A143-L153 HydrophobicContact CB-CD2 3.9Å
144	S	94.5	Very high	95.4	Very high	4 Å²	4	45.4 Å²	45.4	3%	0.028	25%	0.247	C	C	.	.	H	α-helix	trans	-62.2	-48.3	174	-164.3	0	0	0	0	111.8	Y140 G141 I142 S146 G147 P193 D469	Y140-S144 PolarHBondContact O-N 3.38Å; G141-S144 PolarHBondContact O-N 2.85Å; I142-S144 VanDerWaalsContact C-N 3.33Å; I142-S144 PolarHBondContact O-N 3.27Å; S144-S146 VanDerWaalsContact C-N 3.26Å; S144-S146 PolarHBondContact O-N 2.83Å; S144-G147 WeakPolarHBondContact O-CA 3.2Å; S144-G147 PolarHBondContact O-N 3.26Å; S144-P193 WeakPolarHBondContact OG-CB 3.41Å; S144-D469 PolarHBondContact OG-OD1 3.35Å
145	Y	91.3	Very high	95.5	Very high	100 Å²	100	46.7 Å²	46.7	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-58.9	-37.6	177.4	-178.8	-98.3	0	0	0	112.2	G141 I142 G147 K274 D467 R470	G141-Y145 WeakPolarHBondContact O-CB 3.25Å; G141-Y145 PolarHBondContact O-N 3.33Å; I142-Y145 PolarHBondContact O-N 3.39Å; Y145-G147 PolarHBondContact O-N 3.35Å; Y145-K274 PolarHBondContact O-NZ 3.39Å; Y145-D467 WeakPolarHBondContact CD2-OD1 3.31Å; Y145-D467 WeakPolarHBondContact CE2-OD1 3.29Å; Y145-R470 HydrophobicContact CD2-CB 4.45Å; Y145-R470 PolarHBondContact OH-NH2 2.97Å
146	S	92.1	Very high	95.5	Very high	88 Å²	88	45.9 Å²	45.9	62%	0.615	25%	0.253	S	S	*	.	H	α-helix	trans	-68.8	-12.9	174.4	-67.7	0	0	0	0	113.5	I142 A143 S144	I142-S146 WeakPolarHBondContact O-CB 3.44Å; I142-S146 PolarHBondContact O-N 3.12Å; I142-S146 PolarHBondContact O-OG 2.67Å; I142-S146 VanDerWaalsContact O-OG 3.09Å; A143-S146 PolarHBondContact O-N 3.46Å; S144-S146 VanDerWaalsContact C-N 3.26Å; S144-S146 PolarHBondContact O-N 2.83Å
147	G	89.8	Confident	95.6	Very high	39 Å²	39	43.7 Å²	43.7	40%	0.402	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	106	11.4	176	0	0	0	0	0	115.1	A143 S144 Y145 R149	A143-G147 PolarHBondContact O-N 3.02Å; S144-G147 WeakPolarHBondContact O-CA 3.2Å; S144-G147 PolarHBondContact O-N 3.26Å; Y145-G147 PolarHBondContact O-N 3.35Å; G147-R149 PolarHBondContact O-N 2.98Å
148	V	93.7	Very high	95.6	Very high	60 Å²	60	43.5 Å²	43.5	36%	0.364	24%	0.241	S	C	.	.			trans	-68.7	126.3	168.3	-173.7	0	0	0	0	108.5	A143 T152 L153	A143-V148 HydrophobicContact CB-CB 4.38Å; A143-V148 HydrophobicContact CB-CG2 4.2Å; A143-V148 VanDerWaalsContact O-CB 3.28Å; A143-V148 WeakPolarHBondContact O-CB 3.2Å; A143-V148 WeakPolarHBondContact O-CG2 3.33Å; A143-V148 PolarHBondContact O-N 3.09Å; V148-T152 HydrophobicContact CG1-CG2 4.4Å; V148-L153 HydrophobicContact CB-CD1 4.46Å; V148-L153 HydrophobicContact CB-CD2 4.13Å; V148-L153 HydrophobicContact CB-CG 4.29Å; V148-L153 HydrophobicContact CG1-CD1 4.47Å; V148-L153 HydrophobicContact CG1-CD2 3.61Å; V148-L153 HydrophobicContact CG1-CG 3.79Å
149	R	92.9	Very high	95.6	Very high	113 Å²	113	46.5 Å²	46.5	43%	0.426	25%	0.254	S	S	.	.			trans	-63.8	138.4	-178	-65.1	173.1	-65.5	-167	-3.6	111.1	G147 K151 T152 L153	G147-R149 PolarHBondContact O-N 2.98Å; R149-K151 VanDerWaalsContact C-N 3.26Å; R149-K151 PolarHBondContact O-N 2.96Å; R149-T152 WeakPolarHBondContact O-CA 3.48Å; R149-T152 WeakPolarHBondContact O-CB 3.48Å; R149-T152 PolarHBondContact O-N 2.88Å; R149-L153 PolarHBondContact O-N 3.38Å
150	V	94.6	Very high	95.7	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-56.7	-39.4	178.2	-177	0	0	0	0	111.9	T152 L153 L154 P193 D197 Y269	V150-T152 VanDerWaalsContact C-N 3.29Å; V150-T152 PolarHBondContact O-N 3.05Å; V150-L153 PolarHBondContact O-N 3.25Å; V150-L153 VanDerWaalsContact O-N 3.16Å; V150-L154 HydrophobicContact CG1-CD1 4Å; V150-L154 HydrophobicContact CG1-CG 4.15Å; V150-L154 WeakPolarHBondContact O-CB 3.43Å; V150-L154 WeakPolarHBondContact O-CG 3.26Å; V150-L154 PolarHBondContact O-N 3.38Å; V150-P193 HydrophobicContact CB-CB 4.41Å; V150-P193 HydrophobicContact CG1-CB 4.08Å; V150-P193 HydrophobicContact CG2-CB 3.76Å; V150-D197 VanDerWaalsContact CB-OD2 3.28Å; V150-D197 WeakPolarHBondContact CB-OD2 3.29Å; V150-D197 HydrophobicContact CG2-CB 4.47Å; V150-D197 VanDerWaalsContact CG2-CG 3.43Å; V150-D197 WeakPolarHBondContact CG2-OD2 3.26Å; V150-Y269 HydrophobicContact CB-CE1 4.35Å; V150-Y269 HydrophobicContact CG1-CE1 4.29Å; V150-Y269 WeakPolarHBondContact CG1-OH 3.45Å
151	K	95.3	Very high	95.7	Very high	35 Å²	35	43.7 Å²	43.7	15%	0.152	24%	0.241	C	C	.	.	H	α-helix	trans	-54.5	-43.9	173.3	-171.3	174.5	-174.1	158	0	112.6	R149 M155 I265 F266 Y269 N271	R149-K151 VanDerWaalsContact C-N 3.26Å; R149-K151 PolarHBondContact O-N 2.96Å; K151-M155 VanDerWaalsContact O-CG 3.3Å; K151-M155 WeakPolarHBondContact O-CG 3.04Å; K151-M155 PolarHBondContact O-N 3.21Å; K151-M155 VanDerWaalsContact O-N 3.12Å; K151-I265 VanDerWaalsContact CE-O 3.32Å; K151-I265 WeakPolarHBondContact CE-O 3.25Å; K151-I265 HydrophobicContact CG-CG2 4.12Å; K151-F266 WeakPolarHBondContact CE-O 3.35Å; K151-F266 PolarHBondContact NZ-O 3.42Å; K151-Y269 HydrophobicContact CB-CD1 3.84Å; K151-Y269 HydrophobicContact CB-CE1 4.41Å; K151-Y269 WeakPolarHBondContact CD-O 3.38Å; K151-Y269 WeakPolarHBondContact CE-O 3.41Å; K151-Y269 HydrophobicContact CG-CD1 4.2Å; K151-Y269 PolarHBondContact NZ-O 3.27Å; K151-N271 WeakPolarHBondContact CD-OD1 3.17Å
152	T	95.8	Very high	95.8	Very high	57 Å²	57	44.7 Å²	44.7	35%	0.35	25%	0.246	S	C	.	.	H	α-helix	trans	-68.7	-43.1	178.8	-58.4	0	0	0	0	110.7	V148 R149 V150 M155 V156	V148-T152 HydrophobicContact CG1-CG2 4.4Å; R149-T152 WeakPolarHBondContact O-CA 3.48Å; R149-T152 WeakPolarHBondContact O-CB 3.48Å; R149-T152 PolarHBondContact O-N 2.88Å; V150-T152 VanDerWaalsContact C-N 3.29Å; V150-T152 PolarHBondContact O-N 3.05Å; T152-M155 PolarHBondContact O-N 3.36Å; T152-V156 WeakPolarHBondContact O-CG2 3.12Å; T152-V156 PolarHBondContact O-N 3.2Å
153	L	97.2	Very high	96	Very high	13 Å²	13	43 Å²	43	7%	0.068	24%	0.236	C	C	.	.	H	α-helix	trans	-59.9	-46.4	176.4	-64.9	174.4	0	0	0	111.5	Y140 A143 V148 R149 V150 M155 V156 A157 P193	Y140-L153 HydrophobicContact CD1-CB 4.13Å; Y140-L153 HydrophobicContact CD1-CD2 4.06Å; Y140-L153 HydrophobicContact CD1-CG 4.49Å; Y140-L153 HydrophobicContact CE1-CB 4.28Å; Y140-L153 HydrophobicContact CE1-CD2 4.36Å; A143-L153 HydrophobicContact CB-CD2 3.9Å; V148-L153 HydrophobicContact CB-CD1 4.46Å; V148-L153 HydrophobicContact CB-CD2 4.13Å; V148-L153 HydrophobicContact CB-CG 4.29Å; V148-L153 HydrophobicContact CG1-CD1 4.47Å; V148-L153 HydrophobicContact CG1-CD2 3.61Å; V148-L153 HydrophobicContact CG1-CG 3.79Å; R149-L153 PolarHBondContact O-N 3.38Å; V150-L153 PolarHBondContact O-N 3.25Å; V150-L153 VanDerWaalsContact O-N 3.16Å; L153-M155 VanDerWaalsContact C-N 3.35Å; L153-M155 PolarHBondContact O-N 3.02Å; L153-V156 PolarHBondContact O-N 3.21Å; L153-A157 WeakPolarHBondContact O-CB 3.31Å; L153-A157 PolarHBondContact O-N 3.24Å; L153-P193 HydrophobicContact CD1-CB 4.02Å; L153-P193 HydrophobicContact CD1-CG 3.97Å
154	L	97.5	Very high	96.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-39.8	177	-72.2	170.6	0	0	0	112.7	T86 W90 V150 A157 N158 C190 L194 I265 Y269	T86-L154 HydrophobicContact CG2-CD1 4.46Å; W90-L154 HydrophobicContact CD2-CD2 4.36Å; W90-L154 HydrophobicContact CE3-CD2 3.68Å; W90-L154 HydrophobicContact CH2-CD2 4.5Å; W90-L154 HydrophobicContact CZ3-CD2 3.74Å; V150-L154 HydrophobicContact CG1-CD1 4Å; V150-L154 HydrophobicContact CG1-CG 4.15Å; V150-L154 WeakPolarHBondContact O-CB 3.43Å; V150-L154 WeakPolarHBondContact O-CG 3.26Å; V150-L154 PolarHBondContact O-N 3.38Å; L154-A157 PolarHBondContact O-N 2.93Å; L154-N158 WeakPolarHBondContact O-CB 3.29Å; L154-N158 PolarHBondContact O-N 2.94Å; L154-C190 HydrophobicContact CD2-CB 4.36Å; L154-L194 HydrophobicContact CD1-CD1 4.13Å; L154-L194 HydrophobicContact CD2-CB 4.48Å; L154-L194 HydrophobicContact CD2-CD1 4.38Å; L154-L194 HydrophobicContact CD2-CD2 4.33Å; L154-I265 HydrophobicContact CB-CD1 3.94Å; L154-I265 HydrophobicContact CB-CG2 4.2Å; L154-Y269 HydrophobicContact CD1-CD1 4.49Å; L154-Y269 HydrophobicContact CD1-CD2 3.98Å; L154-Y269 HydrophobicContact CD1-CE1 4.26Å; L154-Y269 HydrophobicContact CD1-CE2 3.7Å; L154-Y269 HydrophobicContact CD1-CG 4.35Å
155	M	97.7	Very high	96.3	Very high	59 Å²	59	41.6 Å²	41.6	29%	0.291	23%	0.225	S	C	.	.	H	α-helix	trans	-66.7	-41.6	176.8	-72.6	-61	-57.6	0	0	112.1	K151 T152 L153 A157 L159 I265 F266	K151-M155 VanDerWaalsContact O-CG 3.3Å; K151-M155 WeakPolarHBondContact O-CG 3.04Å; K151-M155 PolarHBondContact O-N 3.21Å; K151-M155 VanDerWaalsContact O-N 3.12Å; T152-M155 PolarHBondContact O-N 3.36Å; L153-M155 VanDerWaalsContact C-N 3.35Å; L153-M155 PolarHBondContact O-N 3.02Å; M155-A157 VanDerWaalsContact C-N 3.34Å; M155-L159 WeakPolarHBondContact O-CB 3.33Å; M155-L159 PolarHBondContact O-N 3.27Å; M155-I265 HydrophobicContact CG-CG2 3.89Å; M155-I265 HydrophobicContact SD-CB 3.86Å; M155-I265 HydrophobicContact SD-CG2 3.61Å; M155-F266 HydrophobicContact SD-CB 4.34Å
156	V	98.2	Very high	96.7	Very high	72 Å²	72	40 Å²	40	44%	0.436	22%	0.223	S	C	.	.	H	α-helix	trans	-63.9	-43.8	174.2	171.2	0	0	0	0	110.4	T152 L153 L159 L160	T152-V156 WeakPolarHBondContact O-CG2 3.12Å; T152-V156 PolarHBondContact O-N 3.2Å; L153-V156 PolarHBondContact O-N 3.21Å; V156-L159 WeakPolarHBondContact O-CB 3.28Å; V156-L159 PolarHBondContact O-N 3.41Å; V156-L160 HydrophobicContact CG1-CD1 4.14Å; V156-L160 WeakPolarHBondContact O-CG 3.4Å; V156-L160 PolarHBondContact O-N 3.39Å
157	A	98.4	Very high	96.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-47	-179.5	0	0	0	0	0	111.9	W90 Y140 L153 L154 M155 L159 L160 E161 G187 C190	W90-A157 HydrophobicContact CH2-CB 3.54Å; W90-A157 HydrophobicContact CZ3-CB 4.14Å; Y140-A157 HydrophobicContact CE1-CB 4.02Å; Y140-A157 WeakPolarHBondContact OH-CA 3.49Å; Y140-A157 WeakPolarHBondContact OH-CB 3.24Å; L153-A157 WeakPolarHBondContact O-CB 3.31Å; L153-A157 PolarHBondContact O-N 3.24Å; L154-A157 PolarHBondContact O-N 2.93Å; M155-A157 VanDerWaalsContact C-N 3.34Å; A157-L159 VanDerWaalsContact C-N 3.34Å; A157-L159 PolarHBondContact O-N 3.08Å; A157-L160 PolarHBondContact O-N 3.2Å; A157-E161 PolarHBondContact O-N 3.5Å; A157-G187 WeakPolarHBondContact CB-O 3.47Å; A157-G187 VanDerWaalsContact O-CA 3.27Å; A157-G187 WeakPolarHBondContact O-CA 3.37Å; A157-C190 HydrophobicContact CB-CB 3.68Å
158	N	98.4	Very high	97.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-40	172	-91.8	23.2	0	0	0	112.8	W90 L154 L160 E161 I162 W258 H261 S262 I265	W90-N158 WeakPolarHBondContact CZ3-OD1 3.39Å; L154-N158 WeakPolarHBondContact O-CB 3.29Å; L154-N158 PolarHBondContact O-N 2.94Å; N158-L160 VanDerWaalsContact C-N 3.3Å; N158-L160 PolarHBondContact O-N 3.19Å; N158-E161 WeakPolarHBondContact O-CB 3.39Å; N158-E161 PolarHBondContact O-N 3.36Å; N158-I162 VanDerWaalsContact O-CG1 3.26Å; N158-I162 WeakPolarHBondContact O-CG1 3.5Å; N158-I162 PolarHBondContact O-N 3.08Å; N158-W258 PolarHBondContact ND2-O 3.1Å; N158-H261 PolarHBondContact ND2-ND1 3.39Å; N158-H261 PolarHBondContact OD1-ND1 3.29Å; N158-S262 WeakPolarHBondContact CB-OG 3.37Å; N158-S262 VanDerWaalsContact ND2-CA 3.29Å; N158-S262 WeakPolarHBondContact ND2-CA 3.16Å; N158-S262 PolarHBondContact ND2-N 3.41Å; N158-S262 PolarHBondContact ND2-OG 3.34Å; N158-I265 WeakPolarHBondContact ND2-CD1 3.13Å
159	L	98.4	Very high	97.4	Very high	99 Å²	99	33.5 Å²	33.5	52%	0.518	17%	0.17	S	C	.	.	H	α-helix	trans	-62.7	-41.4	177.9	178.8	62.9	0	0	0	110.9	M155 V156 A157 I162 I163	M155-L159 WeakPolarHBondContact O-CB 3.33Å; M155-L159 PolarHBondContact O-N 3.27Å; V156-L159 WeakPolarHBondContact O-CB 3.28Å; V156-L159 PolarHBondContact O-N 3.41Å; A157-L159 VanDerWaalsContact C-N 3.34Å; A157-L159 PolarHBondContact O-N 3.08Å; L159-I162 PolarHBondContact O-N 2.78Å; L159-I163 HydrophobicContact CD1-CD1 4.21Å; L159-I163 HydrophobicContact CD1-CG1 4.47Å; L159-I163 HydrophobicContact CG-CD1 3.94Å; L159-I163 VanDerWaalsContact O-CG1 3.26Å; L159-I163 WeakPolarHBondContact O-CG1 3.49Å; L159-I163 PolarHBondContact O-N 3.27Å
160	L	98.6	Very high	97.6	Very high	43 Å²	43	33.9 Å²	33.9	23%	0.225	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-40.9	174.1	-68.4	169	0	0	0	111.5	V156 A157 N158 I162 I163 G164 I183 I186	V156-L160 HydrophobicContact CG1-CD1 4.14Å; V156-L160 WeakPolarHBondContact O-CG 3.4Å; V156-L160 PolarHBondContact O-N 3.39Å; A157-L160 PolarHBondContact O-N 3.2Å; N158-L160 VanDerWaalsContact C-N 3.3Å; N158-L160 PolarHBondContact O-N 3.19Å; L160-I162 VanDerWaalsContact C-N 3.32Å; L160-I162 PolarHBondContact O-N 3.14Å; L160-I163 PolarHBondContact O-N 3.49Å; L160-G164 PolarHBondContact O-N 3.4Å; L160-I183 HydrophobicContact CB-CG2 4.3Å; L160-I183 HydrophobicContact CD2-CG2 4.12Å; L160-I183 WeakPolarHBondContact O-CG2 3.29Å; L160-I186 HydrophobicContact CD1-CB 4.31Å; L160-I186 HydrophobicContact CD1-CG2 3.66Å
161	E	98.5	Very high	97.7	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-58.7	-43.3	172.8	-78.2	-68.5	-171.4	0	0	112.3	A157 N158 N165 S184 A188 W258	A157-E161 PolarHBondContact O-N 3.5Å; N158-E161 WeakPolarHBondContact O-CB 3.39Å; N158-E161 PolarHBondContact O-N 3.36Å; E161-N165 VanDerWaalsContact O-CB 3.25Å; E161-N165 WeakPolarHBondContact O-CB 3.4Å; E161-N165 PolarHBondContact O-N 3.16Å; E161-N165 PolarHBondContact O-ND2 3.49Å; E161-N165 PolarHBondContact OE2-ND2 3.2Å; E161-S184 VanDerWaalsContact OE1-O 3.12Å; E161-S184 WeakPolarHBondContact OE2-CA 3.34Å; E161-S184 WeakPolarHBondContact OE2-CB 3.48Å; E161-S184 PolarHBondContact OE2-OG 2.94Å; E161-S184 VanDerWaalsContact OE2-OG 3.08Å; E161-A188 WeakPolarHBondContact OE1-CB 3.31Å; E161-A188 PolarHBondContact OE1-N 3.41Å; E161-W258 HydrophobicContact CB-CB 4.26Å; E161-W258 HydrophobicContact CB-CD2 3.89Å; E161-W258 HydrophobicContact CB-CG 3.69Å; E161-W258 HydrophobicContact CG-CD2 4.06Å; E161-W258 HydrophobicContact CG-CG 4.37Å; E161-W258 HydrophobicContact CG-CZ2 4.12Å
162	I	98.7	Very high	97.6	Very high	23 Å²	23	37.2 Å²	37.2	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-48.6	176.2	-65.2	162.1	0	0	0	110.2	N158 L159 L160 N165 L166 A255 W258 L259	N158-I162 VanDerWaalsContact O-CG1 3.26Å; N158-I162 WeakPolarHBondContact O-CG1 3.5Å; N158-I162 PolarHBondContact O-N 3.08Å; L159-I162 PolarHBondContact O-N 2.78Å; L160-I162 VanDerWaalsContact C-N 3.32Å; L160-I162 PolarHBondContact O-N 3.14Å; I162-N165 PolarHBondContact O-N 3.41Å; I162-L166 HydrophobicContact CG2-CD1 3.86Å; I162-L166 HydrophobicContact CG2-CG 4.3Å; I162-L166 WeakPolarHBondContact O-CB 3.48Å; I162-L166 VanDerWaalsContact O-CG 3.23Å; I162-L166 WeakPolarHBondContact O-CG 3.43Å; I162-L166 PolarHBondContact O-N 2.88Å; I162-A255 HydrophobicContact CG2-CB 4.47Å; I162-W258 HydrophobicContact CD1-CB 4.45Å; I162-W258 HydrophobicContact CG1-CB 3.69Å; I162-L259 HydrophobicContact CD1-CB 4.09Å; I162-L259 HydrophobicContact CD1-CD1 4.21Å
163	I	98.7	Very high	97.6	Very high	66 Å²	66	37.9 Å²	37.9	34%	0.338	21%	0.205	S	C	.	.	H	α-helix	trans	-61.4	-47	-179.8	-68.1	165.5	0	0	0	110.9	L159 L160 N165 L166 I167 I183	L159-I163 HydrophobicContact CD1-CD1 4.21Å; L159-I163 HydrophobicContact CD1-CG1 4.47Å; L159-I163 HydrophobicContact CG-CD1 3.94Å; L159-I163 VanDerWaalsContact O-CG1 3.26Å; L159-I163 WeakPolarHBondContact O-CG1 3.49Å; L159-I163 PolarHBondContact O-N 3.27Å; L160-I163 PolarHBondContact O-N 3.49Å; I163-N165 PolarHBondContact O-N 2.92Å; I163-L166 PolarHBondContact O-N 3.39Å; I163-I167 HydrophobicContact CG2-CD1 3.84Å; I163-I167 HydrophobicContact CG2-CG1 4.5Å; I163-I167 VanDerWaalsContact O-CG1 3.31Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 3.01Å; I163-I183 HydrophobicContact CB-CG2 4.39Å; I163-I183 HydrophobicContact CG2-CG2 4.21Å
164	G	98.6	Very high	97.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-44.1	179.1	0	0	0	0	0	112.3	L160 I167 Y168 G180	L160-G164 PolarHBondContact O-N 3.4Å; G164-I167 PolarHBondContact O-N 3.43Å; G164-Y168 PolarHBondContact O-N 3.38Å; G164-G180 VanDerWaalsContact CA-O 3.26Å; G164-G180 WeakPolarHBondContact CA-O 3.45Å; G164-G180 VanDerWaalsContact O-CA 3.29Å; G164-G180 WeakPolarHBondContact O-CA 3.37Å
165	N	98.3	Very high	97.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-30.7	177.3	-78.7	-66.7	0	0	0	113.2	E97 E161 I162 I163 Y168 L169 S184 G251 M254 A255	E97-N165 PolarHBondContact OE2-ND2 2.89Å; E161-N165 VanDerWaalsContact O-CB 3.25Å; E161-N165 WeakPolarHBondContact O-CB 3.4Å; E161-N165 PolarHBondContact O-N 3.16Å; E161-N165 PolarHBondContact O-ND2 3.49Å; E161-N165 PolarHBondContact OE2-ND2 3.2Å; I162-N165 PolarHBondContact O-N 3.41Å; I163-N165 PolarHBondContact O-N 2.92Å; N165-Y168 WeakPolarHBondContact O-CB 3.3Å; N165-Y168 PolarHBondContact O-N 3.3Å; N165-L169 WeakPolarHBondContact O-CB 3.47Å; N165-L169 PolarHBondContact O-N 3.48Å; N165-S184 PolarHBondContact ND2-OG 3.27Å; N165-G251 WeakPolarHBondContact CB-O 3.34Å; N165-G251 WeakPolarHBondContact O-CA 3.47Å; N165-M254 HydrophobicContact CB-CB 4.31Å; N165-M254 WeakPolarHBondContact OD1-CB 3.31Å; N165-A255 HydrophobicContact CB-CB 4.18Å
166	L	98.3	Very high	97.4	Very high	67 Å²	67	39.4 Å²	39.4	35%	0.351	22%	0.223	S	C	.	.	H	α-helix	trans	-70.3	-38.8	171.1	-72.8	174.8	0	0	0	112.3	I162 I163 Y168 L169 F170 A255	I162-L166 HydrophobicContact CG2-CD1 3.86Å; I162-L166 HydrophobicContact CG2-CG 4.3Å; I162-L166 WeakPolarHBondContact O-CB 3.48Å; I162-L166 VanDerWaalsContact O-CG 3.23Å; I162-L166 WeakPolarHBondContact O-CG 3.43Å; I162-L166 PolarHBondContact O-N 2.88Å; I163-L166 PolarHBondContact O-N 3.39Å; L166-Y168 VanDerWaalsContact C-N 3.31Å; L166-L169 HydrophobicContact CD2-CD2 4.28Å; L166-L169 WeakPolarHBondContact O-CB 3.45Å; L166-L169 PolarHBondContact O-N 2.92Å; L166-F170 HydrophobicContact CD2-CE2 4.3Å; L166-F170 WeakPolarHBondContact O-CD2 3.27Å; L166-F170 PolarHBondContact O-N 2.89Å; L166-A255 HydrophobicContact CD2-CB 4.06Å; L166-A255 HydrophobicContact CG-CB 4.16Å
167	I	98	Very high	97.3	Very high	46 Å²	46	36 Å²	36	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-41.2	173.1	-68.5	165.7	0	0	0	110.1	I163 G164 L169 F170 A171 A176 I183	I163-I167 HydrophobicContact CG2-CD1 3.84Å; I163-I167 HydrophobicContact CG2-CG1 4.5Å; I163-I167 VanDerWaalsContact O-CG1 3.31Å; I163-I167 WeakPolarHBondContact O-CG1 3.48Å; I163-I167 PolarHBondContact O-N 3.01Å; G164-I167 PolarHBondContact O-N 3.43Å; I167-L169 VanDerWaalsContact C-N 3.34Å; I167-L169 PolarHBondContact O-N 3.44Å; I167-F170 PolarHBondContact O-N 3.46Å; I167-A171 WeakPolarHBondContact O-CA 3.26Å; I167-A171 WeakPolarHBondContact O-CB 3.25Å; I167-A171 PolarHBondContact O-N 3.5Å; I167-A176 HydrophobicContact CG2-CB 4.4Å; I167-A176 WeakPolarHBondContact CG2-O 3.41Å; I167-I183 HydrophobicContact CD1-CD1 3.43Å; I167-I183 VanDerWaalsContact CD1-CD1 3.43Å
168	Y	97.6	Very high	97.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-43.8	173.6	-176	-85.5	0	0	0	111.8	I101 L105 Y108 G164 N165 L166 V177 R181 Y247 P250	I101-Y168 HydrophobicContact CG2-CE2 4.09Å; L105-Y168 HydrophobicContact CD1-CE2 4.03Å; Y108-Y168 HydrophobicContact CD1-CE1 4.07Å; Y108-Y168 HydrophobicContact CD1-CE2 4.05Å; Y108-Y168 AromaticContact CD1-CZ 3.62Å; Y108-Y168 HydrophobicContact CE1-CD1 4.38Å; Y108-Y168 AromaticContact CE1-CE1 3.99Å; Y108-Y168 HydrophobicContact CE1-CE1 3.99Å; Y108-Y168 HydrophobicContact CE1-CE2 4.18Å; Y108-Y168 AromaticContact CE1-CZ 3.89Å; Y108-Y168 PolarHBondContact OH-O 2.95Å; G164-Y168 PolarHBondContact O-N 3.38Å; N165-Y168 WeakPolarHBondContact O-CB 3.3Å; N165-Y168 PolarHBondContact O-N 3.3Å; L166-Y168 VanDerWaalsContact C-N 3.31Å; Y168-V177 HydrophobicContact CD2-CG1 3.75Å; Y168-V177 HydrophobicContact CE2-CG1 3.69Å; Y168-R181 HydrophobicContact CD2-CG 4.35Å; Y168-Y247 WeakPolarHBondContact CE1-O 3.25Å; Y168-Y247 PolarHBondContact OH-O 2.71Å; Y168-P250 HydrophobicContact CE1-CB 4.39Å
169	L	96.5	Very high	97.3	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-44	179.1	175.9	63.2	0	0	0	113	N165 L166 I167 F242 L244 N248 L252	N165-L169 WeakPolarHBondContact O-CB 3.47Å; N165-L169 PolarHBondContact O-N 3.48Å; L166-L169 HydrophobicContact CD2-CD2 4.28Å; L166-L169 WeakPolarHBondContact O-CB 3.45Å; L166-L169 PolarHBondContact O-N 2.92Å; I167-L169 VanDerWaalsContact C-N 3.34Å; I167-L169 PolarHBondContact O-N 3.44Å; L169-F242 HydrophobicContact CD1-CZ 3.78Å; L169-F242 HydrophobicContact CG-CZ 4Å; L169-L244 HydrophobicContact CD1-CD1 3.75Å; L169-N248 HydrophobicContact CD1-CB 4.16Å; L169-N248 WeakPolarHBondContact CD1-O 3.46Å; L169-N248 PolarHBondContact O-ND2 3.25Å; L169-L252 HydrophobicContact CD1-CB 3.86Å; L169-L252 HydrophobicContact CD2-CB 3.85Å; L169-L252 HydrophobicContact CD2-CD1 3.96Å; L169-L252 HydrophobicContact CD2-CG 4.46Å; L169-L252 HydrophobicContact CG-CB 4.46Å
170	F	96.1	Very high	97.3	Very high	120 Å²	120	36.7 Å²	36.7	53%	0.526	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	19.8	-173.9	-65.5	-66.5	0	0	0	113.7	L166 I167 P172 F242	L166-F170 HydrophobicContact CD2-CE2 4.3Å; L166-F170 WeakPolarHBondContact O-CD2 3.27Å; L166-F170 PolarHBondContact O-N 2.89Å; I167-F170 PolarHBondContact O-N 3.46Å; F170-P172 WeakPolarHBondContact O-CD 3.38Å; F170-F242 AromaticContact CD1-CD2 3.79Å; F170-F242 HydrophobicContact CD1-CD2 3.79Å; F170-F242 AromaticContact CD1-CE2 3.4Å; F170-F242 HydrophobicContact CD1-CE2 3.4Å; F170-F242 AromaticContact CD1-CZ 3.89Å; F170-F242 HydrophobicContact CD1-CZ 3.89Å; F170-F242 HydrophobicContact CE1-CD1 4.33Å; F170-F242 AromaticContact CE1-CD2 3.92Å; F170-F242 HydrophobicContact CE1-CD2 3.92Å; F170-F242 HydrophobicContact CE1-CE1 4.02Å; F170-F242 AromaticContact CE1-CE2 3.58Å; F170-F242 HydrophobicContact CE1-CE2 3.58Å; F170-F242 HydrophobicContact CE1-CG 4.28Å; F170-F242 AromaticContact CE1-CZ 3.64Å; F170-F242 HydrophobicContact CE1-CZ 3.64Å; F170-F242 HydrophobicContact CG-CE2 4.45Å
171	A	96.1	Very high	97.2	Very high	11 Å²	11	35.3 Å²	35.3	9%	0.091	20%	0.198	C	C	.	.			trans	-63.1	115.3	-174.2	0	0	0	0	0	112.1	W113 I167 A176 V177	W113-A171 HydrophobicContact CH2-CB 4.41Å; I167-A171 WeakPolarHBondContact O-CA 3.26Å; I167-A171 WeakPolarHBondContact O-CB 3.25Å; I167-A171 PolarHBondContact O-N 3.5Å; A171-A176 HydrophobicContact CB-CB 3.82Å; A171-V177 HydrophobicContact CB-CG2 3.56Å
172	P	93.7	Very high	97.2	Very high	99 Å²	99	38.5 Å²	38.5	64%	0.643	22%	0.215	S	C	*	.	S	Bend	trans	-84.7	-21.1	178.4	33.4	-34	0	0	0	112.7	W113 F170	W113-P172 PolarHBondContact NE1-O 2.85Å; F170-P172 WeakPolarHBondContact O-CD 3.38Å
173	V	95.6	Very high	97.2	Very high	72 Å²	72	38.7 Å²	38.7	44%	0.436	22%	0.216	S	C	.	.	S	Bend	trans	-139.1	157.3	-177.5	-63	0	0	0	0	110.1	W113 S175 A176	W113-V173 VanDerWaalsContact CZ2-C 3.48Å; V173-S175 PolarHBondContact O-N 3.42Å; V173-A176 HydrophobicContact CG2-CB 4.22Å; V173-A176 WeakPolarHBondContact O-CB 3.3Å; V173-A176 PolarHBondContact O-N 3.49Å
174	P	95.1	Very high	97.2	Very high	15 Å²	15	35.5 Å²	35.5	10%	0.097	20%	0.199	C	C	.	.	H	α-helix	trans	-57.5	-35.9	-177.5	-23.5	33.3	0	0	0	113.3	L109 W113 V117 H121 A176 V177 I178	L109-P174 HydrophobicContact CD2-CB 4.18Å; W113-P174 HydrophobicContact CB-CG 4.04Å; W113-P174 HydrophobicContact CD2-CB 4.5Å; W113-P174 HydrophobicContact CD2-CG 3.63Å; W113-P174 HydrophobicContact CE3-CG 4.12Å; W113-P174 HydrophobicContact CG-CG 3.58Å; V117-P174 HydrophobicContact CG1-CB 3.86Å; V117-P174 HydrophobicContact CG1-CG 3.38Å; H121-P174 HydrophobicContact CB-CB 4.45Å; H121-P174 VanDerWaalsContact CD2-CB 3.5Å; H121-P174 WeakPolarHBondContact CD2-CB 3.31Å; P174-A176 PolarHBondContact O-N 2.92Å; P174-V177 WeakPolarHBondContact O-CB 3.46Å; P174-V177 PolarHBondContact O-N 3.18Å; P174-I178 PolarHBondContact O-N 3.41Å
175	S	95.7	Very high	97.1	Very high	72 Å²	72	35.5 Å²	35.5	50%	0.503	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-26.2	178.4	-47.1	0	0	0	0	113.1	V173 I178 L179	V173-S175 PolarHBondContact O-N 3.42Å; S175-I178 PolarHBondContact O-N 3.21Å; S175-L179 WeakPolarHBondContact O-CB 3.31Å; S175-L179 PolarHBondContact O-N 2.97Å
176	A	97.4	Very high	97.1	Very high	17 Å²	17	37 Å²	37	14%	0.14	21%	0.207	C	C	.	.	H	α-helix	trans	-70.7	-35.2	173.3	0	0	0	0	0	111.2	I167 A171 V173 P174 I178 L179 G180	I167-A176 HydrophobicContact CG2-CB 4.4Å; I167-A176 WeakPolarHBondContact CG2-O 3.41Å; A171-A176 HydrophobicContact CB-CB 3.82Å; V173-A176 HydrophobicContact CG2-CB 4.22Å; V173-A176 WeakPolarHBondContact O-CB 3.3Å; V173-A176 PolarHBondContact O-N 3.49Å; P174-A176 PolarHBondContact O-N 2.92Å; A176-I178 VanDerWaalsContact C-N 3.34Å; A176-L179 PolarHBondContact O-N 3.34Å; A176-G180 PolarHBondContact O-N 3.26Å
177	V	97.4	Very high	97.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-45.6	172	-173	0	0	0	0	110.2	L105 Y108 L109 W113 T125 Y168 A171 P174 L179 G180 R181	L105-V177 HydrophobicContact CD1-CG1 3.77Å; Y108-V177 HydrophobicContact CD1-CG1 4.45Å; Y108-V177 HydrophobicContact CD1-CG2 4.4Å; Y108-V177 HydrophobicContact CE1-CG1 4.39Å; Y108-V177 HydrophobicContact CE1-CG2 3.84Å; L109-V177 HydrophobicContact CD2-CG2 4.39Å; W113-V177 HydrophobicContact CH2-CG2 3.83Å; W113-V177 HydrophobicContact CZ3-CG2 4.01Å; T125-V177 HydrophobicContact CG2-CG1 4.06Å; Y168-V177 HydrophobicContact CD2-CG1 3.75Å; Y168-V177 HydrophobicContact CE2-CG1 3.69Å; A171-V177 HydrophobicContact CB-CG2 3.56Å; P174-V177 WeakPolarHBondContact O-CB 3.46Å; P174-V177 PolarHBondContact O-N 3.18Å; V177-L179 PolarHBondContact O-N 2.92Å; V177-G180 PolarHBondContact O-N 2.84Å; V177-R181 WeakPolarHBondContact O-CG 3.24Å; V177-R181 PolarHBondContact O-N 3.2Å
178	I	97.3	Very high	97.1	Very high	30 Å²	30	32.2 Å²	32.2	15%	0.154	18%	0.184	C	C	.	.	H	α-helix	trans	-58.2	-48.2	174.9	-64.4	170	0	0	0	110.7	T124 T125 A128 P174 S175 A176 R181 L182	T124-I178 HydrophobicContact CG2-CD1 3.85Å; T125-I178 WeakPolarHBondContact OG1-CG1 3.3Å; A128-I178 HydrophobicContact CB-CG2 3.86Å; P174-I178 PolarHBondContact O-N 3.41Å; S175-I178 PolarHBondContact O-N 3.21Å; A176-I178 VanDerWaalsContact C-N 3.34Å; I178-R181 PolarHBondContact O-N 3.2Å; I178-L182 WeakPolarHBondContact O-CB 3.37Å; I178-L182 PolarHBondContact O-N 2.83Å
179	L	98.1	Very high	97	Very high	84 Å²	84	32.3 Å²	32.3	44%	0.44	18%	0.184	S	C	.	.	H	α-helix	trans	-62.1	-43.5	179.3	179.7	62.3	0	0	0	112	S175 A176 V177 L182 I183	S175-L179 WeakPolarHBondContact O-CB 3.31Å; S175-L179 PolarHBondContact O-N 2.97Å; A176-L179 PolarHBondContact O-N 3.34Å; V177-L179 PolarHBondContact O-N 2.92Å; L179-L182 PolarHBondContact O-N 3.39Å; L179-I183 HydrophobicContact CD1-CD1 3.89Å; L179-I183 HydrophobicContact CD1-CG1 4.24Å; L179-I183 HydrophobicContact CG-CD1 3.9Å; L179-I183 WeakPolarHBondContact O-CG1 3.23Å; L179-I183 PolarHBondContact O-N 2.89Å
180	G	98.2	Very high	97.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.1	-45.9	176.6	0	0	0	0	0	111.7	G164 A176 V177 I183 S184	G164-G180 VanDerWaalsContact CA-O 3.26Å; G164-G180 WeakPolarHBondContact CA-O 3.45Å; G164-G180 VanDerWaalsContact O-CA 3.29Å; G164-G180 WeakPolarHBondContact O-CA 3.37Å; A176-G180 PolarHBondContact O-N 3.26Å; V177-G180 PolarHBondContact O-N 2.84Å; G180-I183 PolarHBondContact O-N 2.97Å; G180-S184 WeakPolarHBondContact O-CB 3.36Å; G180-S184 PolarHBondContact O-N 3.35Å; G180-S184 PolarHBondContact O-OG 3.4Å
181	R	97.6	Very high	97	Very high	13 Å²	13	27.8 Å²	27.8	5%	0.049	17%	0.165	C	C	.	.	H	α-helix	trans	-65.3	-39.1	174.5	-67.6	-45.3	-58.5	153.9	-4.6	112.8	E97 T125 F129 Y168 V177 I178 G185	E97-R181 IonicContact OE1-CZ 3.98Å; E97-R181 VanDerWaalsContact OE1-CZ 3.3Å; E97-R181 IonicContact OE1-NH1 2.76Å; E97-R181 PolarHBondContact OE1-NH1 3.14Å; E97-R181 IonicContact OE1-NH2 3.28Å; E97-R181 PolarHBondContact OE1-NH2 2.86Å; T125-R181 HydrophobicContact CG2-CB 4.04Å; T125-R181 HydrophobicContact CG2-CG 3.47Å; T125-R181 VanDerWaalsContact CG2-CG 3.47Å; F129-R181 HydrophobicContact CB-CB 4.33Å; F129-R181 WeakPolarHBondContact CD2-O 3.24Å; Y168-R181 HydrophobicContact CD2-CG 4.35Å; V177-R181 WeakPolarHBondContact O-CG 3.24Å; V177-R181 PolarHBondContact O-N 3.2Å; I178-R181 PolarHBondContact O-N 3.2Å; R181-G185 PolarHBondContact O-N 3.21Å
182	L	98	Very high	97	Very high	68 Å²	68	27.2 Å²	27.2	36%	0.356	16%	0.16	S	C	.	.	H	α-helix	trans	-59.8	-50	175.1	-174.7	152.1	0	0	0	110.4	A128 S132 I178 L179 G185 I186	A128-L182 HydrophobicContact CB-CB 4.33Å; S132-L182 WeakPolarHBondContact CB-O 3.35Å; S132-L182 PolarHBondContact OG-O 3.02Å; S132-L182 VanDerWaalsContact OG-O 3.13Å; I178-L182 WeakPolarHBondContact O-CB 3.37Å; I178-L182 PolarHBondContact O-N 2.83Å; L179-L182 PolarHBondContact O-N 3.39Å; L182-G185 PolarHBondContact O-N 2.96Å; L182-I186 HydrophobicContact CD2-CD1 3.98Å; L182-I186 HydrophobicContact CD2-CG1 4.38Å; L182-I186 WeakPolarHBondContact O-CG1 3.37Å; L182-I186 PolarHBondContact O-N 3.44Å; L182-I186 VanDerWaalsContact O-N 3.12Å
183	I	98.5	Very high	97.1	Very high	27 Å²	27	22.5 Å²	22.5	14%	0.138	13%	0.13	C	C	.	.	H	α-helix	trans	-64.4	-43.6	-179.3	-68.4	166.7	0	0	0	111.5	L160 I163 I167 L179 G180 G185 I186 G187	L160-I183 HydrophobicContact CB-CG2 4.3Å; L160-I183 HydrophobicContact CD2-CG2 4.12Å; L160-I183 WeakPolarHBondContact O-CG2 3.29Å; I163-I183 HydrophobicContact CB-CG2 4.39Å; I163-I183 HydrophobicContact CG2-CG2 4.21Å; I167-I183 HydrophobicContact CD1-CD1 3.43Å; I167-I183 VanDerWaalsContact CD1-CD1 3.43Å; L179-I183 HydrophobicContact CD1-CD1 3.89Å; L179-I183 HydrophobicContact CD1-CG1 4.24Å; L179-I183 HydrophobicContact CG-CD1 3.9Å; L179-I183 WeakPolarHBondContact O-CG1 3.23Å; L179-I183 PolarHBondContact O-N 2.89Å; G180-I183 PolarHBondContact O-N 2.97Å; I183-G185 VanDerWaalsContact C-N 3.3Å; I183-G185 PolarHBondContact O-N 2.95Å; I183-I186 WeakPolarHBondContact O-CB 3.22Å; I183-I186 PolarHBondContact O-N 3.27Å; I183-I186 VanDerWaalsContact O-N 3.14Å; I183-G187 PolarHBondContact O-N 3.02Å; I183-G187 VanDerWaalsContact O-N 3.08Å
184	S	98.4	Very high	97.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.4	-42.8	173.2	-81.5	0	0	0	0	111.7	E161 N165 G180 I186 G187 A188	E161-S184 VanDerWaalsContact OE1-O 3.12Å; E161-S184 WeakPolarHBondContact OE2-CA 3.34Å; E161-S184 WeakPolarHBondContact OE2-CB 3.48Å; E161-S184 PolarHBondContact OE2-OG 2.94Å; E161-S184 VanDerWaalsContact OE2-OG 3.08Å; N165-S184 PolarHBondContact ND2-OG 3.27Å; G180-S184 WeakPolarHBondContact O-CB 3.36Å; G180-S184 PolarHBondContact O-N 3.35Å; G180-S184 PolarHBondContact O-OG 3.4Å; S184-I186 VanDerWaalsContact C-N 3.31Å; S184-I186 PolarHBondContact O-N 3.42Å; S184-G187 CarbonylContact O-C 3.47Å; S184-G187 VanDerWaalsContact O-CA 3.31Å; S184-G187 WeakPolarHBondContact O-CA 3.3Å; S184-G187 PolarHBondContact O-N 3.3Å; S184-A188 PolarHBondContact O-N 3.12Å
185	G	97.8	Very high	97	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.7	-28.8	177.6	0	0	0	0	0	113.9	S132 I133 R181 L182 I183 G187 A188 S189	S132-G185 VanDerWaalsContact OG-C 3.22Å; S132-G185 WeakPolarHBondContact OG-CA 3.41Å; I133-G185 VanDerWaalsContact CG1-O 3.25Å; I133-G185 WeakPolarHBondContact CG1-O 3.39Å; R181-G185 PolarHBondContact O-N 3.21Å; L182-G185 PolarHBondContact O-N 2.96Å; I183-G185 VanDerWaalsContact C-N 3.3Å; I183-G185 PolarHBondContact O-N 2.95Å; G185-G187 VanDerWaalsContact C-N 3.34Å; G185-A188 PolarHBondContact O-N 3.34Å; G185-S189 PolarHBondContact O-OG 2.83Å
186	I	98.4	Very high	96.9	Very high	32 Å²	32	15.7 Å²	15.7	16%	0.164	8%	0.083	C	C	.	.	H	α-helix	trans	-61.5	-45.8	166.2	-52.2	-177.6	0	0	0	109.8	S132 M136 Y140 L160 L182 I183 S184 A188 S189	S132-I186 PolarHBondContact OG-N 3.08Å; M136-I186 HydrophobicContact CB-CG2 4.24Å; M136-I186 HydrophobicContact CE-CD1 4.13Å; M136-I186 HydrophobicContact CE-CG1 4.42Å; M136-I186 HydrophobicContact CG-CB 4.1Å; M136-I186 HydrophobicContact CG-CG1 3.88Å; M136-I186 HydrophobicContact CG-CG2 3.75Å; M136-I186 HydrophobicContact SD-CG2 3.9Å; Y140-I186 HydrophobicContact CE2-CG2 4.34Å; Y140-I186 WeakPolarHBondContact CE2-O 3.34Å; Y140-I186 PolarHBondContact OH-O 2.86Å; L160-I186 HydrophobicContact CD1-CB 4.31Å; L160-I186 HydrophobicContact CD1-CG2 3.66Å; L182-I186 HydrophobicContact CD2-CD1 3.98Å; L182-I186 HydrophobicContact CD2-CG1 4.38Å; L182-I186 WeakPolarHBondContact O-CG1 3.37Å; L182-I186 PolarHBondContact O-N 3.44Å; L182-I186 VanDerWaalsContact O-N 3.12Å; I183-I186 WeakPolarHBondContact O-CB 3.22Å; I183-I186 PolarHBondContact O-N 3.27Å; I183-I186 VanDerWaalsContact O-N 3.14Å; S184-I186 VanDerWaalsContact C-N 3.31Å; S184-I186 PolarHBondContact O-N 3.42Å; I186-A188 PolarHBondContact O-N 3.14Å; I186-S189 WeakPolarHBondContact O-CB 3.38Å; I186-S189 PolarHBondContact O-N 3.13Å; I186-S189 PolarHBondContact O-OG 3.12Å
187	G	98	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.9	-40.6	175.6	0	0	0	0	0	113.4	W90 A157 I183 S184 G185 S189	W90-G187 WeakPolarHBondContact CH2-O 3.25Å; W90-G187 WeakPolarHBondContact CZ2-O 3.27Å; A157-G187 WeakPolarHBondContact CB-O 3.47Å; A157-G187 VanDerWaalsContact O-CA 3.27Å; A157-G187 WeakPolarHBondContact O-CA 3.37Å; I183-G187 PolarHBondContact O-N 3.02Å; I183-G187 VanDerWaalsContact O-N 3.08Å; S184-G187 CarbonylContact O-C 3.47Å; S184-G187 VanDerWaalsContact O-CA 3.31Å; S184-G187 WeakPolarHBondContact O-CA 3.3Å; S184-G187 PolarHBondContact O-N 3.3Å; G185-G187 VanDerWaalsContact C-N 3.34Å; G187-S189 PolarHBondContact O-N 3.43Å
188	A	97.1	Very high	96.4	Very high	12 Å²	12	15.3 Å²	15.3	10%	0.099	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-9	179.4	0	0	0	0	0	114.8	F129 I133 E161 S184 G185 I186 C190	F129-A188 HydrophobicContact CE2-CB 4.36Å; F129-A188 HydrophobicContact CZ-CB 4.08Å; I133-A188 HydrophobicContact CD1-CB 3.96Å; I133-A188 HydrophobicContact CG1-CB 4.09Å; E161-A188 WeakPolarHBondContact OE1-CB 3.31Å; E161-A188 PolarHBondContact OE1-N 3.41Å; S184-A188 PolarHBondContact O-N 3.12Å; G185-A188 PolarHBondContact O-N 3.34Å; I186-A188 PolarHBondContact O-N 3.14Å; A188-C190 PolarHBondContact O-N 3.45Å
189	S	96.9	Very high	96.1	Very high	1 Å²	1	14 Å²	14	1%	0.007	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	4.6	-168.3	-60.7	0	0	0	0	115.9	I133 M136 G185 I186 G187 E191 P192	I133-S189 VanDerWaalsContact CA-OG 3.32Å; I133-S189 WeakPolarHBondContact CA-OG 3.42Å; M136-S189 WeakPolarHBondContact CB-OG 3.42Å; G185-S189 PolarHBondContact O-OG 2.83Å; I186-S189 WeakPolarHBondContact O-CB 3.38Å; I186-S189 PolarHBondContact O-N 3.13Å; I186-S189 PolarHBondContact O-OG 3.12Å; G187-S189 PolarHBondContact O-N 3.43Å; S189-E191 VanDerWaalsContact C-N 3.27Å; S189-E191 PolarHBondContact O-N 3.49Å; S189-P192 WeakPolarHBondContact O-CD 3.37Å
190	C	97.1	Very high	95.7	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.			trans	-84.1	10.8	-173.3	-164.4	0	0	0	0	114.2	W90 Y140 L154 A157 A188 P193 L194	W90-C190 HydrophobicContact CH2-CB 4.11Å; W90-C190 HydrophobicContact CZ2-CB 4.16Å; Y140-C190 HydrophobicContact CD1-CB 3.94Å; Y140-C190 HydrophobicContact CE1-CB 3.94Å; Y140-C190 HydrophobicContact CG-CB 4.45Å; L154-C190 HydrophobicContact CD2-CB 4.36Å; A157-C190 HydrophobicContact CB-CB 3.68Å; A188-C190 PolarHBondContact O-N 3.45Å; C190-P193 WeakPolarHBondContact O-CD 3.3Å; C190-P193 VanDerWaalsContact O-CG 3.3Å; C190-P193 WeakPolarHBondContact O-CG 3.33Å; C190-L194 WeakPolarHBondContact O-CB 3.14Å; C190-L194 PolarHBondContact O-N 3.43Å
191	E	94.9	Very high	95.2	Very high	30 Å²	30	13.5 Å²	13.5	14%	0.14	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-43.3	180	-69.8	-170.4	160.9	0	0	114.4	S189 L194 Y195 R218	S189-E191 VanDerWaalsContact C-N 3.27Å; S189-E191 PolarHBondContact O-N 3.49Å; E191-L194 WeakPolarHBondContact O-CB 3.24Å; E191-L194 PolarHBondContact O-N 3.37Å; E191-Y195 HydrophobicContact CB-CD2 4.27Å; E191-Y195 HydrophobicContact CB-CE2 4.48Å; E191-Y195 WeakPolarHBondContact O-CD2 3.17Å; E191-Y195 PolarHBondContact O-N 3.41Å; E191-R218 IonicContact OE1-CZ 3.71Å; E191-R218 IonicContact OE1-NH1 3.75Å; E191-R218 PolarHBondContact OE1-NH1 2.85Å; E191-R218 IonicContact OE1-NH2 3.4Å
192	P	96.1	Very high	94.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-55.3	-53.4	-177.4	-22	29.5	0	0	0	115.2	T137 S189 L194 Y195 A196 Q472 R476	T137-P192 HydrophobicContact CG2-CG 3.56Å; S189-P192 WeakPolarHBondContact O-CD 3.37Å; P192-L194 VanDerWaalsContact C-N 3.32Å; P192-L194 PolarHBondContact O-N 3.45Å; P192-Y195 PolarHBondContact O-N 2.83Å; P192-A196 WeakPolarHBondContact O-CB 3.32Å; P192-A196 PolarHBondContact O-N 2.86Å; P192-Q472 HydrophobicContact CB-CB 4.07Å; P192-Q472 WeakPolarHBondContact O-CB 3.42Å; P192-R476 HydrophobicContact CG-CB 4.04Å; P192-R476 HydrophobicContact CG-CG 4.13Å
193	P	95.1	Very high	94.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-37.9	177.1	22.2	-32.4	0	0	0	112.8	S144 V150 L153 C190 Y195 A196 D197	S144-P193 WeakPolarHBondContact OG-CB 3.41Å; V150-P193 HydrophobicContact CB-CB 4.41Å; V150-P193 HydrophobicContact CG1-CB 4.08Å; V150-P193 HydrophobicContact CG2-CB 3.76Å; L153-P193 HydrophobicContact CD1-CB 4.02Å; L153-P193 HydrophobicContact CD1-CG 3.97Å; C190-P193 WeakPolarHBondContact O-CD 3.3Å; C190-P193 VanDerWaalsContact O-CG 3.3Å; C190-P193 WeakPolarHBondContact O-CG 3.33Å; P193-Y195 PolarHBondContact O-N 3Å; P193-A196 PolarHBondContact O-N 3.41Å; P193-D197 PolarHBondContact O-N 3.14Å
194	L	95.1	Very high	93.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-46.6	178	177.8	61	0	0	0	111.7	A87 W90 L154 C190 E191 P192 D197 I198 Y269	A87-L194 HydrophobicContact CB-CD1 3.83Å; A87-L194 HydrophobicContact CB-CD2 3.88Å; A87-L194 HydrophobicContact CB-CG 3.91Å; W90-L194 HydrophobicContact CB-CD2 4.33Å; W90-L194 HydrophobicContact CG-CD2 4.15Å; L154-L194 HydrophobicContact CD1-CD1 4.13Å; L154-L194 HydrophobicContact CD2-CB 4.48Å; L154-L194 HydrophobicContact CD2-CD1 4.38Å; L154-L194 HydrophobicContact CD2-CD2 4.33Å; C190-L194 WeakPolarHBondContact O-CB 3.14Å; C190-L194 PolarHBondContact O-N 3.43Å; E191-L194 WeakPolarHBondContact O-CB 3.24Å; E191-L194 PolarHBondContact O-N 3.37Å; P192-L194 VanDerWaalsContact C-N 3.32Å; P192-L194 PolarHBondContact O-N 3.45Å; L194-D197 PolarHBondContact O-N 3.42Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 2.9Å; L194-Y269 HydrophobicContact CD1-CE2 4.06Å
195	Y	94.5	Very high	92.9	Very high	13 Å²	13	23.2 Å²	23.2	5%	0.051	12%	0.117	C	C	.	.	H	α-helix	trans	-69.3	-35.3	176.4	-87.6	-93.4	0	0	0	112.4	E191 P192 P193 D197 I198 V199 L214 E456	E191-Y195 HydrophobicContact CB-CD2 4.27Å; E191-Y195 HydrophobicContact CB-CE2 4.48Å; E191-Y195 WeakPolarHBondContact O-CD2 3.17Å; E191-Y195 PolarHBondContact O-N 3.41Å; P192-Y195 PolarHBondContact O-N 2.83Å; P193-Y195 PolarHBondContact O-N 3Å; Y195-D197 VanDerWaalsContact C-N 3.32Å; Y195-D197 PolarHBondContact O-N 3.24Å; Y195-I198 PolarHBondContact O-N 3.35Å; Y195-V199 VanDerWaalsContact O-CG2 3.28Å; Y195-V199 WeakPolarHBondContact O-CG2 3.35Å; Y195-V199 PolarHBondContact O-N 3.33Å; Y195-L214 HydrophobicContact CD1-CD1 4.26Å; Y195-L214 HydrophobicContact CE1-CD1 3.47Å; Y195-L214 VanDerWaalsContact CE1-CD1 3.47Å; Y195-E456 VanDerWaalsContact CD1-OE1 3.32Å; Y195-E456 WeakPolarHBondContact CD1-OE1 3.22Å; Y195-E456 WeakPolarHBondContact CE1-OE1 3.34Å
196	A	93.7	Very high	92.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-42.5	176.2	0	0	0	0	0	111.8	P192 P193 V199 R200 M468 Q472	P192-A196 WeakPolarHBondContact O-CB 3.32Å; P192-A196 PolarHBondContact O-N 2.86Å; P193-A196 PolarHBondContact O-N 3.41Å; A196-V199 PolarHBondContact O-N 3.27Å; A196-R200 WeakPolarHBondContact O-CG 3.44Å; A196-R200 PolarHBondContact O-N 3.24Å; A196-M468 HydrophobicContact CB-CB 4.28Å; A196-M468 HydrophobicContact CB-CG 3.85Å; A196-Q472 HydrophobicContact CB-CG 4.28Å
197	D	92.7	Very high	92.1	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-39.3	175.7	-86.2	10.1	0	0	0	113	V150 P193 L194 Y195 V199 R200 A201 Y269	V150-D197 VanDerWaalsContact CB-OD2 3.28Å; V150-D197 WeakPolarHBondContact CB-OD2 3.29Å; V150-D197 HydrophobicContact CG2-CB 4.47Å; V150-D197 VanDerWaalsContact CG2-CG 3.43Å; V150-D197 WeakPolarHBondContact CG2-OD2 3.26Å; P193-D197 PolarHBondContact O-N 3.14Å; L194-D197 PolarHBondContact O-N 3.42Å; Y195-D197 VanDerWaalsContact C-N 3.32Å; Y195-D197 PolarHBondContact O-N 3.24Å; D197-V199 VanDerWaalsContact C-N 3.29Å; D197-V199 PolarHBondContact O-N 3.31Å; D197-R200 PolarHBondContact O-N 3.24Å; D197-R200 IonicContact OD1-NH1 3.48Å; D197-R200 PolarHBondContact OD1-NH1 3.5Å; D197-A201 WeakPolarHBondContact O-CB 3.4Å; D197-A201 PolarHBondContact O-N 3.49Å; D197-Y269 PolarHBondContact OD2-OH 3.08Å
198	I	91.6	Very high	91.9	Very high	5 Å²	5	24.7 Å²	24.7	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-42.1	174.4	-65.6	167.8	0	0	0	110.5	A87 L194 Y195 R200 A201 T202 L214	A87-I198 HydrophobicContact CB-CD1 3.44Å; A87-I198 VanDerWaalsContact CB-CD1 3.44Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 2.9Å; Y195-I198 PolarHBondContact O-N 3.35Å; I198-R200 VanDerWaalsContact C-N 3.34Å; I198-R200 PolarHBondContact O-N 2.65Å; I198-A201 PolarHBondContact O-N 2.79Å; I198-T202 HydrophobicContact CG2-CG2 4.19Å; I198-T202 WeakPolarHBondContact O-CB 3.23Å; I198-T202 VanDerWaalsContact O-CG2 3.25Å; I198-T202 WeakPolarHBondContact O-CG2 3.43Å; I198-T202 PolarHBondContact O-N 2.74Å; I198-T202 PolarHBondContact O-OG1 3.4Å; I198-L214 HydrophobicContact CD1-CD1 3.71Å; I198-L214 HydrophobicContact CD1-CD2 4.41Å
199	V	91.2	Very high	91.6	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.024	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-36.7	179	173.9	0	0	0	0	111.9	Y195 A196 D197 T202 R207 T460 M468	Y195-V199 VanDerWaalsContact O-CG2 3.28Å; Y195-V199 WeakPolarHBondContact O-CG2 3.35Å; Y195-V199 PolarHBondContact O-N 3.33Å; A196-V199 PolarHBondContact O-N 3.27Å; D197-V199 VanDerWaalsContact C-N 3.29Å; D197-V199 PolarHBondContact O-N 3.31Å; V199-T202 VanDerWaalsContact O-O 3.14Å; V199-R207 PolarHBondContact O-NH2 2.85Å; V199-R207 VanDerWaalsContact O-NH2 3.13Å; V199-T460 HydrophobicContact CG2-CG2 3.68Å; V199-M468 HydrophobicContact CB-CG 4.03Å; V199-M468 HydrophobicContact CB-SD 4.26Å; V199-M468 HydrophobicContact CG1-CE 3.67Å; V199-M468 HydrophobicContact CG1-CG 4.01Å; V199-M468 HydrophobicContact CG1-SD 3.91Å; V199-M468 HydrophobicContact CG2-SD 4.31Å
200	R	89.2	Confident	91.4	Very high	41 Å²	41	28.5 Å²	28.5	16%	0.155	14%	0.139	C	C	.	.	H	α-helix	trans	-67.7	-38.1	173.8	-70.4	168.6	179.4	128.5	3.3	112.3	A196 D197 I198 T202 K274 D469	A196-R200 WeakPolarHBondContact O-CG 3.44Å; A196-R200 PolarHBondContact O-N 3.24Å; D197-R200 PolarHBondContact O-N 3.24Å; D197-R200 IonicContact OD1-NH1 3.48Å; D197-R200 PolarHBondContact OD1-NH1 3.5Å; I198-R200 VanDerWaalsContact C-N 3.34Å; I198-R200 PolarHBondContact O-N 2.65Å; R200-T202 VanDerWaalsContact C-N 3.34Å; R200-K274 WeakPolarHBondContact CD-O 2.99Å; R200-K274 PolarHBondContact NE-O 2.87Å; R200-D469 IonicContact CZ-OD1 2.76Å; R200-D469 IonicContact CZ-OD2 3.62Å; R200-D469 IonicContact NH1-OD1 3.5Å; R200-D469 PolarHBondContact NH1-OD1 3.11Å; R200-D469 VanDerWaalsContact NH1-OD1 3.16Å; R200-D469 IonicContact NH1-OD2 3.18Å; R200-D469 IonicContact NH2-OD1 2.78Å; R200-D469 PolarHBondContact NH2-OD1 2.93Å; R200-D469 IonicContact NH2-OD2 3.47Å; R200-D469 PolarHBondContact NH2-OD2 3.48Å
201	A	87.2	Confident	91.2	Very high	32 Å²	32	28.8 Å²	28.8	26%	0.264	14%	0.141	S	C	.	.	H	α-helix	trans	-80.4	-12.7	-178.3	0	0	0	0	0	114	K80 M83 D197 I198	K80-A201 WeakPolarHBondContact CD-O 3.34Å; M83-A201 HydrophobicContact CE-CB 4.44Å; M83-A201 HydrophobicContact SD-CB 3.5Å; M83-A201 VanDerWaalsContact SD-CB 3.5Å; D197-A201 WeakPolarHBondContact O-CB 3.4Å; D197-A201 PolarHBondContact O-N 3.49Å; I198-A201 PolarHBondContact O-N 2.79Å
202	T	88.8	Confident	91.2	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.025	14%	0.135	C	C	.	.	S	Bend	trans	-114.6	139.8	-174.4	53.9	0	0	0	0	112.8	K80 I198 V199 R200 R207 Y210	K80-T202 HydrophobicContact CD-CG2 3.95Å; K80-T202 HydrophobicContact CG-CG2 4.4Å; I198-T202 HydrophobicContact CG2-CG2 4.19Å; I198-T202 WeakPolarHBondContact O-CB 3.23Å; I198-T202 VanDerWaalsContact O-CG2 3.25Å; I198-T202 WeakPolarHBondContact O-CG2 3.43Å; I198-T202 PolarHBondContact O-N 2.74Å; I198-T202 PolarHBondContact O-OG1 3.4Å; V199-T202 VanDerWaalsContact O-O 3.14Å; R200-T202 VanDerWaalsContact C-N 3.34Å; T202-R207 PolarHBondContact O-NE 3.44Å; T202-R207 VanDerWaalsContact O-NE 3.14Å; T202-R207 PolarHBondContact O-NH2 2.99Å; T202-R207 WeakPolarHBondContact OG1-CG 3.43Å; T202-Y210 HydrophobicContact CG2-CD2 3.46Å; T202-Y210 VanDerWaalsContact CG2-CD2 3.46Å; T202-Y210 HydrophobicContact CG2-CE2 3.74Å; T202-Y210 HydrophobicContact CG2-CG 3.94Å
203	N	86.9	Confident	91	Very high	115 Å²	115	30 Å²	30	62%	0.615	15%	0.15	S	C	*	.			trans	-70	150.5	173	-63.6	-26.7	0	0	0	110.8	D205 E206 R207	N203-D205 PolarHBondContact O-N 3.43Å; N203-D205 VanDerWaalsContact O-N 3.15Å; N203-E206 HydrophobicContact CB-CG 3.99Å; N203-E206 PolarHBondContact N-OE1 3.35Å; N203-E206 WeakPolarHBondContact O-CG 3.44Å; N203-E206 PolarHBondContact O-N 3.33Å; N203-R207 WeakPolarHBondContact O-CG 3.34Å; N203-R207 PolarHBondContact O-N 3.15Å; N203-R207 VanDerWaalsContact O-N 3.09Å
204	R	85.9	Confident	91	Very high	108 Å²	108	30.1 Å²	30.1	41%	0.408	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-40.2	-179.4	-77	-175.8	174.6	171.8	1.3	112.8	E206 K461	R204-E206 PolarHBondContact O-N 3.47Å; R204-K461 WeakPolarHBondContact O-CE 3.11Å; R204-K461 PolarHBondContact O-NZ 3.24Å
205	D	83.1	Confident	90.8	Very high	85 Å²	85	30.5 Å²	30.5	46%	0.455	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-30.9	-178.9	-69.2	-50	0	0	0	114.4	R36 N203	R36-D205 IonicContact CZ-OD1 3.94Å; R36-D205 IonicContact NH1-OD1 3.54Å; R36-D205 PolarHBondContact NH1-OD1 3.16Å; R36-D205 IonicContact NH2-OD1 3.56Å; R36-D205 PolarHBondContact NH2-OD1 2.96Å; R36-D205 IonicContact NH2-OD2 2.65Å; N203-D205 PolarHBondContact O-N 3.43Å; N203-D205 VanDerWaalsContact O-N 3.15Å
206	E	89.2	Confident	90.8	Very high	45 Å²	45	32 Å²	32	21%	0.21	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-16	-177	65	177.9	174.9	0	0	113.3	K80 N203 R204 T208 T209 Y210	K80-E206 IonicContact NZ-OE1 2.7Å; K80-E206 PolarHBondContact NZ-OE1 3.14Å; K80-E206 IonicContact NZ-OE2 2.66Å; K80-E206 PolarHBondContact NZ-OE2 3.47Å; N203-E206 HydrophobicContact CB-CG 3.99Å; N203-E206 PolarHBondContact N-OE1 3.35Å; N203-E206 WeakPolarHBondContact O-CG 3.44Å; N203-E206 PolarHBondContact O-N 3.33Å; R204-E206 PolarHBondContact O-N 3.47Å; E206-T208 VanDerWaalsContact C-N 3.3Å; E206-T208 PolarHBondContact O-N 2.94Å; E206-T209 WeakPolarHBondContact O-CB 3.4Å; E206-T209 PolarHBondContact O-N 3.08Å; E206-Y210 HydrophobicContact CB-CD2 4.3Å; E206-Y210 HydrophobicContact CB-CE2 3.97Å; E206-Y210 HydrophobicContact CG-CD2 4.14Å; E206-Y210 HydrophobicContact CG-CE2 3.74Å; E206-Y210 VanDerWaalsContact O-CD2 3.31Å; E206-Y210 WeakPolarHBondContact O-CD2 3.4Å; E206-Y210 PolarHBondContact O-N 3.35Å; E206-Y210 WeakPolarHBondContact OE2-CE2 3.29Å
207	R	90.1	Very high	90.8	Very high	16 Å²	16	33.2 Å²	33.2	6%	0.06	17%	0.169	C	C	.	.	H	α-helix	trans	-47.8	-47.8	-178.8	-84	171.2	-159.9	-177.2	0.1	113.5	V199 T202 N203 T209 Y210 I211 T460	V199-R207 PolarHBondContact O-NH2 2.85Å; V199-R207 VanDerWaalsContact O-NH2 3.13Å; T202-R207 PolarHBondContact O-NE 3.44Å; T202-R207 VanDerWaalsContact O-NE 3.14Å; T202-R207 PolarHBondContact O-NH2 2.99Å; T202-R207 WeakPolarHBondContact OG1-CG 3.43Å; N203-R207 WeakPolarHBondContact O-CG 3.34Å; N203-R207 PolarHBondContact O-N 3.15Å; N203-R207 VanDerWaalsContact O-N 3.09Å; R207-T209 PolarHBondContact O-N 3.47Å; R207-Y210 PolarHBondContact O-N 2.61Å; R207-Y210 VanDerWaalsContact O-N 3.14Å; R207-I211 PolarHBondContact O-N 2.88Å; R207-T460 PolarHBondContact NH1-O 2.69Å
208	T	92.8	Very high	90.7	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-56.1	-41.7	-179.9	-40.6	0	0	0	0	111.3	E206 I211 I212 D400 Y454 S457 K461	E206-T208 VanDerWaalsContact C-N 3.3Å; E206-T208 PolarHBondContact O-N 2.94Å; T208-I211 PolarHBondContact O-N 3.3Å; T208-I212 HydrophobicContact CG2-CD1 4.07Å; T208-I212 WeakPolarHBondContact O-CB 3.41Å; T208-I212 VanDerWaalsContact O-CG1 3.23Å; T208-I212 WeakPolarHBondContact O-CG1 3.25Å; T208-I212 PolarHBondContact O-N 2.92Å; T208-D400 PolarHBondContact OG1-OD1 3.16Å; T208-D400 PolarHBondContact OG1-OD2 3.45Å; T208-D400 VanDerWaalsContact OG1-OD2 3.07Å; T208-Y454 HydrophobicContact CG2-CD1 3.64Å; T208-Y454 HydrophobicContact CG2-CE1 3.51Å; T208-S457 PolarHBondContact OG1-OG 3.04Å; T208-K461 PolarHBondContact OG1-NZ 3.37Å
209	T	92.3	Very high	90.7	Very high	42 Å²	42	35.9 Å²	35.9	26%	0.258	18%	0.179	S	C	.	.	H	α-helix	trans	-67.4	-39.4	-178.6	-61.9	0	0	0	0	111.6	E206 R207 I212 V213	E206-T209 WeakPolarHBondContact O-CB 3.4Å; E206-T209 PolarHBondContact O-N 3.08Å; R207-T209 PolarHBondContact O-N 3.47Å; T209-I212 PolarHBondContact O-N 3.19Å; T209-V213 WeakPolarHBondContact O-CG2 3.28Å; T209-V213 PolarHBondContact O-N 2.97Å
210	Y	92.4	Very high	90.8	Very high	51 Å²	51	38.4 Å²	38.4	20%	0.2	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-42.6	175.6	-72.6	-77.4	0	0	0	112.1	K80 V84 T202 E206 R207 I212 V213 L214	K80-Y210 HydrophobicContact CD-CE2 4.25Å; K80-Y210 WeakPolarHBondContact CE-OH 3.33Å; V84-Y210 HydrophobicContact CB-CD1 4.13Å; V84-Y210 HydrophobicContact CB-CE1 4.33Å; V84-Y210 HydrophobicContact CG1-CD1 3.73Å; V84-Y210 HydrophobicContact CG1-CE1 4.16Å; V84-Y210 HydrophobicContact CG2-CD1 3.35Å; V84-Y210 HydrophobicContact CG2-CE1 3.64Å; V84-Y210 HydrophobicContact CG2-CG 4.25Å; T202-Y210 HydrophobicContact CG2-CD2 3.46Å; T202-Y210 VanDerWaalsContact CG2-CD2 3.46Å; T202-Y210 HydrophobicContact CG2-CE2 3.74Å; T202-Y210 HydrophobicContact CG2-CG 3.94Å; E206-Y210 HydrophobicContact CB-CD2 4.3Å; E206-Y210 HydrophobicContact CB-CE2 3.97Å; E206-Y210 HydrophobicContact CG-CD2 4.14Å; E206-Y210 HydrophobicContact CG-CE2 3.74Å; E206-Y210 VanDerWaalsContact O-CD2 3.31Å; E206-Y210 WeakPolarHBondContact O-CD2 3.4Å; E206-Y210 PolarHBondContact O-N 3.35Å; E206-Y210 WeakPolarHBondContact OE2-CE2 3.29Å; R207-Y210 PolarHBondContact O-N 2.61Å; R207-Y210 VanDerWaalsContact O-N 3.14Å; Y210-I212 VanDerWaalsContact C-N 3.32Å; Y210-I212 PolarHBondContact O-N 3.46Å; Y210-V213 WeakPolarHBondContact O-CB 3.35Å; Y210-V213 PolarHBondContact O-N 2.8Å; Y210-V213 VanDerWaalsContact O-N 3.11Å; Y210-L214 WeakPolarHBondContact O-CG 3.43Å; Y210-L214 PolarHBondContact O-N 3.06Å
211	I	93.4	Very high	90.8	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-43.1	175.8	-67.3	166	0	0	0	110.8	R207 T208 V213 L214 L215 E456 T460	R207-I211 PolarHBondContact O-N 2.88Å; T208-I211 PolarHBondContact O-N 3.3Å; I211-V213 VanDerWaalsContact C-N 3.31Å; I211-V213 PolarHBondContact O-N 2.8Å; I211-L214 PolarHBondContact O-N 3.46Å; I211-L215 HydrophobicContact CG2-CD1 4.25Å; I211-L215 WeakPolarHBondContact O-CG 3Å; I211-L215 PolarHBondContact O-N 2.9Å; I211-E456 HydrophobicContact CD1-CG 4.1Å; I211-E456 HydrophobicContact CG2-CB 4.37Å; I211-E456 HydrophobicContact CG2-CG 4.36Å; I211-T460 HydrophobicContact CD1-CG2 4.33Å
212	I	93	Very high	90.8	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-41.8	174.4	-71.6	170.1	0	0	0	111.2	T208 T209 Y210 L215 L216 V388 L391 R392 N395 A453	T208-I212 HydrophobicContact CG2-CD1 4.07Å; T208-I212 WeakPolarHBondContact O-CB 3.41Å; T208-I212 VanDerWaalsContact O-CG1 3.23Å; T208-I212 WeakPolarHBondContact O-CG1 3.25Å; T208-I212 PolarHBondContact O-N 2.92Å; T209-I212 PolarHBondContact O-N 3.19Å; Y210-I212 VanDerWaalsContact C-N 3.32Å; Y210-I212 PolarHBondContact O-N 3.46Å; I212-L215 PolarHBondContact O-N 2.81Å; I212-L216 PolarHBondContact O-N 3.45Å; I212-V388 HydrophobicContact CG2-CG1 3.71Å; I212-V388 WeakPolarHBondContact O-CG1 3.33Å; I212-L391 HydrophobicContact CD1-CB 3.98Å; I212-L391 HydrophobicContact CG1-CB 4.45Å; I212-R392 HydrophobicContact CG2-CB 4.22Å; I212-N395 HydrophobicContact CD1-CB 4.5Å; I212-A453 HydrophobicContact CG1-CB 3.85Å
213	V	92.7	Very high	90.7	Very high	50 Å²	50	38 Å²	38	30%	0.303	19%	0.188	S	C	.	.	H	α-helix	trans	-64.5	-42.4	176.2	170.4	0	0	0	0	111.5	T209 Y210 I211 L215 L216 T217	T209-V213 WeakPolarHBondContact O-CG2 3.28Å; T209-V213 PolarHBondContact O-N 2.97Å; Y210-V213 WeakPolarHBondContact O-CB 3.35Å; Y210-V213 PolarHBondContact O-N 2.8Å; Y210-V213 VanDerWaalsContact O-N 3.11Å; I211-V213 VanDerWaalsContact C-N 3.31Å; I211-V213 PolarHBondContact O-N 2.8Å; V213-L215 PolarHBondContact O-N 3.48Å; V213-L216 WeakPolarHBondContact O-CB 3.47Å; V213-L216 PolarHBondContact O-N 3.33Å; V213-T217 PolarHBondContact O-N 3.49Å; V213-T217 VanDerWaalsContact O-N 3.08Å; V213-T217 PolarHBondContact O-OG1 3.36Å
214	L	94.2	Very high	90.6	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-45.3	176.6	-64.6	172.7	0	0	0	111.2	A87 Y195 I198 Y210 I211 L216 T217 R218	A87-L214 HydrophobicContact CB-CD2 3.55Å; Y195-L214 HydrophobicContact CD1-CD1 4.26Å; Y195-L214 HydrophobicContact CE1-CD1 3.47Å; Y195-L214 VanDerWaalsContact CE1-CD1 3.47Å; I198-L214 HydrophobicContact CD1-CD1 3.71Å; I198-L214 HydrophobicContact CD1-CD2 4.41Å; Y210-L214 WeakPolarHBondContact O-CG 3.43Å; Y210-L214 PolarHBondContact O-N 3.06Å; I211-L214 PolarHBondContact O-N 3.46Å; L214-L216 PolarHBondContact O-N 2.66Å; L214-T217 PolarHBondContact O-N 3.31Å; L214-T217 PolarHBondContact O-OG1 2.75Å; L214-R218 WeakPolarHBondContact O-CG 3.48Å; L214-R218 PolarHBondContact O-N 2.88Å
215	L	92.3	Very high	90	Very high	10 Å²	10	31.7 Å²	31.7	5%	0.052	16%	0.158	C	C	.	.	H	α-helix	trans	-60.5	-44.4	175.1	-70.3	172.5	0	0	0	111.7	I211 I212 V213 T217 R218 Q219 Y452 A453	I211-L215 HydrophobicContact CG2-CD1 4.25Å; I211-L215 WeakPolarHBondContact O-CG 3Å; I211-L215 PolarHBondContact O-N 2.9Å; I212-L215 PolarHBondContact O-N 2.81Å; V213-L215 PolarHBondContact O-N 3.48Å; L215-T217 VanDerWaalsContact C-N 3.3Å; L215-T217 PolarHBondContact O-N 3.15Å; L215-R218 WeakPolarHBondContact O-CB 3.37Å; L215-R218 PolarHBondContact O-N 3.27Å; L215-Q219 WeakPolarHBondContact O-CG 3.19Å; L215-Q219 PolarHBondContact O-N 3.29Å; L215-Y452 HydrophobicContact CD2-CD2 4.4Å; L215-A453 HydrophobicContact CD1-CB 3.59Å
216	L	94.1	Very high	89.6	Confident	44 Å²	44	30.9 Å²	30.9	23%	0.23	16%	0.158	C	C	.	.	H	α-helix	trans	-55.2	-47	176.6	-178.5	58.2	0	0	0	111.6	I212 V213 L214 R218 Q219 I220 I385 V388	I212-L216 PolarHBondContact O-N 3.45Å; V213-L216 WeakPolarHBondContact O-CB 3.47Å; V213-L216 PolarHBondContact O-N 3.33Å; L214-L216 PolarHBondContact O-N 2.66Å; L216-R218 VanDerWaalsContact C-N 3.33Å; L216-R218 PolarHBondContact O-N 3.23Å; L216-Q219 PolarHBondContact O-N 2.69Å; L216-I220 HydrophobicContact CD1-CD1 4.4Å; L216-I220 HydrophobicContact CG-CD1 4.1Å; L216-I220 WeakPolarHBondContact O-CG1 3.3Å; L216-I220 PolarHBondContact O-N 3.4Å; L216-I220 VanDerWaalsContact O-N 3.08Å; L216-I385 HydrophobicContact CD1-CB 4.35Å; L216-I385 HydrophobicContact CD1-CG1 4.15Å; L216-I385 HydrophobicContact CD1-CG2 3.95Å; L216-V388 HydrophobicContact CB-CG1 3.72Å; L216-V388 HydrophobicContact CD1-CB 4.4Å; L216-V388 HydrophobicContact CD1-CG1 4.15Å; L216-V388 HydrophobicContact CG-CG1 4.42Å
217	T	93.6	Very high	89.2	Confident	26 Å²	26	32 Å²	32	16%	0.16	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-32.7	-177.4	50	0	0	0	0	113.6	S88 V213 L214 L215 I220 G221	S88-T217 WeakPolarHBondContact CA-OG1 3.23Å; S88-T217 PolarHBondContact O-OG1 3.49Å; S88-T217 PolarHBondContact OG-OG1 3.41Å; V213-T217 PolarHBondContact O-N 3.49Å; V213-T217 VanDerWaalsContact O-N 3.08Å; V213-T217 PolarHBondContact O-OG1 3.36Å; L214-T217 PolarHBondContact O-N 3.31Å; L214-T217 PolarHBondContact O-OG1 2.75Å; L215-T217 VanDerWaalsContact C-N 3.3Å; L215-T217 PolarHBondContact O-N 3.15Å; T217-I220 PolarHBondContact O-N 3.2Å; T217-G221 PolarHBondContact O-N 2.79Å
218	R	91.6	Very high	88.7	Confident	40 Å²	40	33.1 Å²	33.1	15%	0.151	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-43.7	172.4	-67.5	174.6	74.9	91.5	-3.2	111.7	N95 E191 L214 L215 L216 I220 G221 L222	N95-R218 WeakPolarHBondContact CB-O 3.36Å; N95-R218 WeakPolarHBondContact ND2-CB 3.41Å; E191-R218 IonicContact OE1-CZ 3.71Å; E191-R218 IonicContact OE1-NH1 3.75Å; E191-R218 PolarHBondContact OE1-NH1 2.85Å; E191-R218 IonicContact OE1-NH2 3.4Å; L214-R218 WeakPolarHBondContact O-CG 3.48Å; L214-R218 PolarHBondContact O-N 2.88Å; L215-R218 WeakPolarHBondContact O-CB 3.37Å; L215-R218 PolarHBondContact O-N 3.27Å; L216-R218 VanDerWaalsContact C-N 3.33Å; L216-R218 PolarHBondContact O-N 3.23Å; R218-I220 PolarHBondContact O-N 3.24Å; R218-G221 WeakPolarHBondContact O-CA 3.49Å; R218-G221 PolarHBondContact O-N 3.26Å; R218-G221 VanDerWaalsContact O-N 3.08Å; R218-L222 PolarHBondContact O-N 3.2Å
219	Q	91	Very high	87.9	Confident	25 Å²	25	34.7 Å²	34.7	12%	0.117	19%	0.185	C	C	.	.	H	α-helix	trans	-68.4	-36.4	-179.1	-62.2	-57.3	115.8	0	0	112.7	L215 L216 G221 L222 I223 I384 I385	L215-Q219 WeakPolarHBondContact O-CG 3.19Å; L215-Q219 PolarHBondContact O-N 3.29Å; L216-Q219 PolarHBondContact O-N 2.69Å; Q219-G221 PolarHBondContact O-N 3.29Å; Q219-L222 PolarHBondContact O-N 3.21Å; Q219-I223 PolarHBondContact O-N 3.34Å; Q219-I384 HydrophobicContact CB-CG2 4.36Å; Q219-I384 HydrophobicContact CG-CB 4.43Å; Q219-I384 HydrophobicContact CG-CG2 3.54Å; Q219-I385 HydrophobicContact CB-CG1 4.24Å
220	I	92.2	Very high	87.1	Confident	58 Å²	58	38.9 Å²	38.9	30%	0.297	21%	0.206	S	C	.	.	H	α-helix	trans	-59.5	-40.7	171.2	-63.8	167.8	0	0	0	109.7	F92 L216 T217 R218 L222 I223 F224 I385	F92-I220 HydrophobicContact CD2-CB 4.43Å; F92-I220 HydrophobicContact CD2-CG2 4.21Å; F92-I220 HydrophobicContact CE2-CG2 3.97Å; L216-I220 HydrophobicContact CD1-CD1 4.4Å; L216-I220 HydrophobicContact CG-CD1 4.1Å; L216-I220 WeakPolarHBondContact O-CG1 3.3Å; L216-I220 PolarHBondContact O-N 3.4Å; L216-I220 VanDerWaalsContact O-N 3.08Å; T217-I220 PolarHBondContact O-N 3.2Å; R218-I220 PolarHBondContact O-N 3.24Å; I220-L222 PolarHBondContact O-N 2.89Å; I220-I223 PolarHBondContact O-N 3.27Å; I220-F224 HydrophobicContact CG2-CD2 3.93Å; I220-F224 HydrophobicContact CG2-CE2 3.75Å; I220-F224 WeakPolarHBondContact O-CD2 3.27Å; I220-F224 PolarHBondContact O-N 3Å; I220-I385 HydrophobicContact CG1-CD1 3.97Å
221	G	90.6	Very high	86.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.7	-42.8	176.8	0	0	0	0	0	113.8	F92 T217 R218 Q219 I223 F224 G225	F92-G221 VanDerWaalsContact CD2-CA 3.47Å; T217-G221 PolarHBondContact O-N 2.79Å; R218-G221 WeakPolarHBondContact O-CA 3.49Å; R218-G221 PolarHBondContact O-N 3.26Å; R218-G221 VanDerWaalsContact O-N 3.08Å; Q219-G221 PolarHBondContact O-N 3.29Å; G221-I223 VanDerWaalsContact C-N 3.31Å; G221-I223 PolarHBondContact O-N 3.08Å; G221-F224 PolarHBondContact O-N 3.34Å; G221-G225 PolarHBondContact O-N 3.16Å
222	L	86.4	Confident	85.9	Confident	30 Å²	30	42.1 Å²	42.1	16%	0.157	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-36.3	177.4	-68	175.9	0	0	0	112.8	N95 A99 R218 Q219 I220 F224 G225	N95-L222 HydrophobicContact CB-CD2 3.99Å; N95-L222 HydrophobicContact CB-CG 3.99Å; A99-L222 HydrophobicContact CB-CD2 4.27Å; R218-L222 PolarHBondContact O-N 3.2Å; Q219-L222 PolarHBondContact O-N 3.21Å; I220-L222 PolarHBondContact O-N 2.89Å; L222-F224 VanDerWaalsContact C-N 3.34Å; L222-G225 PolarHBondContact O-N 2.83Å
223	I	86.4	Confident	85.2	Confident	39 Å²	39	44.7 Å²	44.7	20%	0.2	25%	0.246	C	C	.	.	H	α-helix	trans	-69.4	-33.6	178.7	-64.3	178.7	0	0	0	111.7	Q219 I220 G221 G225 P226 I382 I385	Q219-I223 PolarHBondContact O-N 3.34Å; I220-I223 PolarHBondContact O-N 3.27Å; G221-I223 VanDerWaalsContact C-N 3.31Å; G221-I223 PolarHBondContact O-N 3.08Å; I223-G225 PolarHBondContact O-N 3.19Å; I223-P226 WeakPolarHBondContact O-CD 3.2Å; I223-I382 HydrophobicContact CD1-CG1 4.12Å; I223-I385 HydrophobicContact CD1-CD1 3.3Å; I223-I385 HydrophobicContact CD1-CG1 4.27Å
224	F	84.2	Confident	84.5	Confident	89 Å²	89	51.8 Å²	51.8	39%	0.39	27%	0.272	S	S	.	.	H	α-helix	trans	-71.7	-16.5	178.8	-89.5	-105.3	0	0	0	113.1	F92 V96 I220 G221 L222 S227 F228	F92-F224 HydrophobicContact CE2-CD2 4.16Å; F92-F224 HydrophobicContact CE2-CG 4.32Å; F92-F224 HydrophobicContact CZ-CG 4.32Å; V96-F224 HydrophobicContact CG2-CB 4.23Å; I220-F224 HydrophobicContact CG2-CD2 3.93Å; I220-F224 HydrophobicContact CG2-CE2 3.75Å; I220-F224 WeakPolarHBondContact O-CD2 3.27Å; I220-F224 PolarHBondContact O-N 3Å; G221-F224 PolarHBondContact O-N 3.34Å; L222-F224 VanDerWaalsContact C-N 3.34Å; F224-S227 WeakPolarHBondContact O-CB 3.43Å; F224-S227 PolarHBondContact O-N 3.31Å; F224-S227 VanDerWaalsContact O-N 3.15Å; F224-F228 HydrophobicContact CB-CD2 4.05Å; F224-F228 HydrophobicContact CB-CE2 3.86Å; F224-F228 AromaticContact CD1-CE2 3.88Å; F224-F228 HydrophobicContact CD1-CE2 3.88Å; F224-F228 HydrophobicContact CD1-CZ 4.19Å; F224-F228 HydrophobicContact CG-CE2 4.34Å; F224-F228 VanDerWaalsContact O-CD2 3.23Å; F224-F228 WeakPolarHBondContact O-CD2 3.46Å; F224-F228 PolarHBondContact O-N 3.42Å
225	G	74.4	Confident	83.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-51	-62.2	177.2	0	0	0	0	0	113	G221 L222 I223 S227 F228 T229	G221-G225 PolarHBondContact O-N 3.16Å; L222-G225 PolarHBondContact O-N 2.83Å; I223-G225 PolarHBondContact O-N 3.19Å; G225-S227 PolarHBondContact O-N 3.44Å; G225-F228 PolarHBondContact O-N 3.18Å; G225-F228 VanDerWaalsContact O-N 3.12Å; G225-T229 PolarHBondContact O-N 3.14Å; G225-T229 PolarHBondContact O-OG1 2.95Å; G225-T229 VanDerWaalsContact O-OG1 3.09Å
226	P	74.3	Confident	83.4	Confident	69 Å²	69	57.2 Å²	57.2	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-53.1	-38.2	175	-29.1	34.4	0	0	0	114.2	I223 T229 L230	I223-P226 WeakPolarHBondContact O-CD 3.2Å; P226-T229 PolarHBondContact O-N 3.44Å; P226-L230 WeakPolarHBondContact O-CB 3.38Å; P226-L230 VanDerWaalsContact O-CG 3.28Å; P226-L230 WeakPolarHBondContact O-CG 3.36Å; P226-L230 PolarHBondContact O-N 2.91Å
227	S	80.7	Confident	83.2	Confident	67 Å²	67	62.5 Å²	62.5	47%	0.469	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-44.1	178.2	-53.6	0	0	0	0	112.1	F224 G225 L230 M231	F224-S227 WeakPolarHBondContact O-CB 3.43Å; F224-S227 PolarHBondContact O-N 3.31Å; F224-S227 VanDerWaalsContact O-N 3.15Å; G225-S227 PolarHBondContact O-N 3.44Å; S227-L230 PolarHBondContact O-N 2.88Å; S227-M231 PolarHBondContact O-N 3.13Å
228	F	80.8	Confident	82.8	Confident	40 Å²	40	70.4 Å²	70.4	18%	0.175	35%	0.346	C	S	.	.	H	α-helix	trans	-71	-36.8	175.6	-72.7	-58.2	0	0	0	112.2	V96 V100 F224 G225 L230 M231 M232 L253	V96-F228 HydrophobicContact CG1-CD2 3.68Å; V96-F228 HydrophobicContact CG1-CE2 3.77Å; V96-F228 HydrophobicContact CG2-CE2 4.35Å; V100-F228 HydrophobicContact CG1-CB 3.67Å; V100-F228 HydrophobicContact CG1-CD2 4.5Å; F224-F228 HydrophobicContact CB-CD2 4.05Å; F224-F228 HydrophobicContact CB-CE2 3.86Å; F224-F228 AromaticContact CD1-CE2 3.88Å; F224-F228 HydrophobicContact CD1-CE2 3.88Å; F224-F228 HydrophobicContact CD1-CZ 4.19Å; F224-F228 HydrophobicContact CG-CE2 4.34Å; F224-F228 VanDerWaalsContact O-CD2 3.23Å; F224-F228 WeakPolarHBondContact O-CD2 3.46Å; F224-F228 PolarHBondContact O-N 3.42Å; G225-F228 PolarHBondContact O-N 3.18Å; G225-F228 VanDerWaalsContact O-N 3.12Å; F228-L230 VanDerWaalsContact C-N 3.33Å; F228-L230 PolarHBondContact O-N 3.36Å; F228-M231 HydrophobicContact CD1-CE 3.85Å; F228-M231 HydrophobicContact CD1-SD 4.38Å; F228-M231 HydrophobicContact CE1-CE 4.43Å; F228-M231 WeakPolarHBondContact O-CB 3.23Å; F228-M231 PolarHBondContact O-N 3.3Å; F228-M232 HydrophobicContact CB-CE 4.33Å; F228-M232 WeakPolarHBondContact O-CE 3.38Å; F228-M232 WeakPolarHBondContact O-CG 3.43Å; F228-M232 PolarHBondContact O-N 3.01Å; F228-L253 HydrophobicContact CB-CD2 3.86Å; F228-L253 HydrophobicContact CD1-CD1 4.38Å; F228-L253 HydrophobicContact CD1-CD2 3.89Å; F228-L253 HydrophobicContact CD2-CD2 4.4Å; F228-L253 HydrophobicContact CE1-CD1 4.4Å; F228-L253 HydrophobicContact CG-CD2 3.81Å
229	T	74.4	Confident	82.5	Confident	35 Å²	35	73.5 Å²	73.5	22%	0.215	37%	0.369	C	S	.	.	H	α-helix	trans	-60.3	-42.7	173.1	-57.4	0	0	0	0	111.3	G225 P226 M232 A233	G225-T229 PolarHBondContact O-N 3.14Å; G225-T229 PolarHBondContact O-OG1 2.95Å; G225-T229 VanDerWaalsContact O-OG1 3.09Å; P226-T229 PolarHBondContact O-N 3.44Å; T229-M232 CarbonylContact O-C 3.59Å; T229-M232 PolarHBondContact O-N 2.84Å; T229-A233 WeakPolarHBondContact O-CB 3.39Å; T229-A233 PolarHBondContact O-N 3.36Å
230	L	76.6	Confident	82.2	Confident	130 Å²	130	77 Å²	77	68%	0.681	40%	0.402	S	S	*	.	H	α-helix	trans	-65.5	-38.5	174.9	-72.2	172.9	0	0	0	112.6	P226 S227 F228 M232 A233	P226-L230 WeakPolarHBondContact O-CB 3.38Å; P226-L230 VanDerWaalsContact O-CG 3.28Å; P226-L230 WeakPolarHBondContact O-CG 3.36Å; P226-L230 PolarHBondContact O-N 2.91Å; S227-L230 PolarHBondContact O-N 2.88Å; F228-L230 VanDerWaalsContact C-N 3.33Å; F228-L230 PolarHBondContact O-N 3.36Å; L230-M232 VanDerWaalsContact C-N 3.27Å; L230-M232 PolarHBondContact O-N 3.24Å; L230-A233 PolarHBondContact O-N 2.87Å
231	M	78.7	Confident	81.8	Confident	120 Å²	120	82.7 Å²	82.7	59%	0.591	43%	0.433	S	S	*	.	H	α-helix	trans	-61.5	-38.7	173.5	-173.5	-176.1	77.4	0	0	111.2	S227 F228 L253	S227-M231 PolarHBondContact O-N 3.13Å; F228-M231 HydrophobicContact CD1-CE 3.85Å; F228-M231 HydrophobicContact CD1-SD 4.38Å; F228-M231 HydrophobicContact CE1-CE 4.43Å; F228-M231 WeakPolarHBondContact O-CB 3.23Å; F228-M231 PolarHBondContact O-N 3.3Å; M231-L253 HydrophobicContact CE-CD1 4.43Å
232	M	82.6	Confident	81.6	Confident	5 Å²	5	85.6 Å²	85.6	3%	0.025	45%	0.446	C	S	.	.	H	α-helix	trans	-80.9	-21	178.3	-69.2	-176.8	-69.5	0	0	113.4	V100 F228 T229 L230 K234 M235 V246 G249 P250 L253	V100-M232 HydrophobicContact CB-CE 4.12Å; V100-M232 HydrophobicContact CG1-CE 4.24Å; F228-M232 HydrophobicContact CB-CE 4.33Å; F228-M232 WeakPolarHBondContact O-CE 3.38Å; F228-M232 WeakPolarHBondContact O-CG 3.43Å; F228-M232 PolarHBondContact O-N 3.01Å; T229-M232 CarbonylContact O-C 3.59Å; T229-M232 PolarHBondContact O-N 2.84Å; L230-M232 VanDerWaalsContact C-N 3.27Å; L230-M232 PolarHBondContact O-N 3.24Å; M232-K234 PolarHBondContact O-N 3.36Å; M232-M235 HydrophobicContact CB-CE 4.24Å; M232-M235 HydrophobicContact CG-CE 3.94Å; M232-M235 WeakPolarHBondContact O-CB 3.45Å; M232-M235 PolarHBondContact O-N 3.37Å; M232-M235 HydrophobicContact SD-CE 4.32Å; M232-V246 HydrophobicContact CB-CG1 4.25Å; M232-V246 WeakPolarHBondContact O-CG2 3.19Å; M232-G249 VanDerWaalsContact SD-C 3.55Å; M232-P250 HydrophobicContact CE-CG 3.9Å; M232-P250 HydrophobicContact SD-CG 4.04Å; M232-L253 HydrophobicContact CE-CD2 4.25Å; M232-L253 HydrophobicContact SD-CD2 4.39Å
233	A	77.8	Confident	81.7	Confident	58 Å²	58	85.2 Å²	85.2	48%	0.479	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.9	-173.8	0	0	0	0	0	114.4	T229 L230	T229-A233 WeakPolarHBondContact O-CB 3.39Å; T229-A233 PolarHBondContact O-N 3.36Å; L230-A233 PolarHBondContact O-N 2.87Å
234	K	77	Confident	82	Confident	199 Å²	199	84.5 Å²	84.5	87%	0.865	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	5.6	176.4	-63.4	-173.6	179	-178.4	0	113.6	M232 D236	M232-K234 PolarHBondContact O-N 3.36Å; K234-D236 PolarHBondContact O-N 2.91Å
235	M	80.7	Confident	82.2	Confident	32 Å²	32	81.2 Å²	81.2	16%	0.158	43%	0.43	C	S	.	.			trans	-82.1	113.9	-177.9	-167.5	162.9	66.1	0	0	109.7	M232 Y237 L244 N245	M232-M235 HydrophobicContact CB-CE 4.24Å; M232-M235 HydrophobicContact CG-CE 3.94Å; M232-M235 WeakPolarHBondContact O-CB 3.45Å; M232-M235 PolarHBondContact O-N 3.37Å; M232-M235 HydrophobicContact SD-CE 4.32Å; M235-Y237 HydrophobicContact CG-CD2 3.54Å; M235-Y237 HydrophobicContact CG-CE2 3.73Å; M235-Y237 HydrophobicContact SD-CD2 4.35Å; M235-Y237 HydrophobicContact SD-CE2 4.45Å; M235-L244 HydrophobicContact CE-CD1 4.12Å; M235-L244 HydrophobicContact CE-CD2 4.43Å; M235-L244 HydrophobicContact CE-CG 3.96Å; M235-L244 HydrophobicContact CG-CD2 4.47Å; M235-L244 HydrophobicContact CG-CG 4.27Å; M235-L244 HydrophobicContact SD-CD2 3.82Å; M235-L244 HydrophobicContact SD-CG 3.9Å; M235-N245 VanDerWaalsContact CE-O 3.3Å; M235-N245 WeakPolarHBondContact CE-O 3.32Å; M235-N245 VanDerWaalsContact O-CA 3.23Å; M235-N245 WeakPolarHBondContact O-CA 3.49Å
236	D	84.3	Confident	82.8	Confident	95 Å²	95	82.7 Å²	82.7	51%	0.508	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	78.3	167	-174.1	17	0	0	0	108.1	K234 R238 L244	K234-D236 PolarHBondContact O-N 2.91Å; D236-R238 IonicContact OD1-NE 3.67Å; D236-L244 WeakPolarHBondContact CA-O 3.26Å
237	Y	88.5	Confident	83.5	Confident	155 Å²	155	82 Å²	82	61%	0.608	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	119	177.8	-64.3	-75.5	0	0	0	109.6	M235 L244	M235-Y237 HydrophobicContact CG-CD2 3.54Å; M235-Y237 HydrophobicContact CG-CE2 3.73Å; M235-Y237 HydrophobicContact SD-CD2 4.35Å; M235-Y237 HydrophobicContact SD-CE2 4.45Å; Y237-L244 HydrophobicContact CD2-CD2 4.39Å; Y237-L244 PolarHBondContact N-O 3.49Å; Y237-L244 PolarHBondContact O-N 3.05Å
238	R	84.8	Confident	84.1	Confident	192 Å²	192	79 Å²	79	73%	0.725	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.7	177.2	-62.1	-175.8	179.8	-138.9	0.3	110.1	D236 A243	D236-R238 IonicContact OD1-NE 3.67Å; R238-A243 HydrophobicContact CG-CB 4.09Å
239	V	85.4	Confident	84.6	Confident	106 Å²	106	77.1 Å²	77.1	64%	0.642	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	106.2	174.3	-177.3	0	0	0	0	107.9	N241 F242	V239-N241 PolarHBondContact O-N 3Å; V239-F242 PolarHBondContact N-O 3.17Å; V239-F242 PolarHBondContact O-N 3.24Å
240	A	84.4	Confident	85.5	Confident	98 Å²	98	75.5 Å²	75.5	81%	0.81	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	-119.6	-174.1	0	0	0	0	0	112.1	F242	A240-F242 VanDerWaalsContact C-N 3.31Å
241	N	84.4	Confident	86.4	Confident	177 Å²	177	69.3 Å²	69.3	95%	0.947	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	5.5	-179.9	-65.3	-16.5	0	0	0	113.5	V239	V239-N241 PolarHBondContact O-N 3Å
242	F	87.4	Confident	87.2	Confident	61 Å²	61	66.3 Å²	66.3	27%	0.268	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	123.2	-178.2	-180	-105.7	0	0	0	110.5	L169 F170 V239 A240 L244	L169-F242 HydrophobicContact CD1-CZ 3.78Å; L169-F242 HydrophobicContact CG-CZ 4Å; F170-F242 AromaticContact CD1-CD2 3.79Å; F170-F242 HydrophobicContact CD1-CD2 3.79Å; F170-F242 AromaticContact CD1-CE2 3.4Å; F170-F242 HydrophobicContact CD1-CE2 3.4Å; F170-F242 AromaticContact CD1-CZ 3.89Å; F170-F242 HydrophobicContact CD1-CZ 3.89Å; F170-F242 HydrophobicContact CE1-CD1 4.33Å; F170-F242 AromaticContact CE1-CD2 3.92Å; F170-F242 HydrophobicContact CE1-CD2 3.92Å; F170-F242 HydrophobicContact CE1-CE1 4.02Å; F170-F242 AromaticContact CE1-CE2 3.58Å; F170-F242 HydrophobicContact CE1-CE2 3.58Å; F170-F242 HydrophobicContact CE1-CG 4.28Å; F170-F242 AromaticContact CE1-CZ 3.64Å; F170-F242 HydrophobicContact CE1-CZ 3.64Å; F170-F242 HydrophobicContact CG-CE2 4.45Å; V239-F242 PolarHBondContact N-O 3.17Å; V239-F242 PolarHBondContact O-N 3.24Å; A240-F242 VanDerWaalsContact C-N 3.31Å; F242-L244 HydrophobicContact CE1-CB 3.94Å
243	A	88.1	Confident	87.8	Confident	23 Å²	23	67.4 Å²	67.4	19%	0.19	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.5	172.6	0	0	0	0	0	109.3	R238 N248	R238-A243 HydrophobicContact CG-CB 4.09Å; A243-N248 PolarHBondContact O-ND2 3.33Å
244	L	91.9	Very high	88.7	Confident	23 Å²	23	64.6 Å²	64.6	12%	0.12	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	111.9	169.2	178.6	68.6	0	0	0	108.4	L169 M235 D236 Y237 F242 L252	L169-L244 HydrophobicContact CD1-CD1 3.75Å; M235-L244 HydrophobicContact CE-CD1 4.12Å; M235-L244 HydrophobicContact CE-CD2 4.43Å; M235-L244 HydrophobicContact CE-CG 3.96Å; M235-L244 HydrophobicContact CG-CD2 4.47Å; M235-L244 HydrophobicContact CG-CG 4.27Å; M235-L244 HydrophobicContact SD-CD2 3.82Å; M235-L244 HydrophobicContact SD-CG 3.9Å; D236-L244 WeakPolarHBondContact CA-O 3.26Å; Y237-L244 HydrophobicContact CD2-CD2 4.39Å; Y237-L244 PolarHBondContact N-O 3.49Å; Y237-L244 PolarHBondContact O-N 3.05Å; F242-L244 HydrophobicContact CE1-CB 3.94Å; L244-L252 HydrophobicContact CD1-CB 4.33Å; L244-L252 HydrophobicContact CD1-CD2 3.99Å; L244-L252 HydrophobicContact CD2-CD2 3.67Å
245	N	89.8	Confident	89.7	Confident	21 Å²	21	55.5 Å²	55.5	11%	0.112	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	-174.3	-178	62.7	23.4	0	0	0	112.3	Y112 M235 Y247 N248 G249	Y112-N245 PolarHBondContact OH-ND2 3.13Å; Y112-N245 PolarHBondContact OH-OD1 3.09Å; M235-N245 VanDerWaalsContact CE-O 3.3Å; M235-N245 WeakPolarHBondContact CE-O 3.32Å; M235-N245 VanDerWaalsContact O-CA 3.23Å; M235-N245 WeakPolarHBondContact O-CA 3.49Å; N245-Y247 PolarHBondContact O-N 3.11Å; N245-Y247 VanDerWaalsContact O-N 3.08Å; N245-Y247 WeakPolarHBondContact OD1-CB 3.42Å; N245-Y247 WeakPolarHBondContact OD1-CD2 3.41Å; N245-Y247 PolarHBondContact OD1-N 3.31Å; N245-Y247 VanDerWaalsContact OD1-N 3.13Å; N245-N248 PolarHBondContact N-OD1 2.84Å; N245-N248 PolarHBondContact O-OD1 2.78Å; N245-N248 PolarHBondContact OD1-N 3.13Å; N245-N248 PolarHBondContact OD1-OD1 3.46Å; N245-G249 VanDerWaalsContact O-CA 3.31Å; N245-G249 WeakPolarHBondContact O-CA 3.28Å; N245-G249 PolarHBondContact O-N 3.46Å
246	V	86.6	Confident	90.5	Very high	31 Å²	31	58.1 Å²	58.1	19%	0.188	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.8	-179.2	-159.9	0	0	0	0	112.9	M232 P250	M232-V246 HydrophobicContact CB-CG1 4.25Å; M232-V246 WeakPolarHBondContact O-CG2 3.19Å; V246-P250 VanDerWaalsContact O-CD 3.29Å; V246-P250 WeakPolarHBondContact O-CD 3.44Å
247	Y	89.3	Confident	91.1	Very high	54 Å²	54	55.4 Å²	55.4	21%	0.212	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-44.1	-171.4	-52.9	-60.9	0	0	0	113.4	L107 Y108 E111 Y112 Y168 N245	L107-Y247 HydrophobicContact CB-CD1 3.93Å; L107-Y247 HydrophobicContact CB-CE1 3.53Å; L107-Y247 HydrophobicContact CD1-CE1 4.42Å; Y108-Y247 VanDerWaalsContact CD2-CB 3.49Å; Y108-Y247 HydrophobicContact CD2-CG 4.46Å; E111-Y247 HydrophobicContact CB-CD2 4.28Å; E111-Y247 HydrophobicContact CB-CE2 3.98Å; E111-Y247 HydrophobicContact CG-CD2 4.12Å; E111-Y247 HydrophobicContact CG-CE2 3.66Å; Y112-Y247 HydrophobicContact CE2-CD2 4.09Å; Y168-Y247 WeakPolarHBondContact CE1-O 3.25Å; Y168-Y247 PolarHBondContact OH-O 2.71Å; N245-Y247 PolarHBondContact O-N 3.11Å; N245-Y247 VanDerWaalsContact O-N 3.08Å; N245-Y247 WeakPolarHBondContact OD1-CB 3.42Å; N245-Y247 WeakPolarHBondContact OD1-CD2 3.41Å; N245-Y247 PolarHBondContact OD1-N 3.31Å; N245-Y247 VanDerWaalsContact OD1-N 3.13Å
248	N	92.8	Very high	91.5	Very high	4 Å²	4	48 Å²	48	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-16.4	177	64.9	-6.8	0	0	0	113	Y108 L169 A243 N245 P250 G251	Y108-N248 HydrophobicContact CE2-CB 4.36Å; L169-N248 HydrophobicContact CD1-CB 4.16Å; L169-N248 WeakPolarHBondContact CD1-O 3.46Å; L169-N248 PolarHBondContact O-ND2 3.25Å; A243-N248 PolarHBondContact O-ND2 3.33Å; N245-N248 PolarHBondContact N-OD1 2.84Å; N245-N248 PolarHBondContact O-OD1 2.78Å; N245-N248 PolarHBondContact OD1-N 3.13Å; N245-N248 PolarHBondContact OD1-OD1 3.46Å; N248-P250 VanDerWaalsContact C-CD 3.42Å; N248-P250 VanDerWaalsContact C-N 3.35Å; N248-G251 PolarHBondContact O-N 3.14Å
249	G	92.2	Very high	92.2	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-46.1	-43.7	173.8	0	0	0	0	0	116.2	M232 N245 G251 L252 L253	M232-G249 VanDerWaalsContact SD-C 3.55Å; N245-G249 VanDerWaalsContact O-CA 3.31Å; N245-G249 WeakPolarHBondContact O-CA 3.28Å; N245-G249 PolarHBondContact O-N 3.46Å; G249-G251 PolarHBondContact O-N 2.92Å; G249-L252 PolarHBondContact O-N 2.83Å; G249-L252 VanDerWaalsContact O-N 3.08Å; G249-L253 PolarHBondContact O-N 3.42Å
250	P	93.1	Very high	92.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-52.4	-38.4	174.1	-30.6	36.3	0	0	0	113.6	V100 I101 Y168 M232 V246 N248 L253 M254	V100-P250 HydrophobicContact CB-CB 4.44Å; V100-P250 HydrophobicContact CG2-CB 4Å; I101-P250 HydrophobicContact CG1-CB 3.77Å; Y168-P250 HydrophobicContact CE1-CB 4.39Å; M232-P250 HydrophobicContact CE-CG 3.9Å; M232-P250 HydrophobicContact SD-CG 4.04Å; V246-P250 VanDerWaalsContact O-CD 3.29Å; V246-P250 WeakPolarHBondContact O-CD 3.44Å; N248-P250 VanDerWaalsContact C-CD 3.42Å; N248-P250 VanDerWaalsContact C-N 3.35Å; P250-L253 PolarHBondContact O-N 3.46Å; P250-M254 WeakPolarHBondContact O-CB 3.36Å; P250-M254 WeakPolarHBondContact O-CG 3.35Å; P250-M254 PolarHBondContact O-N 3.29Å
251	G	95.7	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-42.1	177.4	0	0	0	0	0	112.5	N165 N248 G249 A255	N165-G251 WeakPolarHBondContact CB-O 3.34Å; N165-G251 WeakPolarHBondContact O-CA 3.47Å; N248-G251 PolarHBondContact O-N 3.14Å; G249-G251 PolarHBondContact O-N 2.92Å; G251-A255 VanDerWaalsContact O-CB 3.24Å; G251-A255 WeakPolarHBondContact O-CB 3.42Å; G251-A255 PolarHBondContact O-N 3.3Å
252	L	95.1	Very high	94.1	Very high	58 Å²	58	30 Å²	30	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-65.5	-47.8	175.3	179.9	62.1	0	0	0	111.6	L169 L244 G249 M254 A255 I256	L169-L252 HydrophobicContact CD1-CB 3.86Å; L169-L252 HydrophobicContact CD2-CB 3.85Å; L169-L252 HydrophobicContact CD2-CD1 3.96Å; L169-L252 HydrophobicContact CD2-CG 4.46Å; L169-L252 HydrophobicContact CG-CB 4.46Å; L244-L252 HydrophobicContact CD1-CB 4.33Å; L244-L252 HydrophobicContact CD1-CD2 3.99Å; L244-L252 HydrophobicContact CD2-CD2 3.67Å; G249-L252 PolarHBondContact O-N 2.83Å; G249-L252 VanDerWaalsContact O-N 3.08Å; L252-M254 VanDerWaalsContact C-N 3.35Å; L252-M254 PolarHBondContact O-N 3.42Å; L252-A255 PolarHBondContact O-N 3.05Å; L252-I256 HydrophobicContact CD1-CD1 4Å; L252-I256 HydrophobicContact CD1-CG1 4.37Å; L252-I256 HydrophobicContact CG-CD1 4.03Å; L252-I256 WeakPolarHBondContact O-CG1 3.15Å; L252-I256 PolarHBondContact O-N 3.16Å
253	L	94.3	Very high	94.5	Very high	27 Å²	27	32 Å²	32	14%	0.141	17%	0.166	C	C	.	.	H	α-helix	trans	-55.8	-51.2	179.5	174.8	64.3	0	0	0	110.7	F228 M231 M232 G249 P250 I256 L257	F228-L253 HydrophobicContact CB-CD2 3.86Å; F228-L253 HydrophobicContact CD1-CD1 4.38Å; F228-L253 HydrophobicContact CD1-CD2 3.89Å; F228-L253 HydrophobicContact CD2-CD2 4.4Å; F228-L253 HydrophobicContact CE1-CD1 4.4Å; F228-L253 HydrophobicContact CG-CD2 3.81Å; M231-L253 HydrophobicContact CE-CD1 4.43Å; M232-L253 HydrophobicContact CE-CD2 4.25Å; M232-L253 HydrophobicContact SD-CD2 4.39Å; G249-L253 PolarHBondContact O-N 3.42Å; P250-L253 PolarHBondContact O-N 3.46Å; L253-I256 PolarHBondContact O-N 3.48Å; L253-L257 HydrophobicContact CD1-CD1 4.01Å; L253-L257 HydrophobicContact CD1-CG 4.31Å; L253-L257 HydrophobicContact CG-CD1 4.02Å; L253-L257 WeakPolarHBondContact O-CG 3.46Å; L253-L257 PolarHBondContact O-N 3.44Å
254	M	96.4	Very high	94.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.4	-38.2	-177.7	-68.1	-51.7	-46.2	0	0	112.4	L93 V96 E97 V100 N165 P250 L252 I256 L257 W258	L93-M254 HydrophobicContact CB-CE 4.37Å; V96-M254 HydrophobicContact CG1-SD 3.95Å; E97-M254 HydrophobicContact CB-CE 3.68Å; E97-M254 HydrophobicContact CB-CG 4.06Å; E97-M254 HydrophobicContact CB-SD 3.88Å; E97-M254 HydrophobicContact CG-CE 4.35Å; E97-M254 HydrophobicContact CG-CG 3.96Å; E97-M254 HydrophobicContact CG-SD 4.44Å; V100-M254 HydrophobicContact CG2-CG 4.39Å; V100-M254 HydrophobicContact CG2-SD 4.5Å; N165-M254 HydrophobicContact CB-CB 4.31Å; N165-M254 WeakPolarHBondContact OD1-CB 3.31Å; P250-M254 WeakPolarHBondContact O-CB 3.36Å; P250-M254 WeakPolarHBondContact O-CG 3.35Å; P250-M254 PolarHBondContact O-N 3.29Å; L252-M254 VanDerWaalsContact C-N 3.35Å; L252-M254 PolarHBondContact O-N 3.42Å; M254-I256 VanDerWaalsContact C-N 3.29Å; M254-I256 PolarHBondContact O-N 2.8Å; M254-L257 HydrophobicContact CE-CB 4.43Å; M254-L257 HydrophobicContact CE-CD1 4.42Å; M254-L257 PolarHBondContact O-N 3.4Å; M254-L257 HydrophobicContact SD-CD1 3.99Å; M254-W258 HydrophobicContact CE-CZ2 4.43Å; M254-W258 WeakPolarHBondContact O-CB 3.31Å; M254-W258 PolarHBondContact O-N 3.48Å
255	A	98.1	Very high	95	Very high	7 Å²	7	32.1 Å²	32.1	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-41.5	173.8	0	0	0	0	0	112	I162 N165 L166 G251 L252 L259	I162-A255 HydrophobicContact CG2-CB 4.47Å; N165-A255 HydrophobicContact CB-CB 4.18Å; L166-A255 HydrophobicContact CD2-CB 4.06Å; L166-A255 HydrophobicContact CG-CB 4.16Å; G251-A255 VanDerWaalsContact O-CB 3.24Å; G251-A255 WeakPolarHBondContact O-CB 3.42Å; G251-A255 PolarHBondContact O-N 3.3Å; L252-A255 PolarHBondContact O-N 3.05Å; A255-L259 VanDerWaalsContact O-CB 3.29Å; A255-L259 WeakPolarHBondContact O-CB 3.4Å; A255-L259 PolarHBondContact O-N 2.69Å
256	I	97.5	Very high	95.3	Very high	88 Å²	88	36.9 Å²	36.9	45%	0.451	18%	0.183	S	C	.	.	H	α-helix	trans	-66	-46.8	175.4	-67.3	168.2	0	0	0	110.9	L252 L253 M254 W258 L259 L260	L252-I256 HydrophobicContact CD1-CD1 4Å; L252-I256 HydrophobicContact CD1-CG1 4.37Å; L252-I256 HydrophobicContact CG-CD1 4.03Å; L252-I256 WeakPolarHBondContact O-CG1 3.15Å; L252-I256 PolarHBondContact O-N 3.16Å; L253-I256 PolarHBondContact O-N 3.48Å; M254-I256 VanDerWaalsContact C-N 3.29Å; M254-I256 PolarHBondContact O-N 2.8Å; I256-W258 PolarHBondContact O-N 3.4Å; I256-L259 WeakPolarHBondContact O-CB 3.4Å; I256-L259 PolarHBondContact O-N 3.01Å; I256-L260 HydrophobicContact CG2-CD1 4.19Å; I256-L260 WeakPolarHBondContact O-CG 3.39Å; I256-L260 PolarHBondContact O-N 3.29Å
257	L	96.7	Very high	95.5	Very high	37 Å²	37	41.2 Å²	41.2	19%	0.194	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-40.8	-179	-69.8	175.6	0	0	0	112.2	L93 L253 M254 L260 H261	L93-L257 HydrophobicContact CD1-CB 4.33Å; L93-L257 HydrophobicContact CD2-CB 3.79Å; L93-L257 HydrophobicContact CD2-CD1 3.88Å; L93-L257 HydrophobicContact CD2-CD2 4.4Å; L93-L257 HydrophobicContact CD2-CG 4.24Å; L253-L257 HydrophobicContact CD1-CD1 4.01Å; L253-L257 HydrophobicContact CD1-CG 4.31Å; L253-L257 HydrophobicContact CG-CD1 4.02Å; L253-L257 WeakPolarHBondContact O-CG 3.46Å; L253-L257 PolarHBondContact O-N 3.44Å; M254-L257 HydrophobicContact CE-CB 4.43Å; M254-L257 HydrophobicContact CE-CD1 4.42Å; M254-L257 PolarHBondContact O-N 3.4Å; M254-L257 HydrophobicContact SD-CD1 3.99Å; L257-L260 PolarHBondContact O-N 2.8Å; L257-H261 WeakPolarHBondContact O-CB 3.42Å; L257-H261 PolarHBondContact O-N 3.32Å
258	W	98.3	Very high	95.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-69.3	-33	174.9	-72.1	123.9	0	0	0	112.6	W90 L93 E97 N158 E161 I162 M254 I256 H261 S262	W90-W258 HydrophobicContact CD2-CH2 4.25Å; W90-W258 HydrophobicContact CD2-CZ3 4.12Å; W90-W258 AromaticContact CE3-CZ3 3.97Å; W90-W258 HydrophobicContact CE3-CZ3 3.97Å; W90-W258 HydrophobicContact CZ3-CZ3 4.21Å; L93-W258 HydrophobicContact CB-CE3 4.49Å; L93-W258 HydrophobicContact CB-CH2 3.71Å; L93-W258 HydrophobicContact CB-CZ2 3.86Å; L93-W258 HydrophobicContact CB-CZ3 4.05Å; L93-W258 HydrophobicContact CD1-CD2 4.34Å; L93-W258 HydrophobicContact CD1-CE3 3.95Å; L93-W258 HydrophobicContact CD1-CZ3 4.06Å; E97-W258 PolarHBondContact OE2-NE1 3.17Å; N158-W258 PolarHBondContact ND2-O 3.1Å; E161-W258 HydrophobicContact CB-CB 4.26Å; E161-W258 HydrophobicContact CB-CD2 3.89Å; E161-W258 HydrophobicContact CB-CG 3.69Å; E161-W258 HydrophobicContact CG-CD2 4.06Å; E161-W258 HydrophobicContact CG-CG 4.37Å; E161-W258 HydrophobicContact CG-CZ2 4.12Å; I162-W258 HydrophobicContact CD1-CB 4.45Å; I162-W258 HydrophobicContact CG1-CB 3.69Å; M254-W258 HydrophobicContact CE-CZ2 4.43Å; M254-W258 WeakPolarHBondContact O-CB 3.31Å; M254-W258 PolarHBondContact O-N 3.48Å; I256-W258 PolarHBondContact O-N 3.4Å; W258-H261 HydrophobicContact CE3-CB 4.14Å; W258-H261 AromaticContact CZ3-ND1 3.84Å; W258-H261 PolarHBondContact O-N 2.79Å; W258-S262 PolarHBondContact O-N 2.99Å; W258-S262 PolarHBondContact O-OG 3.32Å
259	L	98.4	Very high	95.4	Very high	85 Å²	85	39.5 Å²	39.5	45%	0.445	20%	0.196	S	C	.	.	H	α-helix	trans	-63.8	-46.1	170.7	-178.1	65.1	0	0	0	111.4	I162 A255 I256 H261 S262 F263	I162-L259 HydrophobicContact CD1-CB 4.09Å; I162-L259 HydrophobicContact CD1-CD1 4.21Å; A255-L259 VanDerWaalsContact O-CB 3.29Å; A255-L259 WeakPolarHBondContact O-CB 3.4Å; A255-L259 PolarHBondContact O-N 2.69Å; I256-L259 WeakPolarHBondContact O-CB 3.4Å; I256-L259 PolarHBondContact O-N 3.01Å; L259-H261 VanDerWaalsContact C-N 3.33Å; L259-H261 PolarHBondContact O-N 3.44Å; L259-S262 VanDerWaalsContact O-CB 3.28Å; L259-S262 WeakPolarHBondContact O-CB 3.45Å; L259-S262 PolarHBondContact O-N 3.31Å; L259-S262 VanDerWaalsContact O-N 3.12Å; L259-F263 HydrophobicContact CD1-CE2 4.21Å; L259-F263 HydrophobicContact CG-CE2 4.04Å; L259-F263 VanDerWaalsContact O-CD2 3.27Å; L259-F263 WeakPolarHBondContact O-CD2 3.36Å; L259-F263 PolarHBondContact O-N 2.68Å
260	L	98	Very high	95.2	Very high	96 Å²	96	40.1 Å²	40.1	50%	0.503	20%	0.199	S	C	.	.	H	α-helix	trans	-61.6	-41.6	174.2	-68	174.9	0	0	0	111.6	I256 L257 S262 F263 I264	I256-L260 HydrophobicContact CG2-CD1 4.19Å; I256-L260 WeakPolarHBondContact O-CG 3.39Å; I256-L260 PolarHBondContact O-N 3.29Å; L257-L260 PolarHBondContact O-N 2.8Å; L260-S262 PolarHBondContact O-N 3.37Å; L260-F263 WeakPolarHBondContact O-CB 3.16Å; L260-F263 PolarHBondContact O-N 2.87Å; L260-I264 PolarHBondContact O-N 3.12Å; L260-I264 VanDerWaalsContact O-N 3.08Å
261	H	97.9	Very high	94.9	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-34.6	174.5	-165.3	-110.8	0	0	0	112.2	T86 T89 W90 L93 N158 L257 W258 L259 F263 I264 I265	T86-H261 PolarHBondContact O-NE2 3.39Å; T89-H261 PolarHBondContact OG1-CD2 2.83Å; T89-H261 VanDerWaalsContact OG1-CD2 3.27Å; T89-H261 PolarHBondContact OG1-NE2 3.05Å; W90-H261 AromaticContact CE3-CE1 3.76Å; W90-H261 PolarHBondContact N-NE2 3.06Å; L93-H261 HydrophobicContact CD1-CB 3.65Å; N158-H261 PolarHBondContact ND2-ND1 3.39Å; N158-H261 PolarHBondContact OD1-ND1 3.29Å; L257-H261 WeakPolarHBondContact O-CB 3.42Å; L257-H261 PolarHBondContact O-N 3.32Å; W258-H261 HydrophobicContact CE3-CB 4.14Å; W258-H261 AromaticContact CZ3-ND1 3.84Å; W258-H261 PolarHBondContact O-N 2.79Å; L259-H261 VanDerWaalsContact C-N 3.33Å; L259-H261 PolarHBondContact O-N 3.44Å; H261-F263 VanDerWaalsContact C-N 3.33Å; H261-F263 PolarHBondContact O-N 3.42Å; H261-I264 WeakPolarHBondContact O-CB 3.48Å; H261-I264 PolarHBondContact O-N 3.02Å; H261-I264 VanDerWaalsContact O-N 3.14Å; H261-I265 WeakPolarHBondContact ND1-CD1 3.33Å; H261-I265 PolarHBondContact O-N 3.4Å
262	S	98.1	Very high	94.3	Very high	12 Å²	12	42 Å²	42	8%	0.084	21%	0.21	C	C	.	.	H	α-helix	trans	-64.3	-39.4	176.2	-56.7	0	0	0	0	111.3	N158 W258 L259 L260 I265 F266	N158-S262 WeakPolarHBondContact CB-OG 3.37Å; N158-S262 VanDerWaalsContact ND2-CA 3.29Å; N158-S262 WeakPolarHBondContact ND2-CA 3.16Å; N158-S262 PolarHBondContact ND2-N 3.41Å; N158-S262 PolarHBondContact ND2-OG 3.34Å; W258-S262 PolarHBondContact O-N 2.99Å; W258-S262 PolarHBondContact O-OG 3.32Å; L259-S262 VanDerWaalsContact O-CB 3.28Å; L259-S262 WeakPolarHBondContact O-CB 3.45Å; L259-S262 PolarHBondContact O-N 3.31Å; L259-S262 VanDerWaalsContact O-N 3.12Å; L260-S262 PolarHBondContact O-N 3.37Å; S262-I265 PolarHBondContact O-N 2.79Å; S262-F266 VanDerWaalsContact O-CB 3.24Å; S262-F266 WeakPolarHBondContact O-CB 3.42Å; S262-F266 PolarHBondContact O-N 2.69Å
263	F	97.3	Very high	93.7	Very high	103 Å²	103	41.4 Å²	41.4	45%	0.452	21%	0.207	S	C	.	.	H	α-helix	trans	-64	-40.7	171.5	-70.8	-65.2	0	0	0	112	L259 L260 H261 I265 F266 F267	L259-F263 HydrophobicContact CD1-CE2 4.21Å; L259-F263 HydrophobicContact CG-CE2 4.04Å; L259-F263 VanDerWaalsContact O-CD2 3.27Å; L259-F263 WeakPolarHBondContact O-CD2 3.36Å; L259-F263 PolarHBondContact O-N 2.68Å; L260-F263 WeakPolarHBondContact O-CB 3.16Å; L260-F263 PolarHBondContact O-N 2.87Å; H261-F263 VanDerWaalsContact C-N 3.33Å; H261-F263 PolarHBondContact O-N 3.42Å; F263-I265 PolarHBondContact O-N 2.8Å; F263-F266 PolarHBondContact O-N 3.36Å; F263-F267 HydrophobicContact CB-CD2 4.24Å; F263-F267 HydrophobicContact CB-CE2 4.23Å; F263-F267 AromaticContact CD1-CE2 3.82Å; F263-F267 HydrophobicContact CD1-CE2 3.82Å; F263-F267 HydrophobicContact CG-CE2 4.46Å; F263-F267 WeakPolarHBondContact O-CB 3.47Å; F263-F267 WeakPolarHBondContact O-CD2 3.33Å; F263-F267 PolarHBondContact O-N 3.47Å
264	I	95	Very high	92.7	Very high	49 Å²	49	45.1 Å²	45.1	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-58.2	-48.8	174.5	-65.8	171.6	0	0	0	110.5	F85 L260 H261 S268	F85-I264 HydrophobicContact CD1-CG2 4.12Å; F85-I264 HydrophobicContact CE1-CD1 4.38Å; F85-I264 HydrophobicContact CE1-CG2 3.81Å; L260-I264 PolarHBondContact O-N 3.12Å; L260-I264 VanDerWaalsContact O-N 3.08Å; H261-I264 WeakPolarHBondContact O-CB 3.48Å; H261-I264 PolarHBondContact O-N 3.02Å; H261-I264 VanDerWaalsContact O-N 3.14Å; I264-S268 WeakPolarHBondContact O-CA 3.32Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3.38Å; I264-S268 PolarHBondContact O-OG 3.41Å
265	I	95.7	Very high	91.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-47.2	178.5	-68.8	155.4	0	0	0	111	T86 K151 L154 M155 N158 H261 S262 F263 F267 Y269	T86-I265 HydrophobicContact CG2-CD1 4.41Å; T86-I265 HydrophobicContact CG2-CG1 3.53Å; K151-I265 VanDerWaalsContact CE-O 3.32Å; K151-I265 WeakPolarHBondContact CE-O 3.25Å; K151-I265 HydrophobicContact CG-CG2 4.12Å; L154-I265 HydrophobicContact CB-CD1 3.94Å; L154-I265 HydrophobicContact CB-CG2 4.2Å; M155-I265 HydrophobicContact CG-CG2 3.89Å; M155-I265 HydrophobicContact SD-CB 3.86Å; M155-I265 HydrophobicContact SD-CG2 3.61Å; N158-I265 WeakPolarHBondContact ND2-CD1 3.13Å; H261-I265 WeakPolarHBondContact ND1-CD1 3.33Å; H261-I265 PolarHBondContact O-N 3.4Å; S262-I265 PolarHBondContact O-N 2.79Å; F263-I265 PolarHBondContact O-N 2.8Å; I265-F267 PolarHBondContact O-N 3.11Å; I265-Y269 VanDerWaalsContact O-CB 3.23Å; I265-Y269 WeakPolarHBondContact O-CB 3.32Å; I265-Y269 PolarHBondContact O-N 3.24Å
266	F	94.2	Very high	90.5	Very high	120 Å²	120	51.8 Å²	51.8	53%	0.526	26%	0.263	S	S	.	.	H	α-helix	trans	-58.3	-49.5	-176.7	-177.7	-98.5	0	0	0	111.3	K151 M155 S262 F263	K151-F266 WeakPolarHBondContact CE-O 3.35Å; K151-F266 PolarHBondContact NZ-O 3.42Å; M155-F266 HydrophobicContact SD-CB 4.34Å; S262-F266 VanDerWaalsContact O-CB 3.24Å; S262-F266 WeakPolarHBondContact O-CB 3.42Å; S262-F266 PolarHBondContact O-N 2.69Å; F263-F266 PolarHBondContact O-N 3.36Å
267	F	91.8	Very high	89.5	Confident	122 Å²	122	55.8 Å²	55.8	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-78	-46.5	-179.3	-66.8	-59.6	0	0	0	112.3	Q74 F263 I265	Q74-F267 PolarHBondContact NE2-O 3.3Å; F263-F267 HydrophobicContact CB-CD2 4.24Å; F263-F267 HydrophobicContact CB-CE2 4.23Å; F263-F267 AromaticContact CD1-CE2 3.82Å; F263-F267 HydrophobicContact CD1-CE2 3.82Å; F263-F267 HydrophobicContact CG-CE2 4.46Å; F263-F267 WeakPolarHBondContact O-CB 3.47Å; F263-F267 WeakPolarHBondContact O-CD2 3.33Å; F263-F267 PolarHBondContact O-N 3.47Å; I265-F267 PolarHBondContact O-N 3.11Å
268	S	88.4	Confident	88.6	Confident	19 Å²	19	56.1 Å²	56.1	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-98.9	-27.3	-164.4	-55.9	0	0	0	0	115.5	W82 I264 P270	W82-S268 WeakPolarHBondContact CB-O 3.31Å; W82-S268 WeakPolarHBondContact CZ3-OG 3.41Å; I264-S268 WeakPolarHBondContact O-CA 3.32Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3.38Å; I264-S268 PolarHBondContact O-OG 3.41Å; S268-P270 WeakPolarHBondContact O-CD 3.08Å
269	Y	91.8	Very high	87.7	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.016	29%	0.293	C	S	.	.			trans	-75.1	123.1	-174.8	-157.9	-88.1	0	0	0	110.7	M83 T86 V150 K151 L154 L194 D197 I265	M83-Y269 HydrophobicContact CB-CE2 4.37Å; M83-Y269 HydrophobicContact CG-CE2 4.24Å; T86-Y269 HydrophobicContact CG2-CD2 3.71Å; T86-Y269 HydrophobicContact CG2-CE2 4.19Å; V150-Y269 HydrophobicContact CB-CE1 4.35Å; V150-Y269 HydrophobicContact CG1-CE1 4.29Å; V150-Y269 WeakPolarHBondContact CG1-OH 3.45Å; K151-Y269 HydrophobicContact CB-CD1 3.84Å; K151-Y269 HydrophobicContact CB-CE1 4.41Å; K151-Y269 WeakPolarHBondContact CD-O 3.38Å; K151-Y269 WeakPolarHBondContact CE-O 3.41Å; K151-Y269 HydrophobicContact CG-CD1 4.2Å; K151-Y269 PolarHBondContact NZ-O 3.27Å; L154-Y269 HydrophobicContact CD1-CD1 4.49Å; L154-Y269 HydrophobicContact CD1-CD2 3.98Å; L154-Y269 HydrophobicContact CD1-CE1 4.26Å; L154-Y269 HydrophobicContact CD1-CE2 3.7Å; L154-Y269 HydrophobicContact CD1-CG 4.35Å; L194-Y269 HydrophobicContact CD1-CE2 4.06Å; D197-Y269 PolarHBondContact OD2-OH 3.08Å; I265-Y269 VanDerWaalsContact O-CB 3.23Å; I265-Y269 WeakPolarHBondContact O-CB 3.32Å; I265-Y269 PolarHBondContact O-N 3.24Å
270	P	88.2	Confident	86.5	Confident	13 Å²	13	62.7 Å²	62.7	8%	0.084	30%	0.3	C	S	.	.			trans	-69.9	147.9	-179.7	29.2	-35.4	0	0	0	111.5	N79 M83 S268 V272	N79-P270 HydrophobicContact CB-CB 4.22Å; N79-P270 HydrophobicContact CB-CG 4.06Å; M83-P270 HydrophobicContact CE-CG 3.65Å; M83-P270 HydrophobicContact CG-CG 3.84Å; M83-P270 HydrophobicContact SD-CG 4.48Å; S268-P270 WeakPolarHBondContact O-CD 3.08Å; P270-V272 HydrophobicContact CB-CG2 4.02Å; P270-V272 HydrophobicContact CG-CG2 4.01Å; P270-V272 PolarHBondContact O-N 2.85Å
271	N	86	Confident	84.8	Confident	29 Å²	29	62.4 Å²	62.4	16%	0.155	30%	0.299	C	S	.	.			trans	-79.3	114.9	168.4	-72.5	-51	0	0	0	108.5	K151 V278 I279	K151-N271 WeakPolarHBondContact CD-OD1 3.17Å; N271-V278 CarbonylContact O-C 3.54Å; N271-V278 WeakPolarHBondContact O-CA 3.1Å; N271-I279 HydrophobicContact CB-CB 4.39Å; N271-I279 PolarHBondContact O-N 3.02Å
272	V	84.2	Confident	82.7	Confident	11 Å²	11	70 Å²	70	7%	0.067	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-121	139.3	-176.7	176.9	0	0	0	0	110.6	M83 P270 G276 R277 V278	M83-V272 HydrophobicContact CE-CB 3.93Å; M83-V272 HydrophobicContact CE-CG1 4.14Å; M83-V272 HydrophobicContact CE-CG2 3.17Å; P270-V272 HydrophobicContact CB-CG2 4.02Å; P270-V272 HydrophobicContact CG-CG2 4.01Å; P270-V272 PolarHBondContact O-N 2.85Å; V272-G276 VanDerWaalsContact CG1-C 3.4Å; V272-R277 CarbonylContact C-O 3.54Å; V272-R277 WeakPolarHBondContact CA-O 3.4Å; V272-V278 HydrophobicContact CG2-CG2 4.21Å
273	D	80.6	Confident	80.5	Confident	45 Å²	45	73.2 Å²	73.2	24%	0.241	38%	0.375	C	S	.	.			trans	-82.5	175.4	174.2	78.5	2.6	0	0	0	111.7	N275 G276 R277 I279	D273-N275 PolarHBondContact O-N 3.07Å; D273-N275 WeakPolarHBondContact OD1-CA 3.3Å; D273-N275 WeakPolarHBondContact OD1-CB 3.49Å; D273-N275 PolarHBondContact OD1-N 3.5Å; D273-G276 PolarHBondContact O-N 2.91Å; D273-G276 PolarHBondContact OD1-N 3.42Å; D273-G276 VanDerWaalsContact OD1-N 3.09Å; D273-R277 PolarHBondContact N-O 3.36Å; D273-R277 WeakPolarHBondContact OD1-CB 3.4Å; D273-R277 PolarHBondContact OD1-N 3.25Å; D273-I279 HydrophobicContact CB-CD1 3.91Å; D273-I279 HydrophobicContact CB-CG1 4.09Å
274	K	74.8	Confident	78	Confident	106 Å²	106	73.1 Å²	73.1	46%	0.461	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19.5	-180	-64.7	-170.4	-178.2	-177.9	0	114.1	Y145 R200	Y145-K274 PolarHBondContact O-NZ 3.39Å; R200-K274 WeakPolarHBondContact CD-O 2.99Å; R200-K274 PolarHBondContact NE-O 2.87Å
275	N	73.5	Confident	75.5	Confident	120 Å²	120	80 Å²	80	64%	0.642	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	2.2	-179.4	-60.7	-30	0	0	0	112.3	D273 R277	D273-N275 PolarHBondContact O-N 3.07Å; D273-N275 WeakPolarHBondContact OD1-CA 3.3Å; D273-N275 WeakPolarHBondContact OD1-CB 3.49Å; D273-N275 PolarHBondContact OD1-N 3.5Å; N275-R277 VanDerWaalsContact C-N 3.31Å; N275-R277 HydrophobicContact CB-CG 4.28Å
276	G	74.3	Confident	73.1	Confident	26 Å²	26	82.2 Å²	82.2	27%	0.268	41%	0.414	S	S	.	.	S	Bend	trans	82.3	5.5	-175.7	0	0	0	0	0	114	V272 D273	V272-G276 VanDerWaalsContact CG1-C 3.4Å; D273-G276 PolarHBondContact O-N 2.91Å; D273-G276 PolarHBondContact OD1-N 3.42Å; D273-G276 VanDerWaalsContact OD1-N 3.09Å
277	R	76.3	Confident	70.8	Confident	173 Å²	173	83.3 Å²	83.3	65%	0.653	44%	0.435	S	S	*	.			trans	-82.8	140.9	179.2	-56.2	179.2	177.6	-179	-0.3	110.5	V272 D273 N275	V272-R277 CarbonylContact C-O 3.54Å; V272-R277 WeakPolarHBondContact CA-O 3.4Å; D273-R277 PolarHBondContact N-O 3.36Å; D273-R277 WeakPolarHBondContact OD1-CB 3.4Å; D273-R277 PolarHBondContact OD1-N 3.25Å; N275-R277 VanDerWaalsContact C-N 3.31Å; N275-R277 HydrophobicContact CB-CG 4.28Å
278	V	78.7	Confident	68.4	Low	43 Å²	43	80.8 Å²	80.8	26%	0.261	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-81.1	124.1	-179.7	178.5	0	0	0	0	109.1	N79 N271 V272 Y280	N79-V278 HydrophobicContact CB-CG2 4.26Å; N79-V278 WeakPolarHBondContact ND2-CG2 3.29Å; N271-V278 CarbonylContact O-C 3.54Å; N271-V278 WeakPolarHBondContact O-CA 3.1Å; V272-V278 HydrophobicContact CG2-CG2 4.21Å; V278-Y280 HydrophobicContact CB-CE2 4.36Å; V278-Y280 HydrophobicContact CG1-CE1 4.11Å; V278-Y280 HydrophobicContact CG1-CE2 4.18Å
279	I	78.1	Confident	66	Low	70 Å²	70	84.2 Å²	84.2	36%	0.359	45%	0.449	S	S	.	.			trans	-89	113.6	176.8	-55.7	172.2	0	0	0	108.3	N271 D273	N271-I279 HydrophobicContact CB-CB 4.39Å; N271-I279 PolarHBondContact O-N 3.02Å; D273-I279 HydrophobicContact CB-CD1 3.91Å; D273-I279 HydrophobicContact CB-CG1 4.09Å
280	Y	74.2	Confident	63.2	Low	153 Å²	153	94.7 Å²	94.7	60%	0.6	49%	0.488	S	S	*	.			trans	-87.9	126.7	168.1	-58.9	-80.2	0	0	0	109	V278	V278-Y280 HydrophobicContact CB-CE2 4.36Å; V278-Y280 HydrophobicContact CG1-CE1 4.11Å; V278-Y280 HydrophobicContact CG1-CE2 4.18Å
281	N	62.7	Low	60.8	Low	91 Å²	91	99.7 Å²	99.7	49%	0.487	51%	0.514	S	S	.	.			trans	-67.7	141.3	167.1	-77.8	-8.9	0	0	0	108.3	G283 Q284	N281-G283 PolarHBondContact O-N 3.48Å; N281-Q284 PolarHBondContact O-N 3.44Å
282	N	52.3	Low	58.4	Low	161 Å²	161	104.9 Å²	104.9	86%	0.861	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-16	-178.8	-77	-16.2	0	0	0	115.1
283	G	51.7	Low	55.7	Low	79 Å²	79	115.3 Å²	115.3	81%	0.814	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-3.5	173	0	0	0	0	0	116	N281	N281-G283 PolarHBondContact O-N 3.48Å
284	Q	45.5	Very low	53.3	Low	102 Å²	102	120.5 Å²	120.5	48%	0.477	61%	0.606	S	S	.	*			trans	-110.8	32.6	175.2	-75.3	-179.9	-45.8	0	0	111.4	N281 S286	N281-Q284 PolarHBondContact O-N 3.44Å; Q284-S286 PolarHBondContact O-N 3.46Å
285	R	42.8	Very low	51	Low	192 Å²	192	124.6 Å²	124.6	73%	0.725	63%	0.627	S	S	*	*			trans	-55.4	100.2	154.1	-82.8	-175.4	176.7	175.3	-1.5	106.2	C287	R285-C287 PolarHBondContact O-N 2.8Å
286	S	44.2	Very low	49	Very low	48 Å²	48	123.1 Å²	123.1	34%	0.336	63%	0.626	S	S	.	*			trans	-52.3	139.7	177	-179.9	0	0	0	0	107	Q284 C288 D289	Q284-S286 PolarHBondContact O-N 3.46Å; S286-C288 PolarHBondContact O-N 2.89Å; S286-C288 PolarHBondContact OG-N 3.1Å; S286-D289 PolarHBondContact O-N 2.86Å
287	C	46.9	Very low	46.8	Very low	142 Å²	142	128.2 Å²	128.2	96%	0.959	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-6.6	168.9	-42.8	0	0	0	0	112.4	R285	R285-C287 PolarHBondContact O-N 2.8Å
288	C	42.2	Very low	44.7	Very low	70 Å²	70	128.2 Å²	128.2	47%	0.473	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.7	31.3	177.8	-43.3	0	0	0	0	112.8	S286 R290	S286-C288 PolarHBondContact O-N 2.89Å; S286-C288 PolarHBondContact OG-N 3.1Å; C288-R290 PolarHBondContact O-N 3.24Å
289	D	36	Very low	42.4	Very low	91 Å²	91	134.6 Å²	134.6	49%	0.487	68%	0.682	S	S	.	*			trans	-67.2	102.7	166.3	-117.1	-20.7	0	0	0	108.9	S286 D291	S286-D289 PolarHBondContact O-N 2.86Å; D289-D291 PolarHBondContact O-N 3.42Å
290	R	33.4	Very low	40.4	Very low	223 Å²	223	134.6 Å²	134.6	84%	0.842	69%	0.692	S	S	*	*			trans	-93.7	60	166.3	-158.1	-177.4	-153.3	-149.5	4.1	107.3	C288 N292	C288-R290 PolarHBondContact O-N 3.24Å; R290-N292 PolarHBondContact O-N 3.11Å
291	D	38.9	Very low	38.4	Very low	119 Å²	119	135.7 Å²	135.7	64%	0.636	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	91.8	160.3	-83.4	-28.4	0	0	0	106.8	D289	D289-D291 PolarHBondContact O-N 3.42Å
292	N	34.5	Very low	37	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.8	23.8	154.4	-92.1	-10.5	0	0	0	115.5	R290	R290-N292 PolarHBondContact O-N 3.11Å
293	W	27.2	Very low	36.1	Very low	230 Å²	230	138.8 Å²	138.8	87%	0.871	71%	0.712	S	S	*	*	S	Bend	trans	-132.1	13.5	170.6	-110.9	76.6	0	0	0	116.6
294	I	31.3	Very low	35.3	Very low	153 Å²	153	140.1 Å²	140.1	79%	0.785	71%	0.708	S	S	*	*			trans	-122.5	60.8	161.8	-49	179.4	0	0	0	107.9	S296	I294-S296 VanDerWaalsContact CG2-OG 3.32Å; I294-S296 WeakPolarHBondContact CG2-OG 3.23Å; I294-S296 PolarHBondContact O-N 2.92Å
295	Q	25.7	Very low	34.4	Very low	193 Å²	193	145 Å²	145	90%	0.902	72%	0.722	S	S	*	*			trans	-81.7	82.8	142	-87.3	-178.5	-8.8	0	0	105.9
296	S	31.7	Very low	33.7	Very low	88 Å²	88	141 Å²	141	62%	0.615	72%	0.721	S	S	*	*			trans	-120.6	97.2	160.4	58.7	0	0	0	0	107.1	I294	I294-S296 VanDerWaalsContact CG2-OG 3.32Å; I294-S296 WeakPolarHBondContact CG2-OG 3.23Å; I294-S296 PolarHBondContact O-N 2.92Å
297	N	28.4	Very low	33	Very low	133 Å²	133	147.7 Å²	147.7	71%	0.711	75%	0.75	S	S	*	*			trans	47.4	99.1	161.2	-69.8	-10.8	0	0	0	117.5	Q299	N297-Q299 PolarHBondContact O-N 3.48Å
298	E	32.3	Very low	32.1	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.813	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-59.9	5.4	156.3	-80.9	-176.7	134.3	0	0	114.2
299	Q	30.6	Very low	31.5	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.822	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-86.4	-8.4	178.3	-121.3	80.9	24.4	0	0	115.4	N297	N297-Q299 PolarHBondContact O-N 3.48Å
300	A	35	Very low	31.1	Very low	70 Å²	70	153.3 Å²	153.3	58%	0.579	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-93.9	14.6	177.5	0	0	0	0	0	114
301	K	33.2	Very low	31.1	Very low	176 Å²	176	148.3 Å²	148.3	77%	0.765	77%	0.772	S	S	*	*			trans	-96.5	15.1	-170.7	-111	-178.2	-174.4	174.3	0	116.3
302	E	32.1	Very low	30.7	Very low	159 Å²	159	148.2 Å²	148.2	74%	0.743	78%	0.776	S	S	*	*	S	Bend	trans	-97.5	-21.8	171	-97.9	177.1	157.9	0	0	115.4	S304	E302-S304 PolarHBondContact O-N 3.27Å
303	D	34.5	Very low	30.5	Very low	159 Å²	159	148.6 Å²	148.6	85%	0.85	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	26.9	-174.6	-77.8	-20.6	0	0	0	115.5
304	S	34.1	Very low	30.7	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	32.6	169.8	-55.4	0	0	0	0	112.9	E302	E302-S304 PolarHBondContact O-N 3.27Å
305	R	27.6	Very low	31.2	Very low	204 Å²	204	143.7 Å²	143.7	77%	0.77	78%	0.778	S	S	*	*	S	Bend	trans	-74	131.3	153.7	-71.4	-174.5	-179	-171.8	3.2	107.7	M307	R305-M307 PolarHBondContact O-N 3.49Å
306	P	28.3	Very low	31.6	Very low	107 Å²	107	142.1 Å²	142.1	70%	0.695	78%	0.775	S	S	*	*			trans	-55.6	131.3	171.2	22.4	-30.3	0	0	0	108.6	L308	P306-L308 PolarHBondContact O-N 2.93Å
307	M	30	Very low	31.9	Very low	190 Å²	190	143.7 Å²	143.7	94%	0.936	79%	0.786	S	S	*	*	S	Bend	trans	-64.8	29.4	174.1	-81.9	-169.4	72.3	0	0	113.9	R305	R305-M307 PolarHBondContact O-N 3.49Å
308	L	26.8	Very low	32.7	Very low	163 Å²	163	140.3 Å²	140.3	85%	0.853	78%	0.783	S	S	*	*			trans	-128.6	70.8	163.1	-95.8	97.4	0	0	0	108	P306	P306-L308 PolarHBondContact O-N 2.93Å
309	S	29	Very low	33.1	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	79%	0.785	S	S	*	*			trans	-82.3	125	149.8	55.6	0	0	0	0	107.6	S311	S309-S311 PolarHBondContact O-N 2.95Å
310	D	28.6	Very low	33.5	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	78%	0.782	S	S	*	*			trans	-36.9	98.1	176.8	-66.5	-48.7	0	0	0	113.5	T312	D310-T312 PolarHBondContact O-N 3.43Å; D310-T312 VanDerWaalsContact O-N 3.15Å
311	S	33.6	Very low	34.1	Very low	117 Å²	117	143.1 Å²	143.1	82%	0.818	78%	0.781	S	S	*	*			trans	-77.9	86.6	144.7	-60.9	0	0	0	0	106.1	S309 D313	S309-S311 PolarHBondContact O-N 2.95Å; S311-D313 PolarHBondContact O-N 3.2Å
312	T	31	Very low	34.7	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	77%	0.773	S	S	*	*			trans	-53.9	95.7	154.2	-54.6	0	0	0	0	106	D310	D310-T312 PolarHBondContact O-N 3.43Å; D310-T312 VanDerWaalsContact O-N 3.15Å
313	D	30.7	Very low	35.5	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	76%	0.758	S	S	*	*			trans	-168	126.9	150.9	-94.8	-25.6	0	0	0	112.7	S311	S311-D313 PolarHBondContact O-N 3.2Å
314	S	31.1	Very low	36.4	Very low	105 Å²	105	130.7 Å²	130.7	73%	0.734	74%	0.742	S	S	*	*			trans	73.5	98.1	159.2	71.1	0	0	0	0	118.5	N316	S314-N316 PolarHBondContact O-N 3.4Å
315	L	41.5	Very low	37.3	Very low	176 Å²	176	129.9 Å²	129.9	92%	0.921	73%	0.728	S	S	*	*			trans	-25	102.5	138.8	-70.7	147.8	0	0	0	112.5
316	N	32.9	Very low	39	Very low	160 Å²	160	125.1 Å²	125.1	86%	0.856	72%	0.718	S	S	*	*			trans	-156.6	105.2	150.3	-100.9	-25.7	0	0	0	111.5	S314	S314-N316 PolarHBondContact O-N 3.4Å
317	S	38	Very low	40.9	Very low	121 Å²	121	125 Å²	125	85%	0.846	71%	0.712	S	S	*	*			trans	-64.1	138.6	-174.3	48	0	0	0	0	115.4
318	G	45.9	Very low	43	Very low	62 Å²	62	118 Å²	118	64%	0.639	68%	0.681	S	S	*	*	S	Bend	trans	108.3	-35.5	141.1	0	0	0	0	0	119.2
319	R	40.2	Very low	45.6	Very low	228 Å²	228	113.4 Å²	113.4	86%	0.86	66%	0.657	S	S	*	*	S	Bend	trans	-93.8	-27.4	-175.5	-84.7	-174	-166.8	173.7	5.7	115.6
320	F	39.1	Very low	48.3	Very low	170 Å²	170	117.1 Å²	117.1	75%	0.746	66%	0.655	S	S	*	*	H	α-helix	trans	-73.9	-34.3	-174.5	-133.4	-92.1	0	0	0	112.6	T322 A323 V324	F320-T322 PolarHBondContact O-N 2.96Å; F320-A323 PolarHBondContact O-N 2.99Å; F320-V324 HydrophobicContact CD1-CG2 3.84Å; F320-V324 HydrophobicContact CE1-CG2 4.15Å; F320-V324 WeakPolarHBondContact O-CG2 3.36Å; F320-V324 PolarHBondContact O-N 3.38Å
321	S	47	Very low	51.1	Low	80 Å²	80	115.5 Å²	115.5	56%	0.559	64%	0.642	S	S	*	*	H	α-helix	trans	-63.5	-40.1	-179.7	-166.5	0	0	0	0	112.4	I325	S321-I325 WeakPolarHBondContact O-CB 3.4Å; S321-I325 WeakPolarHBondContact O-CD1 3.47Å; S321-I325 WeakPolarHBondContact O-CG1 3.39Å; S321-I325 PolarHBondContact O-N 3.46Å
322	T	47	Very low	53.8	Low	97 Å²	97	110.3 Å²	110.3	60%	0.595	61%	0.605	S	S	*	*	H	α-helix	trans	-69.2	-39.5	-179.9	-34.7	0	0	0	0	111.7	F320 N326	F320-T322 PolarHBondContact O-N 2.96Å; T322-N326 VanDerWaalsContact O-CB 3.26Å; T322-N326 WeakPolarHBondContact O-CB 3.24Å; T322-N326 PolarHBondContact O-N 3.08Å
323	A	48	Very low	56.7	Low	53 Å²	53	110 Å²	110	44%	0.438	60%	0.598	S	S	.	*	H	α-helix	trans	-66.8	-41.5	178.1	0	0	0	0	0	112.3	F320 N326 N327	F320-A323 PolarHBondContact O-N 2.99Å; A323-N326 PolarHBondContact O-N 3.36Å; A323-N327 PolarHBondContact O-N 3.43Å; A323-N327 VanDerWaalsContact O-N 3.07Å
324	V	53.2	Low	59.7	Low	84 Å²	84	105.2 Å²	105.2	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-67.6	-43	177	175.1	0	0	0	0	111.3	F320 N326 N327 S328	F320-V324 HydrophobicContact CD1-CG2 3.84Å; F320-V324 HydrophobicContact CE1-CG2 4.15Å; F320-V324 WeakPolarHBondContact O-CG2 3.36Å; F320-V324 PolarHBondContact O-N 3.38Å; V324-N326 VanDerWaalsContact C-N 3.32Å; V324-N326 PolarHBondContact O-N 2.98Å; V324-N327 PolarHBondContact O-N 3.03Å; V324-S328 PolarHBondContact O-N 2.92Å; V324-S328 VanDerWaalsContact O-N 3.15Å
325	I	54.7	Low	62.7	Low	90 Å²	90	103 Å²	103	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-59.3	-45.1	173.7	-68.7	165.2	0	0	0	110.3	S321 N327 S328 L329	S321-I325 WeakPolarHBondContact O-CB 3.4Å; S321-I325 WeakPolarHBondContact O-CD1 3.47Å; S321-I325 WeakPolarHBondContact O-CG1 3.39Å; S321-I325 PolarHBondContact O-N 3.46Å; I325-N327 PolarHBondContact O-N 3.22Å; I325-S328 PolarHBondContact O-N 2.87Å; I325-S328 PolarHBondContact O-OG 3.01Å; I325-L329 HydrophobicContact CG2-CD1 3.91Å; I325-L329 HydrophobicContact CG2-CG 4.46Å; I325-L329 PolarHBondContact O-N 3.33Å; I325-L329 VanDerWaalsContact O-N 3.09Å
326	N	62.4	Low	65.2	Low	103 Å²	103	96.3 Å²	96.3	55%	0.551	52%	0.518	S	S	*	.	H	α-helix	trans	-60.9	-42.1	-179.2	-164	10.4	0	0	0	112.2	T322 A323 V324 S328 L329 R330	T322-N326 VanDerWaalsContact O-CB 3.26Å; T322-N326 WeakPolarHBondContact O-CB 3.24Å; T322-N326 PolarHBondContact O-N 3.08Å; A323-N326 PolarHBondContact O-N 3.36Å; V324-N326 VanDerWaalsContact C-N 3.32Å; V324-N326 PolarHBondContact O-N 2.98Å; N326-S328 PolarHBondContact O-N 3.41Å; N326-L329 PolarHBondContact O-N 3.5Å; N326-R330 PolarHBondContact O-N 3.22Å; N326-R330 VanDerWaalsContact O-N 3.15Å
327	N	69.1	Low	68.2	Low	106 Å²	106	88.9 Å²	88.9	57%	0.567	48%	0.478	S	S	*	.	H	α-helix	trans	-66.3	-37.4	176.4	-80.7	-13.4	0	0	0	112.9	A323 V324 I325 R330	A323-N327 PolarHBondContact O-N 3.43Å; A323-N327 VanDerWaalsContact O-N 3.07Å; V324-N327 PolarHBondContact O-N 3.03Å; I325-N327 PolarHBondContact O-N 3.22Å; N327-R330 WeakPolarHBondContact O-CB 3.35Å; N327-R330 PolarHBondContact O-N 3.46Å
328	S	73.3	Confident	71	Confident	42 Å²	42	86.4 Å²	86.4	29%	0.294	46%	0.455	S	S	.	.	H	α-helix	trans	-65	-40.5	176.9	75.8	0	0	0	0	112.1	V324 I325 N326 R330 R470	V324-S328 PolarHBondContact O-N 2.92Å; V324-S328 VanDerWaalsContact O-N 3.15Å; I325-S328 PolarHBondContact O-N 2.87Å; I325-S328 PolarHBondContact O-OG 3.01Å; N326-S328 PolarHBondContact O-N 3.41Å; S328-R330 VanDerWaalsContact C-N 3.33Å; S328-R330 PolarHBondContact O-N 3.47Å; S328-R470 PolarHBondContact OG-NH1 3.05Å
329	L	81.4	Confident	73.5	Confident	66 Å²	66	83.5 Å²	83.5	35%	0.346	43%	0.425	S	S	.	.	H	α-helix	trans	-76.2	-19.6	-177.7	-68.5	176.3	0	0	0	113.7	I325 N326 H331 Y332 L333	I325-L329 HydrophobicContact CG2-CD1 3.91Å; I325-L329 HydrophobicContact CG2-CG 4.46Å; I325-L329 PolarHBondContact O-N 3.33Å; I325-L329 VanDerWaalsContact O-N 3.09Å; N326-L329 PolarHBondContact O-N 3.5Å; L329-H331 PolarHBondContact O-N 3.18Å; L329-H331 VanDerWaalsContact O-N 3.15Å; L329-Y332 HydrophobicContact CD2-CD2 4.17Å; L329-Y332 PolarHBondContact O-N 3.1Å; L329-L333 PolarHBondContact O-N 3.43Å
330	R	85.8	Confident	76.2	Confident	184 Å²	184	72.7 Å²	72.7	69%	0.694	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-54.4	-35.5	-178.5	-168.8	177.4	-179.5	-158.8	-0.6	113.5	N326 N327 S328 Y332 L333 S334	N326-R330 PolarHBondContact O-N 3.22Å; N326-R330 VanDerWaalsContact O-N 3.15Å; N327-R330 WeakPolarHBondContact O-CB 3.35Å; N327-R330 PolarHBondContact O-N 3.46Å; S328-R330 VanDerWaalsContact C-N 3.33Å; S328-R330 PolarHBondContact O-N 3.47Å; R330-Y332 VanDerWaalsContact C-N 3.31Å; R330-Y332 PolarHBondContact O-N 3.26Å; R330-L333 CarbonylContact O-C 3.59Å; R330-L333 PolarHBondContact O-N 3.41Å; R330-L333 VanDerWaalsContact O-N 3.14Å; R330-S334 PolarHBondContact O-N 3.39Å
331	H	86.5	Confident	79	Confident	118 Å²	118	65.9 Å²	65.9	55%	0.546	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-62.7	-37.6	178	-61.1	90.2	0	0	0	112.3	L329 L333 S334	L329-H331 PolarHBondContact O-N 3.18Å; L329-H331 VanDerWaalsContact O-N 3.15Å; H331-L333 VanDerWaalsContact C-N 3.26Å; H331-L333 PolarHBondContact O-N 3.36Å; H331-S334 WeakPolarHBondContact O-CB 3.46Å; H331-S334 PolarHBondContact O-N 3.22Å; H331-S334 PolarHBondContact O-OG 3.34Å
332	Y	91.5	Very high	81.5	Confident	9 Å²	9	63.7 Å²	63.7	4%	0.035	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-77	-13.1	177.8	-55.7	-69.5	0	0	0	113.3	L329 R330 I337 P464 D467 R470 A471 I474	L329-Y332 HydrophobicContact CD2-CD2 4.17Å; L329-Y332 PolarHBondContact O-N 3.1Å; R330-Y332 VanDerWaalsContact C-N 3.31Å; R330-Y332 PolarHBondContact O-N 3.26Å; Y332-I337 WeakPolarHBondContact O-CG2 3.43Å; Y332-P464 HydrophobicContact CE1-CG 4.34Å; Y332-D467 WeakPolarHBondContact OH-CB 3.47Å; Y332-D467 VanDerWaalsContact OH-CG 3.28Å; Y332-D467 PolarHBondContact OH-O 2.97Å; Y332-D467 VanDerWaalsContact OH-O 3.04Å; Y332-D467 PolarHBondContact OH-OD2 3.44Å; Y332-R470 HydrophobicContact CE2-CG 4.31Å; Y332-A471 HydrophobicContact CE1-CB 3.67Å; Y332-I474 HydrophobicContact CD1-CD1 4.06Å; Y332-I474 HydrophobicContact CD2-CD1 4.06Å; Y332-I474 HydrophobicContact CE1-CD1 4.39Å; Y332-I474 HydrophobicContact CE2-CD1 4.39Å; Y332-I474 HydrophobicContact CG-CD1 3.88Å
333	L	92.2	Very high	83.9	Confident	111 Å²	111	59 Å²	59	58%	0.581	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-98.1	6.1	173.7	-61.4	176.6	0	0	0	112.6	L329 R330 H331 I338	L329-L333 PolarHBondContact O-N 3.43Å; R330-L333 CarbonylContact O-C 3.59Å; R330-L333 PolarHBondContact O-N 3.41Å; R330-L333 VanDerWaalsContact O-N 3.14Å; H331-L333 VanDerWaalsContact C-N 3.26Å; H331-L333 PolarHBondContact O-N 3.36Å; L333-I338 VanDerWaalsContact O-CD1 3.25Å; L333-I338 WeakPolarHBondContact O-CD1 3.41Å
334	S	92.6	Very high	86.3	Confident	45 Å²	45	56.5 Å²	56.5	32%	0.315	29%	0.289	S	S	.	.	S	Bend	trans	-65.2	147.5	173.2	64.7	0	0	0	0	110.9	R330 H331 N336 I337 I338	R330-S334 PolarHBondContact O-N 3.39Å; H331-S334 WeakPolarHBondContact O-CB 3.46Å; H331-S334 PolarHBondContact O-N 3.22Å; H331-S334 PolarHBondContact O-OG 3.34Å; S334-N336 VanDerWaalsContact C-N 3.29Å; S334-N336 PolarHBondContact O-N 2.79Å; S334-I337 PolarHBondContact O-N 2.95Å; S334-I337 VanDerWaalsContact O-N 3.15Å; S334-I337 WeakPolarHBondContact OG-CB 3.46Å; S334-I337 WeakPolarHBondContact OG-CG1 3.09Å; S334-I338 WeakPolarHBondContact O-CG1 3.47Å; S334-I338 PolarHBondContact O-N 3.37Å
335	F	94.7	Very high	88.5	Confident	59 Å²	59	55 Å²	55	26%	0.259	28%	0.275	S	S	.	.	H	α-helix	trans	-51.6	-47.1	-176.1	174.6	-91.3	0	0	0	112.5	I337 I338 A339 L514 R518 F522	F335-I337 VanDerWaalsContact C-N 3.31Å; F335-I337 PolarHBondContact O-N 3.46Å; F335-I338 PolarHBondContact O-N 2.98Å; F335-A339 HydrophobicContact CE1-CB 4.41Å; F335-A339 WeakPolarHBondContact O-CB 3.2Å; F335-A339 PolarHBondContact O-N 2.88Å; F335-L514 HydrophobicContact CE2-CD2 4.07Å; F335-L514 HydrophobicContact CZ-CB 4.09Å; F335-L514 HydrophobicContact CZ-CD2 4.16Å; F335-R518 HydrophobicContact CD1-CB 4.28Å; F335-R518 HydrophobicContact CE1-CB 3.49Å; F335-R518 VanDerWaalsContact CE1-CB 3.49Å; F335-R518 HydrophobicContact CE1-CG 4Å; F335-R518 HydrophobicContact CZ-CB 3.94Å; F335-R518 HydrophobicContact CZ-CG 4.04Å; F335-F522 HydrophobicContact CE1-CE2 4.43Å; F335-F522 HydrophobicContact CE1-CZ 4.39Å
336	N	94.1	Very high	90.5	Very high	34 Å²	34	50.8 Å²	50.8	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-39.8	-174.7	-46.5	-5.9	0	0	0	110.9	S334 L340 L462 D521 F522	S334-N336 VanDerWaalsContact C-N 3.29Å; S334-N336 PolarHBondContact O-N 2.79Å; N336-L340 VanDerWaalsContact O-CG 3.26Å; N336-L340 WeakPolarHBondContact O-CG 3.36Å; N336-L340 PolarHBondContact O-N 3.39Å; N336-L340 VanDerWaalsContact O-N 3.07Å; N336-L462 HydrophobicContact CB-CD1 4.1Å; N336-D521 PolarHBondContact ND2-O 3.23Å; N336-D521 WeakPolarHBondContact OD1-CB 3.45Å; N336-F522 HydrophobicContact CB-CD1 4.49Å; N336-F522 HydrophobicContact CB-CE1 4.19Å
337	I	95.9	Very high	92.2	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-71.4	-44.9	179.8	-65.4	-62.9	0	0	0	110.7	Y332 S334 F335 A339 L340 Y341 Y459 L462 A463	Y332-I337 WeakPolarHBondContact O-CG2 3.43Å; S334-I337 PolarHBondContact O-N 2.95Å; S334-I337 VanDerWaalsContact O-N 3.15Å; S334-I337 WeakPolarHBondContact OG-CB 3.46Å; S334-I337 WeakPolarHBondContact OG-CG1 3.09Å; F335-I337 VanDerWaalsContact C-N 3.31Å; F335-I337 PolarHBondContact O-N 3.46Å; I337-A339 VanDerWaalsContact C-N 3.33Å; I337-A339 PolarHBondContact O-N 3.03Å; I337-L340 PolarHBondContact O-N 3.06Å; I337-L340 VanDerWaalsContact O-N 3.16Å; I337-Y341 HydrophobicContact CG2-CD2 4.24Å; I337-Y341 HydrophobicContact CG2-CE1 3.97Å; I337-Y341 HydrophobicContact CG2-CE2 3.48Å; I337-Y341 VanDerWaalsContact CG2-CE2 3.48Å; I337-Y341 VanDerWaalsContact CG2-OH 3.27Å; I337-Y341 WeakPolarHBondContact CG2-OH 3.14Å; I337-Y341 PolarHBondContact O-N 2.85Å; I337-Y459 HydrophobicContact CD1-CD2 3.9Å; I337-Y459 HydrophobicContact CD1-CE2 3.95Å; I337-Y459 HydrophobicContact CG2-CD2 4.45Å; I337-Y459 HydrophobicContact CG2-CE2 3.83Å; I337-L462 HydrophobicContact CD1-CB 4.03Å; I337-A463 HydrophobicContact CD1-CB 4.39Å
338	I	96.8	Very high	93.6	Very high	70 Å²	70	42 Å²	42	36%	0.359	21%	0.206	S	C	.	.	H	α-helix	trans	-60.2	-44.3	174.8	-66	174.8	0	0	0	110.8	L333 S334 F335 L340 Y341 C342	L333-I338 VanDerWaalsContact O-CD1 3.25Å; L333-I338 WeakPolarHBondContact O-CD1 3.41Å; S334-I338 WeakPolarHBondContact O-CG1 3.47Å; S334-I338 PolarHBondContact O-N 3.37Å; F335-I338 PolarHBondContact O-N 2.98Å; I338-L340 VanDerWaalsContact C-N 3.28Å; I338-L340 PolarHBondContact O-N 3.45Å; I338-Y341 WeakPolarHBondContact O-CB 3.2Å; I338-Y341 PolarHBondContact O-N 2.96Å; I338-Y341 VanDerWaalsContact O-N 3.11Å; I338-C342 PolarHBondContact O-N 2.86Å; I338-C342 PolarHBondContact O-SG 3.18Å; I338-C342 VanDerWaalsContact O-SG 3.36Å
339	A	97.6	Very high	94.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-40.8	176.7	0	0	0	0	0	111.5	F335 I337 C342 V343 L514 F522	F335-A339 HydrophobicContact CE1-CB 4.41Å; F335-A339 WeakPolarHBondContact O-CB 3.2Å; F335-A339 PolarHBondContact O-N 2.88Å; I337-A339 VanDerWaalsContact C-N 3.33Å; I337-A339 PolarHBondContact O-N 3.03Å; A339-C342 WeakPolarHBondContact O-CB 3.34Å; A339-C342 PolarHBondContact O-N 3.24Å; A339-V343 VanDerWaalsContact O-CG2 3.3Å; A339-V343 WeakPolarHBondContact O-CG2 3.49Å; A339-V343 PolarHBondContact O-N 3.39Å; A339-L514 HydrophobicContact CB-CB 4.2Å; A339-L514 HydrophobicContact CB-CD1 4.26Å; A339-F522 HydrophobicContact CB-CE1 4.25Å; A339-F522 HydrophobicContact CB-CZ 3.77Å
340	L	98	Very high	95.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.1	-32.8	175.2	-69.6	171.7	0	0	0	113.1	N336 I337 I338 V343 N344 L404 L458 Y459 L462 F522	N336-L340 VanDerWaalsContact O-CG 3.26Å; N336-L340 WeakPolarHBondContact O-CG 3.36Å; N336-L340 PolarHBondContact O-N 3.39Å; N336-L340 VanDerWaalsContact O-N 3.07Å; I337-L340 PolarHBondContact O-N 3.06Å; I337-L340 VanDerWaalsContact O-N 3.16Å; I338-L340 VanDerWaalsContact C-N 3.28Å; I338-L340 PolarHBondContact O-N 3.45Å; L340-V343 PolarHBondContact O-N 2.77Å; L340-N344 PolarHBondContact O-N 3.04Å; L340-N344 PolarHBondContact O-ND2 3.21Å; L340-L404 HydrophobicContact CD2-CD2 3.95Å; L340-L458 HydrophobicContact CD1-CB 4.07Å; L340-L458 HydrophobicContact CD2-CB 4.27Å; L340-Y459 HydrophobicContact CB-CD2 4.46Å; L340-Y459 HydrophobicContact CD1-CD2 4.46Å; L340-L462 HydrophobicContact CD1-CD1 4.08Å; L340-F522 HydrophobicContact CD2-CE1 4.29Å; L340-F522 HydrophobicContact CG-CE1 4.11Å
341	Y	98.1	Very high	95.9	Very high	27 Å²	27	30.5 Å²	30.5	11%	0.106	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-46.6	168.9	-62.3	-31.4	0	0	0	111.1	I337 I338 V343 N344 F345 Y459 I474 F475 V478	I337-Y341 HydrophobicContact CG2-CD2 4.24Å; I337-Y341 HydrophobicContact CG2-CE1 3.97Å; I337-Y341 HydrophobicContact CG2-CE2 3.48Å; I337-Y341 VanDerWaalsContact CG2-CE2 3.48Å; I337-Y341 VanDerWaalsContact CG2-OH 3.27Å; I337-Y341 WeakPolarHBondContact CG2-OH 3.14Å; I337-Y341 PolarHBondContact O-N 2.85Å; I338-Y341 WeakPolarHBondContact O-CB 3.2Å; I338-Y341 PolarHBondContact O-N 2.96Å; I338-Y341 VanDerWaalsContact O-N 3.11Å; Y341-V343 PolarHBondContact O-N 3.01Å; Y341-N344 PolarHBondContact O-N 3.09Å; Y341-F345 VanDerWaalsContact O-CB 3.28Å; Y341-F345 WeakPolarHBondContact O-CB 3.49Å; Y341-F345 PolarHBondContact O-N 2.97Å; Y341-Y459 HydrophobicContact CD1-CE2 4.26Å; Y341-Y459 HydrophobicContact CE1-CD2 4.16Å; Y341-Y459 AromaticContact CE1-CE2 3.36Å; Y341-Y459 HydrophobicContact CE1-CE2 3.36Å; Y341-Y459 AromaticContact CE1-CZ 3.94Å; Y341-Y459 AromaticContact CZ-CE2 3.87Å; Y341-Y459 PolarHBondContact OH-OH 3.14Å; Y341-I474 HydrophobicContact CE1-CG2 4.12Å; Y341-I474 HydrophobicContact CE2-CG2 4.15Å; Y341-I474 WeakPolarHBondContact OH-CG2 3.48Å; Y341-F475 AromaticContact CD1-CD2 3.96Å; Y341-F475 HydrophobicContact CD1-CD2 3.96Å; Y341-F475 HydrophobicContact CE1-CB 4.34Å; Y341-F475 AromaticContact CE1-CD2 3.99Å; Y341-F475 HydrophobicContact CE1-CD2 3.99Å; Y341-V478 HydrophobicContact CD1-CG2 4.29Å; Y341-V478 HydrophobicContact CG-CG2 4.29Å
342	C	98.2	Very high	96.2	Very high	34 Å²	34	25.2 Å²	25.2	23%	0.23	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-42.1	176.9	-63.4	0	0	0	0	112.2	I338 A339 A346 F510 P511	I338-C342 PolarHBondContact O-N 2.86Å; I338-C342 PolarHBondContact O-SG 3.18Å; I338-C342 VanDerWaalsContact O-SG 3.36Å; A339-C342 WeakPolarHBondContact O-CB 3.34Å; A339-C342 PolarHBondContact O-N 3.24Å; C342-A346 VanDerWaalsContact O-CB 3.22Å; C342-A346 WeakPolarHBondContact O-CB 3.14Å; C342-A346 PolarHBondContact O-N 2.88Å; C342-F510 HydrophobicContact CB-CE1 4.45Å; C342-P511 HydrophobicContact CB-CB 3.93Å
343	V	98.4	Very high	96.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.3	-52.2	174.8	165	0	0	0	0	110.9	A339 L340 Y341 A346 A347 L404 L408 P511 V515	A339-V343 VanDerWaalsContact O-CG2 3.3Å; A339-V343 WeakPolarHBondContact O-CG2 3.49Å; A339-V343 PolarHBondContact O-N 3.39Å; L340-V343 PolarHBondContact O-N 2.77Å; Y341-V343 PolarHBondContact O-N 3.01Å; V343-A346 PolarHBondContact O-N 3.39Å; V343-A347 VanDerWaalsContact O-CB 3.31Å; V343-A347 WeakPolarHBondContact O-CB 3.48Å; V343-A347 PolarHBondContact O-N 3.5Å; V343-L404 HydrophobicContact CG1-CD1 4.08Å; V343-L408 HydrophobicContact CG1-CD2 4.11Å; V343-L408 HydrophobicContact CG2-CD1 3.96Å; V343-L408 HydrophobicContact CG2-CD2 4.22Å; V343-P511 HydrophobicContact CB-CB 4.39Å; V343-P511 HydrophobicContact CG2-CB 3.7Å; V343-V515 HydrophobicContact CG2-CG2 3.97Å
344	N	98	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.5	-44.4	-176.9	-82.3	-84	0	0	0	111.6	L340 Y341 A346 A347 Y348 S455 F475 I479	L340-N344 PolarHBondContact O-N 3.04Å; L340-N344 PolarHBondContact O-ND2 3.21Å; Y341-N344 PolarHBondContact O-N 3.09Å; N344-A346 VanDerWaalsContact C-N 3.34Å; N344-A346 PolarHBondContact O-N 2.92Å; N344-A347 PolarHBondContact O-N 3.01Å; N344-Y348 WeakPolarHBondContact O-CB 3.36Å; N344-Y348 WeakPolarHBondContact O-CD2 3.36Å; N344-Y348 PolarHBondContact O-N 3.02Å; N344-S455 VanDerWaalsContact CG-OG 3.32Å; N344-S455 WeakPolarHBondContact ND2-CB 3.06Å; N344-S455 PolarHBondContact ND2-OG 2.9Å; N344-S455 PolarHBondContact OD1-OG 3.49Å; N344-S455 VanDerWaalsContact OD1-OG 3.12Å; N344-F475 HydrophobicContact CB-CE2 4.14Å; N344-F475 HydrophobicContact CB-CZ 4.22Å; N344-F475 WeakPolarHBondContact ND2-CE2 3.28Å; N344-F475 WeakPolarHBondContact ND2-CZ 3.43Å; N344-F475 WeakPolarHBondContact OD1-CZ 3.42Å; N344-I479 HydrophobicContact CB-CD1 4.31Å; N344-I479 HydrophobicContact CB-CG1 3.96Å
345	F	98.5	Very high	96.2	Very high	51 Å²	51	20.1 Å²	20.1	22%	0.224	10%	0.098	C	C	.	.	H	α-helix	trans	-55	-52	174.4	-178.9	-89.7	0	0	0	110.9	Y341 A347 F349 V478 V481 A482 L507	Y341-F345 VanDerWaalsContact O-CB 3.28Å; Y341-F345 WeakPolarHBondContact O-CB 3.49Å; Y341-F345 PolarHBondContact O-N 2.97Å; F345-A347 PolarHBondContact O-N 3.48Å; F345-F349 HydrophobicContact CE1-CB 4.42Å; F345-F349 WeakPolarHBondContact O-CB 3.42Å; F345-F349 PolarHBondContact O-N 3.5Å; F345-V478 HydrophobicContact CB-CG1 3.94Å; F345-V478 HydrophobicContact CD2-CG1 4.46Å; F345-V481 HydrophobicContact CE2-CB 4.4Å; F345-V481 HydrophobicContact CE2-CG1 3.95Å; F345-A482 HydrophobicContact CD2-CB 3.63Å; F345-A482 HydrophobicContact CE2-CB 3.91Å; F345-A482 HydrophobicContact CG-CB 4.13Å; F345-A482 WeakPolarHBondContact O-CB 3.31Å; F345-L507 HydrophobicContact CD1-CD1 4.15Å; F345-L507 HydrophobicContact CD1-CD2 3.99Å; F345-L507 HydrophobicContact CD1-CG 4.46Å; F345-L507 HydrophobicContact CE1-CD1 4.04Å; F345-L507 HydrophobicContact CE1-CD2 3.77Å; F345-L507 HydrophobicContact CE1-CG 4.47Å
346	A	98.2	Very high	95.8	Very high	3 Å²	3	18.9 Å²	18.9	3%	0.025	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-44.9	-179.5	0	0	0	0	0	112.4	C342 V343 N344 S350 L507 P511	C342-A346 VanDerWaalsContact O-CB 3.22Å; C342-A346 WeakPolarHBondContact O-CB 3.14Å; C342-A346 PolarHBondContact O-N 2.88Å; V343-A346 PolarHBondContact O-N 3.39Å; N344-A346 VanDerWaalsContact C-N 3.34Å; N344-A346 PolarHBondContact O-N 2.92Å; A346-S350 WeakPolarHBondContact O-CB 3.18Å; A346-S350 PolarHBondContact O-N 3.24Å; A346-S350 PolarHBondContact O-OG 3.3Å; A346-L507 HydrophobicContact CB-CD2 4.25Å; A346-L507 HydrophobicContact CB-CG 3.86Å; A346-L507 WeakPolarHBondContact CB-O 3.48Å; A346-P511 HydrophobicContact CB-CG 3.91Å
347	A	98	Very high	95.5	Very high	4 Å²	4	17.3 Å²	17.3	3%	0.033	9%	0.09	C	C	.	.	H	α-helix	trans	-67.9	-45.1	-177.8	0	0	0	0	0	112.5	V343 N344 F345 F351 I448 T451 Y452	V343-A347 VanDerWaalsContact O-CB 3.31Å; V343-A347 WeakPolarHBondContact O-CB 3.48Å; V343-A347 PolarHBondContact O-N 3.5Å; N344-A347 PolarHBondContact O-N 3.01Å; F345-A347 PolarHBondContact O-N 3.48Å; A347-F351 WeakPolarHBondContact O-CB 3.39Å; A347-F351 PolarHBondContact O-N 3.49Å; A347-I448 HydrophobicContact CB-CD1 4.39Å; A347-I448 WeakPolarHBondContact O-CD1 3.44Å; A347-T451 WeakPolarHBondContact CB-OG1 3.17Å; A347-Y452 HydrophobicContact CB-CD1 3.98Å; A347-Y452 HydrophobicContact CB-CE1 3.57Å; A347-Y452 PolarHBondContact O-OH 3.34Å
348	Y	97	Very high	95.1	Very high	19 Å²	19	17.6 Å²	17.6	8%	0.075	9%	0.092	C	C	.	.	H	α-helix	trans	-70.7	-39.9	177	-81.8	-85.3	0	0	0	112.6	N344 S350 F351 M352 Y452 I479 F483	N344-Y348 WeakPolarHBondContact O-CB 3.36Å; N344-Y348 WeakPolarHBondContact O-CD2 3.36Å; N344-Y348 PolarHBondContact O-N 3.02Å; Y348-S350 VanDerWaalsContact C-N 3.29Å; Y348-S350 PolarHBondContact O-N 2.84Å; Y348-F351 PolarHBondContact O-N 3.41Å; Y348-M352 WeakPolarHBondContact O-CB 3.32Å; Y348-M352 VanDerWaalsContact O-CG 3.23Å; Y348-M352 WeakPolarHBondContact O-CG 3.45Å; Y348-M352 PolarHBondContact O-N 2.67Å; Y348-Y452 WeakPolarHBondContact CA-OH 3.42Å; Y348-Y452 HydrophobicContact CD1-CE1 4.13Å; Y348-Y452 HydrophobicContact CD1-CE2 4.26Å; Y348-Y452 AromaticContact CD1-CZ 3.7Å; Y348-Y452 WeakPolarHBondContact CD1-OH 3.24Å; Y348-Y452 HydrophobicContact CD2-CD1 4.07Å; Y348-Y452 AromaticContact CD2-CE1 3.57Å; Y348-Y452 HydrophobicContact CD2-CE1 3.57Å; Y348-Y452 HydrophobicContact CE1-CD2 4.37Å; Y348-Y452 HydrophobicContact CE1-CE1 4.16Å; Y348-Y452 AromaticContact CE1-CE2 3.8Å; Y348-Y452 HydrophobicContact CE1-CE2 3.8Å; Y348-Y452 AromaticContact CE1-CZ 3.69Å; Y348-Y452 AromaticContact CE2-CD1 3.69Å; Y348-Y452 HydrophobicContact CE2-CD1 3.69Å; Y348-Y452 AromaticContact CE2-CE1 3.6Å; Y348-Y452 HydrophobicContact CE2-CE1 3.6Å; Y348-Y452 HydrophobicContact CE2-CE2 4.44Å; Y348-Y452 HydrophobicContact CE2-CG 4.16Å; Y348-Y452 AromaticContact CG-CE1 3.85Å; Y348-Y452 HydrophobicContact CG-CE1 3.85Å; Y348-Y452 AromaticContact CG-CZ 3.89Å; Y348-Y452 AromaticContact CZ-CE1 3.91Å; Y348-Y452 AromaticContact CZ-CE2 3.9Å; Y348-Y452 AromaticContact CZ-CZ 3.85Å; Y348-I479 HydrophobicContact CD1-CG2 3.76Å; Y348-I479 HydrophobicContact CD2-CB 4.3Å; Y348-I479 HydrophobicContact CD2-CD1 4.09Å; Y348-I479 HydrophobicContact CD2-CG1 3.75Å; Y348-I479 HydrophobicContact CD2-CG2 3.76Å; Y348-I479 HydrophobicContact CE1-CG2 3.88Å; Y348-I479 HydrophobicContact CE2-CD1 3.62Å; Y348-I479 HydrophobicContact CE2-CG1 3.83Å; Y348-I479 HydrophobicContact CE2-CG2 3.89Å; Y348-I479 HydrophobicContact CG-CG1 4.47Å; Y348-I479 HydrophobicContact CG-CG2 3.7Å; Y348-F483 HydrophobicContact CD1-CD2 4.49Å
349	F	97.3	Very high	94.5	Very high	11 Å²	11	16.6 Å²	16.6	5%	0.048	9%	0.09	C	C	.	.	H	α-helix	trans	-56.6	-48.1	173.8	169.8	-89	0	0	0	110.1	F345 M352 S353 A482 V485 G486 V489 M504 L507	F345-F349 HydrophobicContact CE1-CB 4.42Å; F345-F349 WeakPolarHBondContact O-CB 3.42Å; F345-F349 PolarHBondContact O-N 3.5Å; F349-M352 PolarHBondContact O-N 3.38Å; F349-S353 WeakPolarHBondContact O-CB 3.2Å; F349-S353 PolarHBondContact O-N 3.48Å; F349-A482 HydrophobicContact CB-CB 4.11Å; F349-V485 HydrophobicContact CD2-CB 4.44Å; F349-V485 HydrophobicContact CD2-CG1 4.11Å; F349-V485 HydrophobicContact CE2-CG1 3.92Å; F349-G486 VanDerWaalsContact CD2-CA 3.47Å; F349-V489 HydrophobicContact CE2-CB 3.93Å; F349-V489 HydrophobicContact CE2-CG1 4.49Å; F349-V489 HydrophobicContact CE2-CG2 3.82Å; F349-V489 HydrophobicContact CZ-CB 3.86Å; F349-V489 HydrophobicContact CZ-CG1 3.94Å; F349-V489 HydrophobicContact CZ-CG2 4.06Å; F349-M504 HydrophobicContact CD1-CG 4.29Å; F349-M504 HydrophobicContact CE1-CG 3.86Å; F349-L507 HydrophobicContact CB-CD2 3.89Å; F349-L507 HydrophobicContact CD1-CD2 3.28Å; F349-L507 HydrophobicContact CD2-CD2 4.36Å; F349-L507 HydrophobicContact CE1-CD2 3.85Å; F349-L507 HydrophobicContact CG-CD2 3.58Å
350	S	97.2	Very high	93.7	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-72.2	-39.5	-173.9	-53.9	0	0	0	0	112.1	A346 Y348 L354 Y415 M504	A346-S350 WeakPolarHBondContact O-CB 3.18Å; A346-S350 PolarHBondContact O-N 3.24Å; A346-S350 PolarHBondContact O-OG 3.3Å; Y348-S350 VanDerWaalsContact C-N 3.29Å; Y348-S350 PolarHBondContact O-N 2.84Å; S350-L354 WeakPolarHBondContact O-CB 3.39Å; S350-L354 PolarHBondContact O-N 3.5Å; S350-Y415 VanDerWaalsContact CB-CZ 3.43Å; S350-Y415 WeakPolarHBondContact CB-OH 3.18Å; S350-M504 WeakPolarHBondContact O-CE 3.2Å
351	F	94.8	Very high	93.1	Very high	40 Å²	40	18.6 Å²	18.6	18%	0.175	10%	0.103	C	C	.	.	H	α-helix	trans	-57.1	-52.4	171.1	171.9	-108	0	0	0	111.6	A347 Y348 S353 L354 E355 I448 Y452	A347-F351 WeakPolarHBondContact O-CB 3.39Å; A347-F351 PolarHBondContact O-N 3.49Å; Y348-F351 PolarHBondContact O-N 3.41Å; F351-S353 PolarHBondContact O-N 3.39Å; F351-L354 PolarHBondContact O-N 2.84Å; F351-E355 WeakPolarHBondContact O-CB 3.31Å; F351-E355 PolarHBondContact O-N 3.22Å; F351-I448 HydrophobicContact CB-CD1 3.93Å; F351-Y452 WeakPolarHBondContact CB-OH 3.4Å; F351-Y452 WeakPolarHBondContact CG-OH 3.3Å
352	M	92.6	Very high	92.6	Very high	8 Å²	8	17.3 Å²	17.3	4%	0.039	10%	0.098	C	C	.	.	H	α-helix	trans	-70.2	-32.7	-176.2	-65.9	-65.5	-66.4	0	0	112.8	R98 Y348 F349 A356 F483 P487	R98-M352 PolarHBondContact NH1-SD 3.18Å; R98-M352 PolarHBondContact NH2-SD 3.43Å; Y348-M352 WeakPolarHBondContact O-CB 3.32Å; Y348-M352 VanDerWaalsContact O-CG 3.23Å; Y348-M352 WeakPolarHBondContact O-CG 3.45Å; Y348-M352 PolarHBondContact O-N 2.67Å; F349-M352 PolarHBondContact O-N 3.38Å; M352-A356 PolarHBondContact O-N 3.05Å; M352-A356 VanDerWaalsContact O-N 3.15Å; M352-F483 HydrophobicContact CE-CD1 3.73Å; M352-F483 HydrophobicContact CE-CD2 3.77Å; M352-F483 HydrophobicContact CE-CE1 3.6Å; M352-F483 HydrophobicContact CE-CE2 3.66Å; M352-F483 HydrophobicContact CE-CG 3.85Å; M352-F483 HydrophobicContact CE-CZ 3.61Å; M352-F483 HydrophobicContact CG-CD2 3.63Å; M352-F483 HydrophobicContact CG-CE2 4.02Å; M352-F483 HydrophobicContact CG-CG 4.21Å; M352-F483 HydrophobicContact SD-CD2 3.56Å; M352-F483 VanDerWaalsContact SD-CD2 3.56Å; M352-F483 HydrophobicContact SD-CE1 4.39Å; M352-F483 HydrophobicContact SD-CE2 3.31Å; M352-F483 WeakPolarHBondContact SD-CE2 3.26Å; M352-F483 HydrophobicContact SD-CG 4.24Å; M352-F483 HydrophobicContact SD-CZ 3.81Å; M352-P487 HydrophobicContact CB-CG 3.85Å; M352-P487 HydrophobicContact CE-CG 3.74Å
353	S	93.6	Very high	91.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.1	-45.2	174.3	-176	0	0	0	0	111.6	F349 F351 E355 A356 A357 G486 G490 V500	F349-S353 WeakPolarHBondContact O-CB 3.2Å; F349-S353 PolarHBondContact O-N 3.48Å; F351-S353 PolarHBondContact O-N 3.39Å; S353-E355 VanDerWaalsContact C-N 3.34Å; S353-E355 PolarHBondContact O-N 2.91Å; S353-A356 PolarHBondContact O-N 3.16Å; S353-A357 VanDerWaalsContact O-CB 3.24Å; S353-A357 WeakPolarHBondContact O-CB 3.34Å; S353-A357 PolarHBondContact O-N 3.43Å; S353-G486 WeakPolarHBondContact CA-O 3.47Å; S353-G486 WeakPolarHBondContact CB-O 3.34Å; S353-G490 WeakPolarHBondContact OG-CA 3.29Å; S353-V500 WeakPolarHBondContact OG-CG1 3.48Å
354	L	93.4	Very high	91.3	Very high	9 Å²	9	27.6 Å²	27.6	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-60.2	-45.6	174.6	177.9	69.4	0	0	0	111.1	S350 F351 A356 A357 L358 I441 H444 F501 M504	S350-L354 WeakPolarHBondContact O-CB 3.39Å; S350-L354 PolarHBondContact O-N 3.5Å; F351-L354 PolarHBondContact O-N 2.84Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 2.82Å; L354-A357 PolarHBondContact O-N 3.08Å; L354-L358 VanDerWaalsContact O-CB 3.23Å; L354-L358 WeakPolarHBondContact O-CB 3.37Å; L354-L358 PolarHBondContact O-N 3.23Å; L354-I441 HydrophobicContact CD1-CG1 4.47Å; L354-H444 WeakPolarHBondContact CD2-CD2 3.3Å; L354-H444 WeakPolarHBondContact CD2-NE2 3.25Å; L354-F501 HydrophobicContact CD1-CE1 3.63Å; L354-F501 HydrophobicContact CD1-CZ 3.96Å; L354-M504 HydrophobicContact CB-CE 4.02Å
355	E	88.9	Confident	90.7	Very high	49 Å²	49	30.1 Å²	30.1	23%	0.229	15%	0.154	C	C	.	.	H	α-helix	trans	-59.5	-39.5	180	-169.9	-176.9	159.3	0	0	111.7	R98 F351 S353 P359 Y377	R98-E355 IonicContact CZ-OE1 2.69Å; R98-E355 IonicContact CZ-OE2 2.75Å; R98-E355 IonicContact NE-OE1 3.3Å; R98-E355 IonicContact NH2-OE1 3.64Å; R98-E355 PolarHBondContact NH2-OE1 3.22Å; R98-E355 IonicContact NH2-OE2 2.84Å; R98-E355 PolarHBondContact NH2-OE2 3.26Å; F351-E355 WeakPolarHBondContact O-CB 3.31Å; F351-E355 PolarHBondContact O-N 3.22Å; S353-E355 VanDerWaalsContact C-N 3.34Å; S353-E355 PolarHBondContact O-N 2.91Å; E355-P359 VanDerWaalsContact O-CD 3.3Å; E355-P359 WeakPolarHBondContact O-CD 3.39Å; E355-Y377 HydrophobicContact CG-CE1 4.03Å; E355-Y377 PolarHBondContact O-OH 3.43Å
356	A	87.7	Confident	90.2	Very high	32 Å²	32	28.2 Å²	28.2	26%	0.264	15%	0.146	S	C	.	.	H	α-helix	trans	-75.7	-36.4	176.8	0	0	0	0	0	113.5	M352 S353 L354 P360 P487	M352-A356 PolarHBondContact O-N 3.05Å; M352-A356 VanDerWaalsContact O-N 3.15Å; S353-A356 PolarHBondContact O-N 3.16Å; L354-A356 VanDerWaalsContact C-N 3.27Å; L354-A356 PolarHBondContact O-N 2.82Å; A356-P360 WeakPolarHBondContact O-CD 3.38Å; A356-P487 HydrophobicContact CB-CB 4.04Å
357	A	88	Confident	89.7	Confident	2 Å²	2	35 Å²	35	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-82.6	-27.1	-174.7	0	0	0	0	0	113.7	S353 L354 P360 V361 V500	S353-A357 VanDerWaalsContact O-CB 3.24Å; S353-A357 WeakPolarHBondContact O-CB 3.34Å; S353-A357 PolarHBondContact O-N 3.43Å; L354-A357 PolarHBondContact O-N 3.08Å; A357-P360 VanDerWaalsContact O-CD 3.27Å; A357-P360 WeakPolarHBondContact O-CD 3.4Å; A357-P360 WeakPolarHBondContact O-CG 3.22Å; A357-V361 WeakPolarHBondContact O-CB 3.33Å; A357-V361 WeakPolarHBondContact O-CG2 3.28Å; A357-V361 PolarHBondContact O-N 2.86Å; A357-V500 HydrophobicContact CB-CG1 4.12Å
358	L	87.3	Confident	89.2	Confident	10 Å²	10	36.6 Å²	36.6	5%	0.052	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-50	-173.7	177.1	63.3	0	0	0	113.7	L354 V361 A362 V376 Y377 I441	L354-L358 VanDerWaalsContact O-CB 3.23Å; L354-L358 WeakPolarHBondContact O-CB 3.37Å; L354-L358 PolarHBondContact O-N 3.23Å; L358-V361 PolarHBondContact O-N 3.42Å; L358-A362 VanDerWaalsContact O-CB 3.3Å; L358-A362 WeakPolarHBondContact O-CB 3.34Å; L358-A362 PolarHBondContact O-N 2.85Å; L358-V376 HydrophobicContact CD2-CG1 4.05Å; L358-Y377 HydrophobicContact CD2-CE1 4.06Å; L358-I441 HydrophobicContact CD1-CD1 3.64Å; L358-I441 HydrophobicContact CD2-CD1 4.09Å
359	P	84	Confident	88.5	Confident	48 Å²	48	39.2 Å²	39.2	31%	0.312	20%	0.2	S	C	.	.	H	α-helix	trans	-58.9	-48.5	-177	-21.6	33.7	0	0	0	113.8	E355 V361 A362 N363 T373 Y377	E355-P359 VanDerWaalsContact O-CD 3.3Å; E355-P359 WeakPolarHBondContact O-CD 3.39Å; P359-V361 PolarHBondContact O-N 3.24Å; P359-A362 PolarHBondContact O-N 3.06Å; P359-N363 WeakPolarHBondContact O-CB 3.45Å; P359-N363 PolarHBondContact O-N 3.39Å; P359-T373 HydrophobicContact CB-CG2 4.09Å; P359-T373 HydrophobicContact CG-CG2 4.08Å; P359-Y377 WeakPolarHBondContact CD-OH 3.47Å; P359-Y377 HydrophobicContact CG-CE2 4.21Å; P359-Y377 VanDerWaalsContact CG-OH 3.26Å; P359-Y377 WeakPolarHBondContact CG-OH 3.26Å
360	P	81.1	Confident	87.4	Confident	35 Å²	35	46 Å²	46	23%	0.227	23%	0.232	C	C	.	.	H	α-helix	trans	-71.1	-31.9	-179.3	28.4	-35.5	0	0	0	112.7	A356 A357 R364 I494	A356-P360 WeakPolarHBondContact O-CD 3.38Å; A357-P360 VanDerWaalsContact O-CD 3.27Å; A357-P360 WeakPolarHBondContact O-CD 3.4Å; A357-P360 WeakPolarHBondContact O-CG 3.22Å; P360-R364 VanDerWaalsContact O-CB 3.25Å; P360-R364 WeakPolarHBondContact O-CB 3.44Å; P360-R364 PolarHBondContact O-N 3.34Å; P360-I494 HydrophobicContact CB-CD1 3.94Å; P360-I494 HydrophobicContact CB-CG1 4.24Å; P360-I494 HydrophobicContact CB-CG2 3.6Å; P360-I494 HydrophobicContact CG-CB 4.44Å; P360-I494 HydrophobicContact CG-CD1 3.56Å; P360-I494 HydrophobicContact CG-CG1 3.67Å; P360-I494 HydrophobicContact CG-CG2 3.89Å
361	V	84.1	Confident	86.3	Confident	9 Å²	9	49.7 Å²	49.7	6%	0.055	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-45.8	173.5	171.9	0	0	0	0	110.6	A357 L358 P359 N363 R364 V365 P497	A357-V361 WeakPolarHBondContact O-CB 3.33Å; A357-V361 WeakPolarHBondContact O-CG2 3.28Å; A357-V361 PolarHBondContact O-N 2.86Å; L358-V361 PolarHBondContact O-N 3.42Å; P359-V361 PolarHBondContact O-N 3.24Å; V361-N363 VanDerWaalsContact C-N 3.35Å; V361-N363 PolarHBondContact O-N 2.98Å; V361-R364 PolarHBondContact O-N 3.28Å; V361-V365 HydrophobicContact CG1-CG2 4.33Å; V361-V365 WeakPolarHBondContact O-CB 3.13Å; V361-V365 WeakPolarHBondContact O-CG2 3.38Å; V361-V365 PolarHBondContact O-N 2.65Å; V361-P497 HydrophobicContact CG2-CB 3.62Å; V361-P497 HydrophobicContact CG2-CG 4.31Å
362	A	87.9	Confident	85.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-41.1	177.4	0	0	0	0	0	112	L358 P359 F366 Q367 W368	L358-A362 VanDerWaalsContact O-CB 3.3Å; L358-A362 WeakPolarHBondContact O-CB 3.34Å; L358-A362 PolarHBondContact O-N 2.85Å; P359-A362 PolarHBondContact O-N 3.06Å; A362-F366 HydrophobicContact CB-CD2 4.23Å; A362-F366 CarbonylContact O-C 3.52Å; A362-F366 VanDerWaalsContact O-CA 3.31Å; A362-F366 WeakPolarHBondContact O-CA 3.12Å; A362-F366 VanDerWaalsContact O-CB 3.3Å; A362-F366 WeakPolarHBondContact O-CB 3.42Å; A362-F366 PolarHBondContact O-N 3.44Å; A362-Q367 PolarHBondContact O-N 2.91Å; A362-W368 HydrophobicContact CB-CB 4.18Å; A362-W368 HydrophobicContact CB-CD2 4.24Å; A362-W368 HydrophobicContact CB-CE3 3.67Å; A362-W368 HydrophobicContact CB-CG 4.49Å; A362-W368 HydrophobicContact CB-CZ3 4.37Å; A362-W368 PolarHBondContact O-N 3.28Å
363	N	84.5	Confident	85.3	Confident	91 Å²	91	51.5 Å²	51.5	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-47.8	175.9	-177.3	-104.7	0	0	0	111.9	P359 V361 Q367 W368	P359-N363 WeakPolarHBondContact O-CB 3.45Å; P359-N363 PolarHBondContact O-N 3.39Å; V361-N363 VanDerWaalsContact C-N 3.35Å; V361-N363 PolarHBondContact O-N 2.98Å; N363-Q367 VanDerWaalsContact O-CA 3.25Å; N363-Q367 WeakPolarHBondContact O-CA 3.28Å; N363-Q367 PolarHBondContact O-N 3.22Å; N363-Q367 VanDerWaalsContact O-N 3.16Å; N363-W368 PolarHBondContact ND2-O 2.85Å
364	R	84.3	Confident	84.6	Confident	158 Å²	158	54.8 Å²	54.8	60%	0.596	29%	0.287	S	S	*	.	H	α-helix	trans	-66.5	-42.9	-177.7	-175.5	178.6	178.5	-169.9	-0.9	112.9	P360 V361 Q367 G495	P360-R364 VanDerWaalsContact O-CB 3.25Å; P360-R364 WeakPolarHBondContact O-CB 3.44Å; P360-R364 PolarHBondContact O-N 3.34Å; V361-R364 PolarHBondContact O-N 3.28Å; R364-Q367 PolarHBondContact O-NE2 3.04Å; R364-G495 PolarHBondContact NH1-O 3.49Å
365	V	85.5	Confident	84.3	Confident	54 Å²	54	61.7 Å²	61.7	33%	0.327	31%	0.313	S	S	.	.	H	α-helix	trans	-94.5	-44	-171.5	-175.8	0	0	0	0	112	V361 L425	V361-V365 HydrophobicContact CG1-CG2 4.33Å; V361-V365 WeakPolarHBondContact O-CB 3.13Å; V361-V365 WeakPolarHBondContact O-CG2 3.38Å; V361-V365 PolarHBondContact O-N 2.65Å; V365-L425 HydrophobicContact CG1-CD1 4.16Å; V365-L425 HydrophobicContact CG1-CD2 4.22Å; V365-L425 HydrophobicContact CG2-CD1 4.32Å
366	F	89.5	Confident	84.3	Confident	11 Å²	11	60.2 Å²	60.2	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-100.9	-3.7	-173.7	-49.3	-37.6	0	0	0	113.5	A362 W368 L425 L430 I434 T437	A362-F366 HydrophobicContact CB-CD2 4.23Å; A362-F366 CarbonylContact O-C 3.52Å; A362-F366 VanDerWaalsContact O-CA 3.31Å; A362-F366 WeakPolarHBondContact O-CA 3.12Å; A362-F366 VanDerWaalsContact O-CB 3.3Å; A362-F366 WeakPolarHBondContact O-CB 3.42Å; A362-F366 PolarHBondContact O-N 3.44Å; F366-W368 VanDerWaalsContact CB-CD1 3.44Å; F366-W368 HydrophobicContact CB-CD2 3.95Å; F366-W368 HydrophobicContact CB-CG 3.76Å; F366-W368 HydrophobicContact CB-CZ2 4.49Å; F366-W368 HydrophobicContact CD2-CD2 4.05Å; F366-W368 AromaticContact CD2-CE2 3.92Å; F366-W368 HydrophobicContact CD2-CE3 4.2Å; F366-W368 HydrophobicContact CD2-CH2 4.1Å; F366-W368 AromaticContact CD2-CZ2 3.98Å; F366-W368 HydrophobicContact CD2-CZ2 3.98Å; F366-W368 HydrophobicContact CD2-CZ3 4.19Å; F366-W368 HydrophobicContact CE2-CH2 4.49Å; F366-W368 HydrophobicContact CG-CD2 4.47Å; F366-W368 HydrophobicContact CG-CZ2 4.47Å; F366-W368 VanDerWaalsContact O-CD1 3.3Å; F366-W368 PolarHBondContact O-N 2.91Å; F366-L425 HydrophobicContact CE1-CD2 3.98Å; F366-L425 HydrophobicContact CZ-CD2 4.18Å; F366-L430 HydrophobicContact CB-CD1 4.34Å; F366-L430 HydrophobicContact CD1-CD1 3.48Å; F366-L430 VanDerWaalsContact CD1-CD1 3.48Å; F366-L430 HydrophobicContact CE1-CD1 4.24Å; F366-L430 HydrophobicContact CG-CD1 4.32Å; F366-I434 HydrophobicContact CB-CG1 4.47Å; F366-I434 HydrophobicContact CD1-CG1 3.82Å; F366-I434 HydrophobicContact CD2-CG1 4.27Å; F366-I434 HydrophobicContact CE1-CG1 4.05Å; F366-I434 HydrophobicContact CE2-CG1 4.49Å; F366-I434 HydrophobicContact CG-CG1 3.94Å; F366-I434 HydrophobicContact CZ-CG1 4.38Å; F366-T437 HydrophobicContact CE2-CG2 4.17Å; F366-T437 HydrophobicContact CZ-CG2 4.26Å
367	Q	88.1	Confident	84.3	Confident	144 Å²	144	62 Å²	62	67%	0.673	31%	0.308	S	S	*	.			trans	54.7	29.9	-173.3	-58.5	-63	-39.1	0	0	112.2	A362 N363 R364	A362-Q367 PolarHBondContact O-N 2.91Å; N363-Q367 VanDerWaalsContact O-CA 3.25Å; N363-Q367 WeakPolarHBondContact O-CA 3.28Å; N363-Q367 PolarHBondContact O-N 3.22Å; N363-Q367 VanDerWaalsContact O-N 3.16Å; R364-Q367 PolarHBondContact O-NE2 3.04Å
368	W	87	Confident	84.2	Confident	38 Å²	38	65.2 Å²	65.2	14%	0.144	32%	0.324	C	S	.	.			trans	-71.4	141.1	177	-73.5	2.8	0	0	0	110.6	A362 N363 F366 E372 V376 I434 L438	A362-W368 HydrophobicContact CB-CB 4.18Å; A362-W368 HydrophobicContact CB-CD2 4.24Å; A362-W368 HydrophobicContact CB-CE3 3.67Å; A362-W368 HydrophobicContact CB-CG 4.49Å; A362-W368 HydrophobicContact CB-CZ3 4.37Å; A362-W368 PolarHBondContact O-N 3.28Å; N363-W368 PolarHBondContact ND2-O 2.85Å; F366-W368 VanDerWaalsContact CB-CD1 3.44Å; F366-W368 HydrophobicContact CB-CD2 3.95Å; F366-W368 HydrophobicContact CB-CG 3.76Å; F366-W368 HydrophobicContact CB-CZ2 4.49Å; F366-W368 HydrophobicContact CD2-CD2 4.05Å; F366-W368 AromaticContact CD2-CE2 3.92Å; F366-W368 HydrophobicContact CD2-CE3 4.2Å; F366-W368 HydrophobicContact CD2-CH2 4.1Å; F366-W368 AromaticContact CD2-CZ2 3.98Å; F366-W368 HydrophobicContact CD2-CZ2 3.98Å; F366-W368 HydrophobicContact CD2-CZ3 4.19Å; F366-W368 HydrophobicContact CE2-CH2 4.49Å; F366-W368 HydrophobicContact CG-CD2 4.47Å; F366-W368 HydrophobicContact CG-CZ2 4.47Å; F366-W368 VanDerWaalsContact O-CD1 3.3Å; F366-W368 PolarHBondContact O-N 2.91Å; W368-E372 HydrophobicContact CB-CB 4.01Å; W368-E372 HydrophobicContact CD2-CB 3.96Å; W368-E372 HydrophobicContact CE3-CB 4.31Å; W368-E372 HydrophobicContact CG-CB 3.83Å; W368-E372 HydrophobicContact CG-CG 4.46Å; W368-V376 HydrophobicContact CH2-CG2 4.16Å; W368-V376 HydrophobicContact CZ3-CG2 3.67Å; W368-I434 HydrophobicContact CH2-CG2 4.07Å; W368-I434 HydrophobicContact CZ2-CB 4.35Å; W368-I434 HydrophobicContact CZ2-CD1 4.03Å; W368-I434 HydrophobicContact CZ2-CG1 3.91Å; W368-I434 HydrophobicContact CZ2-CG2 3.6Å; W368-L438 HydrophobicContact CH2-CD1 4.48Å; W368-L438 HydrophobicContact CH2-CD2 4.14Å; W368-L438 HydrophobicContact CH2-CG 4.42Å
369	T	80.8	Confident	84.4	Confident	74 Å²	74	67.6 Å²	67.6	45%	0.454	35%	0.345	S	S	.	.			trans	-85	-179.8	170.3	78.4	0	0	0	0	109.8	V371 E372 T373	T369-V371 PolarHBondContact O-N 2.93Å; T369-V371 PolarHBondContact OG1-N 3.41Å; T369-E372 WeakPolarHBondContact CA-OE2 3.33Å; T369-E372 VanDerWaalsContact CB-OE2 3.27Å; T369-E372 WeakPolarHBondContact CB-OE2 3.3Å; T369-E372 PolarHBondContact N-OE2 2.98Å; T369-E372 PolarHBondContact OG1-OE2 2.68Å; T369-T373 PolarHBondContact O-N 2.85Å; T369-T373 PolarHBondContact O-OG1 3.26Å
370	E	74.2	Confident	84.8	Confident	155 Å²	155	66.1 Å²	66.1	72%	0.724	34%	0.337	S	S	*	.	H	α-helix	trans	-58.8	-27.6	173.3	-62.7	176.6	-175.3	0	0	111.9	S374	E370-S374 VanDerWaalsContact O-CB 3.24Å; E370-S374 WeakPolarHBondContact O-CB 3.48Å; E370-S374 PolarHBondContact O-N 2.91Å; E370-S374 PolarHBondContact O-OG 3.39Å
371	V	75.7	Confident	85.2	Confident	76 Å²	76	65.3 Å²	65.3	46%	0.461	33%	0.333	S	S	.	.	H	α-helix	trans	-71.1	-51.8	-177.9	-178	0	0	0	0	111.5	T369 T373 S374 Y375	T369-V371 PolarHBondContact O-N 2.93Å; T369-V371 PolarHBondContact OG1-N 3.41Å; V371-T373 VanDerWaalsContact C-N 3.35Å; V371-T373 PolarHBondContact O-N 3.5Å; V371-S374 WeakPolarHBondContact O-CB 3.25Å; V371-S374 PolarHBondContact O-N 3.14Å; V371-Y375 HydrophobicContact CG1-CD2 4.39Å; V371-Y375 HydrophobicContact CG1-CE2 3.65Å; V371-Y375 WeakPolarHBondContact O-CD2 3.48Å; V371-Y375 PolarHBondContact O-N 2.76Å; V371-Y375 VanDerWaalsContact O-N 3.1Å
372	E	83.7	Confident	85.6	Confident	78 Å²	78	68.4 Å²	68.4	36%	0.364	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-41	-179.1	-64.4	82.8	-176.5	0	0	111.6	W368 T369 S374 Y375 V376	W368-E372 HydrophobicContact CB-CB 4.01Å; W368-E372 HydrophobicContact CD2-CB 3.96Å; W368-E372 HydrophobicContact CE3-CB 4.31Å; W368-E372 HydrophobicContact CG-CB 3.83Å; W368-E372 HydrophobicContact CG-CG 4.46Å; T369-E372 WeakPolarHBondContact CA-OE2 3.33Å; T369-E372 VanDerWaalsContact CB-OE2 3.27Å; T369-E372 WeakPolarHBondContact CB-OE2 3.3Å; T369-E372 PolarHBondContact N-OE2 2.98Å; T369-E372 PolarHBondContact OG1-OE2 2.68Å; E372-S374 VanDerWaalsContact C-N 3.31Å; E372-S374 PolarHBondContact O-N 2.75Å; E372-Y375 PolarHBondContact O-N 3.14Å; E372-V376 PolarHBondContact O-N 3.4Å
373	T	81.5	Confident	85.9	Confident	9 Å²	9	71 Å²	71	6%	0.055	36%	0.362	C	S	.	.	H	α-helix	trans	-61.1	-40.5	174.2	-59	0	0	0	0	111.4	P359 T369 V371 Y375 V376 Y377	P359-T373 HydrophobicContact CB-CG2 4.09Å; P359-T373 HydrophobicContact CG-CG2 4.08Å; T369-T373 PolarHBondContact O-N 2.85Å; T369-T373 PolarHBondContact O-OG1 3.26Å; V371-T373 VanDerWaalsContact C-N 3.35Å; V371-T373 PolarHBondContact O-N 3.5Å; T373-Y375 VanDerWaalsContact C-N 3.32Å; T373-Y375 PolarHBondContact O-N 2.92Å; T373-V376 WeakPolarHBondContact O-CB 3.38Å; T373-V376 PolarHBondContact O-N 2.64Å; T373-V376 VanDerWaalsContact O-N 3.14Å; T373-Y377 HydrophobicContact CG2-CD2 4.07Å; T373-Y377 HydrophobicContact CG2-CE2 3.55Å; T373-Y377 VanDerWaalsContact O-CD2 3.31Å; T373-Y377 WeakPolarHBondContact O-CD2 3.46Å; T373-Y377 PolarHBondContact O-N 3.45Å
374	S	79.1	Confident	86.3	Confident	69 Å²	69	67.3 Å²	67.3	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-62.9	-35.8	176.5	-65.3	0	0	0	0	112.8	E370 V371 E372 V376 Y377 L378	E370-S374 VanDerWaalsContact O-CB 3.24Å; E370-S374 WeakPolarHBondContact O-CB 3.48Å; E370-S374 PolarHBondContact O-N 2.91Å; E370-S374 PolarHBondContact O-OG 3.39Å; V371-S374 WeakPolarHBondContact O-CB 3.25Å; V371-S374 PolarHBondContact O-N 3.14Å; E372-S374 VanDerWaalsContact C-N 3.31Å; E372-S374 PolarHBondContact O-N 2.75Å; S374-V376 VanDerWaalsContact C-N 3.28Å; S374-V376 PolarHBondContact O-N 3.01Å; S374-Y377 PolarHBondContact O-N 2.84Å; S374-L378 WeakPolarHBondContact O-CB 3.41Å; S374-L378 PolarHBondContact O-N 3.02Å
375	Y	86.8	Confident	86.7	Confident	153 Å²	153	61.5 Å²	61.5	60%	0.6	32%	0.322	S	S	*	.	H	α-helix	trans	-62.3	-35.9	174.1	-67.2	-42.7	0	0	0	112.6	V371 E372 T373 L378 A379	V371-Y375 HydrophobicContact CG1-CD2 4.39Å; V371-Y375 HydrophobicContact CG1-CE2 3.65Å; V371-Y375 WeakPolarHBondContact O-CD2 3.48Å; V371-Y375 PolarHBondContact O-N 2.76Å; V371-Y375 VanDerWaalsContact O-N 3.1Å; E372-Y375 PolarHBondContact O-N 3.14Å; T373-Y375 VanDerWaalsContact C-N 3.32Å; T373-Y375 PolarHBondContact O-N 2.92Å; Y375-L378 PolarHBondContact O-N 3.25Å; Y375-A379 VanDerWaalsContact O-CB 3.31Å; Y375-A379 WeakPolarHBondContact O-CB 3.12Å; Y375-A379 PolarHBondContact O-N 3.25Å
376	V	90.7	Very high	87.2	Confident	19 Å²	19	65.2 Å²	65.2	12%	0.115	33%	0.334	C	S	.	.	H	α-helix	trans	-64.7	-45.4	175.6	179.3	0	0	0	0	111.1	L358 W368 E372 T373 S374 L378 A379 A380 L438 I441	L358-V376 HydrophobicContact CD2-CG1 4.05Å; W368-V376 HydrophobicContact CH2-CG2 4.16Å; W368-V376 HydrophobicContact CZ3-CG2 3.67Å; E372-V376 PolarHBondContact O-N 3.4Å; T373-V376 WeakPolarHBondContact O-CB 3.38Å; T373-V376 PolarHBondContact O-N 2.64Å; T373-V376 VanDerWaalsContact O-N 3.14Å; S374-V376 VanDerWaalsContact C-N 3.28Å; S374-V376 PolarHBondContact O-N 3.01Å; V376-L378 PolarHBondContact O-N 3.47Å; V376-A379 PolarHBondContact O-N 2.97Å; V376-A380 VanDerWaalsContact O-CB 3.24Å; V376-A380 WeakPolarHBondContact O-CB 3.36Å; V376-A380 PolarHBondContact O-N 3.42Å; V376-L438 HydrophobicContact CG1-CD2 4.01Å; V376-L438 HydrophobicContact CG2-CD2 3.72Å; V376-I441 HydrophobicContact CG1-CD1 4.39Å; V376-I441 HydrophobicContact CG1-CG2 4.39Å
377	Y	86.6	Confident	87.5	Confident	69 Å²	69	64.9 Å²	64.9	27%	0.271	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-38.1	177	-70.2	-62.7	0	0	0	113.1	E355 L358 P359 T373 S374 A380 S381	E355-Y377 HydrophobicContact CG-CE1 4.03Å; E355-Y377 PolarHBondContact O-OH 3.43Å; L358-Y377 HydrophobicContact CD2-CE1 4.06Å; P359-Y377 WeakPolarHBondContact CD-OH 3.47Å; P359-Y377 HydrophobicContact CG-CE2 4.21Å; P359-Y377 VanDerWaalsContact CG-OH 3.26Å; P359-Y377 WeakPolarHBondContact CG-OH 3.26Å; T373-Y377 HydrophobicContact CG2-CD2 4.07Å; T373-Y377 HydrophobicContact CG2-CE2 3.55Å; T373-Y377 VanDerWaalsContact O-CD2 3.31Å; T373-Y377 WeakPolarHBondContact O-CD2 3.46Å; T373-Y377 PolarHBondContact O-N 3.45Å; S374-Y377 PolarHBondContact O-N 2.84Å; Y377-A380 PolarHBondContact O-N 3.04Å; Y377-S381 WeakPolarHBondContact O-CB 3.33Å; Y377-S381 PolarHBondContact O-N 2.79Å; Y377-S381 PolarHBondContact O-OG 2.88Å
378	L	86	Confident	87.7	Confident	69 Å²	69	58.1 Å²	58.1	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-49.1	175.5	-179.5	62.8	0	0	0	111	S374 Y375 V376 A380 S381 I382	S374-L378 WeakPolarHBondContact O-CB 3.41Å; S374-L378 PolarHBondContact O-N 3.02Å; Y375-L378 PolarHBondContact O-N 3.25Å; V376-L378 PolarHBondContact O-N 3.47Å; L378-A380 VanDerWaalsContact C-N 3.34Å; L378-A380 PolarHBondContact O-N 3.36Å; L378-S381 PolarHBondContact O-N 2.64Å; L378-I382 HydrophobicContact CD1-CD1 4.21Å; L378-I382 HydrophobicContact CG-CD1 4.12Å; L378-I382 WeakPolarHBondContact O-CG1 3.32Å; L378-I382 PolarHBondContact O-N 2.87Å
379	A	91.2	Very high	88	Confident	60 Å²	60	60.2 Å²	60.2	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-61.4	-42.5	177.2	0	0	0	0	0	111.8	Y375 V376 I382 L383	Y375-A379 VanDerWaalsContact O-CB 3.31Å; Y375-A379 WeakPolarHBondContact O-CB 3.12Å; Y375-A379 PolarHBondContact O-N 3.25Å; V376-A379 PolarHBondContact O-N 2.97Å; A379-I382 PolarHBondContact O-N 3.24Å; A379-L383 WeakPolarHBondContact O-CB 3.35Å; A379-L383 PolarHBondContact O-N 3.08Å
380	A	92.4	Very high	88.7	Confident	17 Å²	17	60.4 Å²	60.4	14%	0.14	31%	0.313	C	S	.	.	H	α-helix	trans	-59.5	-47.3	174.2	0	0	0	0	0	111.5	V376 Y377 L378 I382 L383 I384 V445	V376-A380 VanDerWaalsContact O-CB 3.24Å; V376-A380 WeakPolarHBondContact O-CB 3.36Å; V376-A380 PolarHBondContact O-N 3.42Å; Y377-A380 PolarHBondContact O-N 3.04Å; L378-A380 VanDerWaalsContact C-N 3.34Å; L378-A380 PolarHBondContact O-N 3.36Å; A380-I382 PolarHBondContact O-N 3.46Å; A380-L383 PolarHBondContact O-N 3.07Å; A380-I384 WeakPolarHBondContact O-CG1 3.5Å; A380-I384 PolarHBondContact O-N 3.15Å; A380-V445 HydrophobicContact CB-CG2 3.75Å
381	S	89.2	Confident	89.6	Confident	19 Å²	19	53.1 Å²	53.1	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-62.6	-41.5	-179.6	-59.5	0	0	0	0	112.4	Y377 L378 I384 I385	Y377-S381 WeakPolarHBondContact O-CB 3.33Å; Y377-S381 PolarHBondContact O-N 2.79Å; Y377-S381 PolarHBondContact O-OG 2.88Å; L378-S381 PolarHBondContact O-N 2.64Å; S381-I384 PolarHBondContact O-N 3.45Å; S381-I385 PolarHBondContact O-N 3.25Å
382	I	92.2	Very high	90.4	Very high	73 Å²	73	56.3 Å²	56.3	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-44.9	174	-69	168.2	0	0	0	110.6	I223 L378 A379 A380 I384 I385 F386	I223-I382 HydrophobicContact CD1-CG1 4.12Å; L378-I382 HydrophobicContact CD1-CD1 4.21Å; L378-I382 HydrophobicContact CG-CD1 4.12Å; L378-I382 WeakPolarHBondContact O-CG1 3.32Å; L378-I382 PolarHBondContact O-N 2.87Å; A379-I382 PolarHBondContact O-N 3.24Å; A380-I382 PolarHBondContact O-N 3.46Å; I382-I384 VanDerWaalsContact C-N 3.32Å; I382-I384 PolarHBondContact O-N 3.21Å; I382-I385 WeakPolarHBondContact O-CB 3.46Å; I382-I385 PolarHBondContact O-N 3.31Å; I382-I385 VanDerWaalsContact O-N 3.16Å; I382-F386 HydrophobicContact CG2-CD2 4.06Å; I382-F386 HydrophobicContact CG2-CE2 3.57Å; I382-F386 VanDerWaalsContact O-CD2 3.24Å; I382-F386 WeakPolarHBondContact O-CD2 3.35Å; I382-F386 PolarHBondContact O-N 3.29Å
383	L	94.5	Very high	90.9	Very high	56 Å²	56	56.6 Å²	56.6	29%	0.293	29%	0.286	S	S	.	.	H	α-helix	trans	-60.9	-40.8	177.2	-179.2	59.8	0	0	0	111.6	A379 A380 I385 F386 V387 A442 V445 L446	A379-L383 WeakPolarHBondContact O-CB 3.35Å; A379-L383 PolarHBondContact O-N 3.08Å; A380-L383 PolarHBondContact O-N 3.07Å; L383-I385 VanDerWaalsContact C-N 3.27Å; L383-I385 PolarHBondContact O-N 2.96Å; L383-F386 PolarHBondContact O-N 2.92Å; L383-F386 VanDerWaalsContact O-N 3.13Å; L383-V387 HydrophobicContact CD1-CG2 4.44Å; L383-V387 HydrophobicContact CG-CG2 4.4Å; L383-V387 VanDerWaalsContact O-CG2 3.31Å; L383-V387 WeakPolarHBondContact O-CG2 3.48Å; L383-V387 PolarHBondContact O-N 3.27Å; L383-A442 HydrophobicContact CD2-CB 4.48Å; L383-V445 HydrophobicContact CB-CG1 3.87Å; L383-V445 HydrophobicContact CD2-CB 4.16Å; L383-V445 HydrophobicContact CD2-CG1 3.6Å; L383-V445 HydrophobicContact CG-CG1 3.69Å; L383-L446 HydrophobicContact CD1-CD2 4.24Å; L383-L446 HydrophobicContact CD2-CD2 4.43Å; L383-L446 HydrophobicContact CG-CD2 4.46Å
384	I	93.9	Very high	91.5	Very high	13 Å²	13	58.1 Å²	58.1	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-57.8	-40.6	176	-66.4	171.1	0	0	0	111.1	Q219 A380 S381 I382 F386 V387 V388 V445 P449	Q219-I384 HydrophobicContact CB-CG2 4.36Å; Q219-I384 HydrophobicContact CG-CB 4.43Å; Q219-I384 HydrophobicContact CG-CG2 3.54Å; A380-I384 WeakPolarHBondContact O-CG1 3.5Å; A380-I384 PolarHBondContact O-N 3.15Å; S381-I384 PolarHBondContact O-N 3.45Å; I382-I384 VanDerWaalsContact C-N 3.32Å; I382-I384 PolarHBondContact O-N 3.21Å; I384-F386 VanDerWaalsContact C-N 3.34Å; I384-F386 PolarHBondContact O-N 3.15Å; I384-V387 PolarHBondContact O-N 2.9Å; I384-V388 HydrophobicContact CG2-CG2 3.96Å; I384-V388 WeakPolarHBondContact O-CB 3.26Å; I384-V388 VanDerWaalsContact O-CG2 3.26Å; I384-V388 WeakPolarHBondContact O-CG2 3.42Å; I384-V388 PolarHBondContact O-N 3.35Å; I384-V445 HydrophobicContact CD1-CG1 4.37Å; I384-V445 HydrophobicContact CG1-CG1 3.53Å; I384-P449 HydrophobicContact CG2-CG 3.76Å
385	I	92.8	Very high	92.1	Very high	36 Å²	36	56.3 Å²	56.3	19%	0.185	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-46.9	177.2	-70.4	-178.6	0	0	0	110.9	L216 Q219 I220 I223 S381 I382 L383 V387 V388 I389	L216-I385 HydrophobicContact CD1-CB 4.35Å; L216-I385 HydrophobicContact CD1-CG1 4.15Å; L216-I385 HydrophobicContact CD1-CG2 3.95Å; Q219-I385 HydrophobicContact CB-CG1 4.24Å; I220-I385 HydrophobicContact CG1-CD1 3.97Å; I223-I385 HydrophobicContact CD1-CD1 3.3Å; I223-I385 HydrophobicContact CD1-CG1 4.27Å; S381-I385 PolarHBondContact O-N 3.25Å; I382-I385 WeakPolarHBondContact O-CB 3.46Å; I382-I385 PolarHBondContact O-N 3.31Å; I382-I385 VanDerWaalsContact O-N 3.16Å; L383-I385 VanDerWaalsContact C-N 3.27Å; L383-I385 PolarHBondContact O-N 2.96Å; I385-V387 VanDerWaalsContact C-N 3.32Å; I385-V387 PolarHBondContact O-N 3.22Å; I385-V388 PolarHBondContact O-N 3.21Å; I385-I389 HydrophobicContact CG2-CD1 3.99Å; I385-I389 WeakPolarHBondContact O-CG1 3.47Å; I385-I389 PolarHBondContact O-N 2.97Å
386	F	95.1	Very high	92.3	Very high	132 Å²	132	55.7 Å²	55.7	58%	0.579	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-41.4	176.3	-70.3	-67.3	0	0	0	112.1	I382 L383 I384 I389 L390	I382-F386 HydrophobicContact CG2-CD2 4.06Å; I382-F386 HydrophobicContact CG2-CE2 3.57Å; I382-F386 VanDerWaalsContact O-CD2 3.24Å; I382-F386 WeakPolarHBondContact O-CD2 3.35Å; I382-F386 PolarHBondContact O-N 3.29Å; L383-F386 PolarHBondContact O-N 2.92Å; L383-F386 VanDerWaalsContact O-N 3.13Å; I384-F386 VanDerWaalsContact C-N 3.34Å; I384-F386 PolarHBondContact O-N 3.15Å; F386-I389 PolarHBondContact O-N 2.73Å; F386-L390 WeakPolarHBondContact O-CB 3.46Å; F386-L390 PolarHBondContact O-N 3.02Å
387	V	96.1	Very high	92.4	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-44.8	176.8	177.2	0	0	0	0	111	L383 I384 I385 I389 L390 L391 L446 P449 F450	L383-V387 HydrophobicContact CD1-CG2 4.44Å; L383-V387 HydrophobicContact CG-CG2 4.4Å; L383-V387 VanDerWaalsContact O-CG2 3.31Å; L383-V387 WeakPolarHBondContact O-CG2 3.48Å; L383-V387 PolarHBondContact O-N 3.27Å; I384-V387 PolarHBondContact O-N 2.9Å; I385-V387 VanDerWaalsContact C-N 3.32Å; I385-V387 PolarHBondContact O-N 3.22Å; V387-I389 VanDerWaalsContact C-N 3.31Å; V387-I389 PolarHBondContact O-N 3.02Å; V387-L390 CarbonylContact O-C 3.22Å; V387-L390 WeakPolarHBondContact O-CA 3.33Å; V387-L390 WeakPolarHBondContact O-CB 3.25Å; V387-L390 PolarHBondContact O-N 2.73Å; V387-L390 VanDerWaalsContact O-N 3.1Å; V387-L391 HydrophobicContact CG1-CD2 4.5Å; V387-L391 VanDerWaalsContact O-CG 3.3Å; V387-L391 WeakPolarHBondContact O-CG 2.87Å; V387-L391 PolarHBondContact O-N 3.45Å; V387-L446 HydrophobicContact CG2-CD2 3.48Å; V387-L446 VanDerWaalsContact CG2-CD2 3.48Å; V387-P449 HydrophobicContact CB-CG 4.22Å; V387-P449 HydrophobicContact CG1-CB 3.87Å; V387-P449 HydrophobicContact CG1-CG 3.75Å; V387-F450 HydrophobicContact CG1-CD2 4.2Å; V387-F450 HydrophobicContact CG1-CE2 3.88Å
388	V	93.5	Very high	92.8	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-37.2	178.8	173.9	0	0	0	0	111.5	I212 L216 I384 I385 L391 R392 P449	I212-V388 HydrophobicContact CG2-CG1 3.71Å; I212-V388 WeakPolarHBondContact O-CG1 3.33Å; L216-V388 HydrophobicContact CB-CG1 3.72Å; L216-V388 HydrophobicContact CD1-CB 4.4Å; L216-V388 HydrophobicContact CD1-CG1 4.15Å; L216-V388 HydrophobicContact CG-CG1 4.42Å; I384-V388 HydrophobicContact CG2-CG2 3.96Å; I384-V388 WeakPolarHBondContact O-CB 3.26Å; I384-V388 VanDerWaalsContact O-CG2 3.26Å; I384-V388 WeakPolarHBondContact O-CG2 3.42Å; I384-V388 PolarHBondContact O-N 3.35Å; I385-V388 PolarHBondContact O-N 3.21Å; V388-L391 WeakPolarHBondContact O-CB 3.32Å; V388-L391 PolarHBondContact O-N 3.25Å; V388-R392 PolarHBondContact O-N 3.3Å; V388-P449 HydrophobicContact CG2-CB 3.92Å; V388-P449 HydrophobicContact CG2-CG 4.38Å
389	I	92.1	Very high	93.1	Very high	83 Å²	83	64.9 Å²	64.9	43%	0.426	32%	0.322	S	S	.	.	H	α-helix	trans	-64.7	-44	171.8	-66.3	166.5	0	0	0	110.5	I385 F386 V387 L391 R392 I393	I385-I389 HydrophobicContact CG2-CD1 3.99Å; I385-I389 WeakPolarHBondContact O-CG1 3.47Å; I385-I389 PolarHBondContact O-N 2.97Å; F386-I389 PolarHBondContact O-N 2.73Å; V387-I389 VanDerWaalsContact C-N 3.31Å; V387-I389 PolarHBondContact O-N 3.02Å; I389-L391 VanDerWaalsContact C-N 3.31Å; I389-L391 PolarHBondContact O-N 3.38Å; I389-R392 WeakPolarHBondContact O-CB 3.34Å; I389-R392 PolarHBondContact O-N 3.36Å; I389-I393 HydrophobicContact CG2-CD1 4.48Å; I389-I393 PolarHBondContact O-N 3.45Å
390	L	95.4	Very high	93.3	Very high	78 Å²	78	62.6 Å²	62.6	41%	0.408	30%	0.301	S	S	.	.	H	α-helix	trans	-59.5	-40.9	174.6	174.7	64.9	0	0	0	111.6	F386 V387 R392 I393 L394	F386-L390 WeakPolarHBondContact O-CB 3.46Å; F386-L390 PolarHBondContact O-N 3.02Å; V387-L390 CarbonylContact O-C 3.22Å; V387-L390 WeakPolarHBondContact O-CA 3.33Å; V387-L390 WeakPolarHBondContact O-CB 3.25Å; V387-L390 PolarHBondContact O-N 2.73Å; V387-L390 VanDerWaalsContact O-N 3.1Å; L390-R392 VanDerWaalsContact C-N 3.27Å; L390-R392 PolarHBondContact O-N 3.01Å; L390-I393 PolarHBondContact O-N 2.87Å; L390-I393 VanDerWaalsContact O-N 3.09Å; L390-L394 HydrophobicContact CD1-CD1 4.03Å; L390-L394 HydrophobicContact CD1-CD2 4.33Å; L390-L394 HydrophobicContact CD1-CG 3.88Å; L390-L394 HydrophobicContact CD2-CD1 4.28Å; L390-L394 HydrophobicContact CG-CD1 3.8Å; L390-L394 HydrophobicContact CG-CG 4.1Å; L390-L394 WeakPolarHBondContact O-CG 3.46Å; L390-L394 PolarHBondContact O-N 3.18Å
391	L	93.8	Very high	93.5	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-55.6	-45.4	175.2	-65.1	-165.9	0	0	0	111.5	I212 V387 V388 I389 I393 L394 N395 P449 F450 A453 Y454	I212-L391 HydrophobicContact CD1-CB 3.98Å; I212-L391 HydrophobicContact CG1-CB 4.45Å; V387-L391 HydrophobicContact CG1-CD2 4.5Å; V387-L391 VanDerWaalsContact O-CG 3.3Å; V387-L391 WeakPolarHBondContact O-CG 2.87Å; V387-L391 PolarHBondContact O-N 3.45Å; V388-L391 WeakPolarHBondContact O-CB 3.32Å; V388-L391 PolarHBondContact O-N 3.25Å; I389-L391 VanDerWaalsContact C-N 3.31Å; I389-L391 PolarHBondContact O-N 3.38Å; L391-I393 PolarHBondContact O-N 3.25Å; L391-L394 PolarHBondContact O-N 2.66Å; L391-N395 VanDerWaalsContact O-CB 3.26Å; L391-N395 WeakPolarHBondContact O-CB 3.43Å; L391-N395 PolarHBondContact O-N 2.92Å; L391-P449 HydrophobicContact CD1-CB 3.82Å; L391-P449 WeakPolarHBondContact CD1-O 3.43Å; L391-F450 HydrophobicContact CD2-CB 4.41Å; L391-F450 HydrophobicContact CD2-CD1 3.44Å; L391-F450 VanDerWaalsContact CD2-CD1 3.44Å; L391-F450 HydrophobicContact CD2-CD2 3.39Å; L391-F450 HydrophobicContact CD2-CE1 3.34Å; L391-F450 HydrophobicContact CD2-CE2 3.28Å; L391-F450 HydrophobicContact CD2-CG 3.47Å; L391-F450 VanDerWaalsContact CD2-CG 3.47Å; L391-F450 HydrophobicContact CD2-CZ 3.26Å; L391-A453 HydrophobicContact CD1-CB 3.89Å; L391-Y454 WeakPolarHBondContact CB-OH 3.38Å; L391-Y454 HydrophobicContact CD1-CE2 4.18Å; L391-Y454 HydrophobicContact CD2-CE2 3.8Å; L391-Y454 HydrophobicContact CG-CE2 4.39Å; L391-Y454 PolarHBondContact O-OH 3.45Å
392	R	91.3	Very high	93.9	Very high	143 Å²	143	66.3 Å²	66.3	54%	0.54	32%	0.315	S	S	.	.	H	α-helix	trans	-59.7	-38.2	179	-172.8	174.6	177.5	-121.6	-0.6	111.8	I212 V388 I389 L390	I212-R392 HydrophobicContact CG2-CB 4.22Å; V388-R392 PolarHBondContact O-N 3.3Å; I389-R392 WeakPolarHBondContact O-CB 3.34Å; I389-R392 PolarHBondContact O-N 3.36Å; L390-R392 VanDerWaalsContact C-N 3.27Å; L390-R392 PolarHBondContact O-N 3.01Å
393	I	93.9	Very high	94.1	Very high	85 Å²	85	63.2 Å²	63.2	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-70.4	-50.2	176.9	-61.9	169.6	0	0	0	109.9	I389 L390 L391 N395 Q396 F397	I389-I393 HydrophobicContact CG2-CD1 4.48Å; I389-I393 PolarHBondContact O-N 3.45Å; L390-I393 PolarHBondContact O-N 2.87Å; L390-I393 VanDerWaalsContact O-N 3.09Å; L391-I393 PolarHBondContact O-N 3.25Å; I393-N395 VanDerWaalsContact C-N 3.31Å; I393-N395 PolarHBondContact O-N 3.27Å; I393-Q396 WeakPolarHBondContact O-CB 3.36Å; I393-Q396 PolarHBondContact O-N 3.32Å; I393-Q396 VanDerWaalsContact O-N 3.1Å; I393-F397 HydrophobicContact CG2-CE2 4.02Å; I393-F397 VanDerWaalsContact O-CD2 3.24Å; I393-F397 WeakPolarHBondContact O-CD2 3.05Å; I393-F397 WeakPolarHBondContact O-CE2 3.46Å
394	L	94.8	Very high	94.3	Very high	41 Å²	41	60.5 Å²	60.5	22%	0.215	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-34.3	-178	-67.9	177.9	0	0	0	113.3	L390 L391 Q396 F397 Y398 L403 F450	L390-L394 HydrophobicContact CD1-CD1 4.03Å; L390-L394 HydrophobicContact CD1-CD2 4.33Å; L390-L394 HydrophobicContact CD1-CG 3.88Å; L390-L394 HydrophobicContact CD2-CD1 4.28Å; L390-L394 HydrophobicContact CG-CD1 3.8Å; L390-L394 HydrophobicContact CG-CG 4.1Å; L390-L394 WeakPolarHBondContact O-CG 3.46Å; L390-L394 PolarHBondContact O-N 3.18Å; L391-L394 PolarHBondContact O-N 2.66Å; L394-Q396 PolarHBondContact O-N 3.35Å; L394-Q396 VanDerWaalsContact O-N 3.13Å; L394-F397 PolarHBondContact O-N 3.21Å; L394-Y398 HydrophobicContact CB-CD2 4.47Å; L394-Y398 HydrophobicContact CD2-CD2 4.32Å; L394-Y398 HydrophobicContact CD2-CE2 4.15Å; L394-Y398 PolarHBondContact O-N 2.95Å; L394-L403 HydrophobicContact CB-CD1 4.27Å; L394-L403 HydrophobicContact CB-CD2 3.98Å; L394-L403 HydrophobicContact CD1-CD2 4.37Å; L394-F450 HydrophobicContact CD1-CE1 3.93Å; L394-F450 HydrophobicContact CD1-CZ 3.82Å
395	N	92.1	Very high	94.5	Very high	30 Å²	30	61.8 Å²	61.8	16%	0.16	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.6	175.9	-174.7	51	0	0	0	113.2	I212 L391 I393 F397 D400 L403 Y454	I212-N395 HydrophobicContact CD1-CB 4.5Å; L391-N395 VanDerWaalsContact O-CB 3.26Å; L391-N395 WeakPolarHBondContact O-CB 3.43Å; L391-N395 PolarHBondContact O-N 2.92Å; I393-N395 VanDerWaalsContact C-N 3.31Å; I393-N395 PolarHBondContact O-N 3.27Å; N395-F397 VanDerWaalsContact C-N 3.32Å; N395-D400 PolarHBondContact OD1-OD1 3.5Å; N395-L403 HydrophobicContact CB-CD1 4.42Å; N395-Y454 HydrophobicContact CB-CE1 4.32Å
396	Q	90	Very high	94.7	Very high	140 Å²	140	62.3 Å²	62.3	65%	0.654	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-23.5	173.7	-59.8	-178.7	-8.6	0	0	112.5	I393 L394	I393-Q396 WeakPolarHBondContact O-CB 3.36Å; I393-Q396 PolarHBondContact O-N 3.32Å; I393-Q396 VanDerWaalsContact O-N 3.1Å; L394-Q396 PolarHBondContact O-N 3.35Å; L394-Q396 VanDerWaalsContact O-N 3.13Å
397	F	93.1	Very high	94.9	Very high	143 Å²	143	56 Å²	56	63%	0.627	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-29.6	-173.3	-58.7	-74.5	0	0	0	113	I393 L394 N395	I393-F397 HydrophobicContact CG2-CE2 4.02Å; I393-F397 VanDerWaalsContact O-CD2 3.24Å; I393-F397 WeakPolarHBondContact O-CD2 3.05Å; I393-F397 WeakPolarHBondContact O-CE2 3.46Å; L394-F397 PolarHBondContact O-N 3.21Å; N395-F397 VanDerWaalsContact C-N 3.32Å
398	Y	94.7	Very high	95	Very high	128 Å²	128	56.1 Å²	56.1	50%	0.502	27%	0.274	S	S	.	.	S	Bend	trans	-126	148.7	-173.4	-58.7	-78.1	0	0	0	111.7	L394 V402 L403	L394-Y398 HydrophobicContact CB-CD2 4.47Å; L394-Y398 HydrophobicContact CD2-CD2 4.32Å; L394-Y398 HydrophobicContact CD2-CE2 4.15Å; L394-Y398 PolarHBondContact O-N 2.95Å; Y398-V402 HydrophobicContact CD1-CG1 4.38Å; Y398-L403 HydrophobicContact CD2-CD2 4.12Å; Y398-L403 HydrophobicContact CG-CD2 4.18Å
399	T	94	Very high	95.2	Very high	79 Å²	79	59.1 Å²	59.1	49%	0.485	29%	0.292	S	S	.	.			trans	-74.9	149.4	176.5	61.4	0	0	0	0	111.6	R401 V402 L403	T399-R401 PolarHBondContact O-N 3Å; T399-R401 WeakPolarHBondContact OG1-CG 3.08Å; T399-V402 PolarHBondContact O-N 3.45Å; T399-V402 WeakPolarHBondContact OG1-CG2 3.41Å; T399-L403 PolarHBondContact O-N 3.49Å
400	D	94.6	Very high	95.5	Very high	13 Å²	13	57.1 Å²	57.1	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-43.5	-44.8	178.3	-64.6	12	0	0	0	114	T208 N395 V402 L403 L404 Y454 S457 L458 K461	T208-D400 PolarHBondContact OG1-OD1 3.16Å; T208-D400 PolarHBondContact OG1-OD2 3.45Å; T208-D400 VanDerWaalsContact OG1-OD2 3.07Å; N395-D400 PolarHBondContact OD1-OD1 3.5Å; D400-V402 PolarHBondContact O-N 2.96Å; D400-L403 PolarHBondContact O-N 2.83Å; D400-L404 VanDerWaalsContact O-CB 3.29Å; D400-L404 WeakPolarHBondContact O-CB 3.31Å; D400-L404 PolarHBondContact O-N 3Å; D400-Y454 HydrophobicContact CB-CD1 3.99Å; D400-S457 WeakPolarHBondContact OD2-CB 3.14Å; D400-S457 PolarHBondContact OD2-OG 2.92Å; D400-L458 HydrophobicContact CB-CD1 4.07Å; D400-L458 HydrophobicContact CB-CD2 3.99Å; D400-L458 HydrophobicContact CB-CG 3.75Å; D400-K461 IonicContact OD1-NZ 3.65Å; D400-K461 PolarHBondContact OD1-NZ 3.49Å; D400-K461 WeakPolarHBondContact OD2-CE 3.42Å; D400-K461 IonicContact OD2-NZ 2.69Å; D400-K461 PolarHBondContact OD2-NZ 3.44Å
401	R	96.3	Very high	95.6	Very high	57 Å²	57	53.5 Å²	53.5	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-37.8	-178.4	61.4	171.4	-175	165.6	-3.6	113.9	T399 L405 L458 F519 F522	T399-R401 PolarHBondContact O-N 3Å; T399-R401 WeakPolarHBondContact OG1-CG 3.08Å; R401-L405 WeakPolarHBondContact O-CB 3.41Å; R401-L405 PolarHBondContact O-N 2.94Å; R401-L458 HydrophobicContact CB-CD1 4.29Å; R401-F519 HydrophobicContact CB-CE2 3.91Å; R401-F519 HydrophobicContact CB-CZ 4.04Å; R401-F519 HydrophobicContact CG-CE1 4.18Å; R401-F519 HydrophobicContact CG-CE2 3.98Å; R401-F519 HydrophobicContact CG-CZ 3.57Å; R401-F519 PolarHBondContact NH1-O 3.43Å; R401-F519 WeakPolarHBondContact O-CE2 3.22Å; R401-F522 HydrophobicContact CB-CB 3.99Å
402	V	96.9	Very high	95.8	Very high	57 Å²	57	54.8 Å²	54.8	35%	0.345	27%	0.273	S	S	.	.	H	α-helix	trans	-68.4	-45.3	179.2	173.9	0	0	0	0	108.9	Y398 T399 D400 L405 A406 F519	Y398-V402 HydrophobicContact CD1-CG1 4.38Å; T399-V402 PolarHBondContact O-N 3.45Å; T399-V402 WeakPolarHBondContact OG1-CG2 3.41Å; D400-V402 PolarHBondContact O-N 2.96Å; V402-L405 PolarHBondContact O-N 3.49Å; V402-A406 WeakPolarHBondContact O-CB 3.4Å; V402-A406 PolarHBondContact O-N 3.13Å; V402-F519 HydrophobicContact CB-CZ 4.48Å; V402-F519 HydrophobicContact CG2-CE1 4.44Å; V402-F519 HydrophobicContact CG2-CZ 3.74Å
403	L	97.3	Very high	96.2	Very high	7 Å²	7	52.2 Å²	52.2	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-69.3	-35.6	179.7	-61.3	173.6	0	0	0	111.7	L394 N395 Y398 T399 D400 A406 G407 F450 Y454	L394-L403 HydrophobicContact CB-CD1 4.27Å; L394-L403 HydrophobicContact CB-CD2 3.98Å; L394-L403 HydrophobicContact CD1-CD2 4.37Å; N395-L403 HydrophobicContact CB-CD1 4.42Å; Y398-L403 HydrophobicContact CD2-CD2 4.12Å; Y398-L403 HydrophobicContact CG-CD2 4.18Å; T399-L403 PolarHBondContact O-N 3.49Å; D400-L403 PolarHBondContact O-N 2.83Å; L403-A406 PolarHBondContact O-N 3.45Å; L403-G407 PolarHBondContact O-N 3.32Å; L403-F450 HydrophobicContact CB-CD1 4.18Å; L403-F450 HydrophobicContact CD2-CE1 4.2Å; L403-F450 WeakPolarHBondContact O-CD1 3.17Å; L403-Y454 HydrophobicContact CB-CD1 4.24Å; L403-Y454 HydrophobicContact CB-CD2 3.52Å; L403-Y454 HydrophobicContact CB-CE1 4.09Å; L403-Y454 HydrophobicContact CB-CE2 3.38Å; L403-Y454 HydrophobicContact CB-CG 3.99Å; L403-Y454 HydrophobicContact CD1-CD1 4.47Å; L403-Y454 HydrophobicContact CD1-CE1 3.63Å; L403-Y454 HydrophobicContact CD1-CE2 3.96Å; L403-Y454 VanDerWaalsContact CD1-OH 3.28Å; L403-Y454 WeakPolarHBondContact CD1-OH 3.17Å; L403-Y454 HydrophobicContact CG-CE2 4.25Å
404	L	98	Very high	96.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-51	171.2	175.8	58.1	0	0	0	111.2	L340 V343 D400 A406 G407 L408 L458	L340-L404 HydrophobicContact CD2-CD2 3.95Å; V343-L404 HydrophobicContact CG1-CD1 4.08Å; D400-L404 VanDerWaalsContact O-CB 3.29Å; D400-L404 WeakPolarHBondContact O-CB 3.31Å; D400-L404 PolarHBondContact O-N 3Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.1Å; L404-G407 PolarHBondContact O-N 2.87Å; L404-L408 HydrophobicContact CD1-CD1 4.1Å; L404-L408 HydrophobicContact CD1-CG 4.14Å; L404-L408 HydrophobicContact CG-CD1 3.99Å; L404-L408 HydrophobicContact CG-CG 4.46Å; L404-L408 WeakPolarHBondContact O-CG 3.31Å; L404-L408 PolarHBondContact O-N 3.3Å; L404-L458 HydrophobicContact CB-CD1 4.23Å; L404-L458 HydrophobicContact CD2-CD1 3.6Å
405	L	98.2	Very high	96.5	Very high	40 Å²	40	46.2 Å²	46.2	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-40.9	179.7	-179.1	61.4	0	0	0	111.4	R401 V402 G407 L408 V409 T512 V515 A516 F519	R401-L405 WeakPolarHBondContact O-CB 3.41Å; R401-L405 PolarHBondContact O-N 2.94Å; V402-L405 PolarHBondContact O-N 3.49Å; L405-G407 PolarHBondContact O-N 3.28Å; L405-L408 PolarHBondContact O-N 3.29Å; L405-V409 HydrophobicContact CD1-CG2 4.26Å; L405-V409 HydrophobicContact CG-CG2 4.49Å; L405-V409 WeakPolarHBondContact O-CG2 3.19Å; L405-V409 PolarHBondContact O-N 2.96Å; L405-T512 HydrophobicContact CD1-CG2 4.41Å; L405-V515 HydrophobicContact CD1-CG1 4.41Å; L405-A516 HydrophobicContact CD1-CB 4.01Å; L405-F519 HydrophobicContact CB-CE2 4.14Å; L405-F519 HydrophobicContact CD2-CD2 3.98Å; L405-F519 HydrophobicContact CD2-CE2 3.96Å
406	A	97.9	Very high	96.8	Very high	46 Å²	46	48.9 Å²	48.9	38%	0.38	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-48.9	173.9	0	0	0	0	0	111.4	V402 L403 L404 L408 V409 T410	V402-A406 WeakPolarHBondContact O-CB 3.4Å; V402-A406 PolarHBondContact O-N 3.13Å; L403-A406 PolarHBondContact O-N 3.45Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.1Å; A406-L408 PolarHBondContact O-N 3.22Å; A406-V409 PolarHBondContact O-N 3.35Å; A406-T410 PolarHBondContact O-N 2.97Å; A406-T410 PolarHBondContact O-OG1 2.9Å
407	G	98	Very high	97.2	Very high	1 Å²	1	47 Å²	47	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-44.6	175.4	0	0	0	0	0	113.5	L403 L404 L405 T410 M411	L403-G407 PolarHBondContact O-N 3.32Å; L404-G407 PolarHBondContact O-N 2.87Å; L405-G407 PolarHBondContact O-N 3.28Å; G407-T410 WeakPolarHBondContact O-CB 3.42Å; G407-T410 PolarHBondContact O-N 2.96Å; G407-M411 WeakPolarHBondContact O-CG 3.21Å; G407-M411 PolarHBondContact O-N 2.79Å
408	L	98.4	Very high	97.3	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-44.9	177.4	-76.6	173.1	0	0	0	112.3	V343 L404 L405 A406 M411 V412 T451 T512 V515	V343-L408 HydrophobicContact CG1-CD2 4.11Å; V343-L408 HydrophobicContact CG2-CD1 3.96Å; V343-L408 HydrophobicContact CG2-CD2 4.22Å; L404-L408 HydrophobicContact CD1-CD1 4.1Å; L404-L408 HydrophobicContact CD1-CG 4.14Å; L404-L408 HydrophobicContact CG-CD1 3.99Å; L404-L408 HydrophobicContact CG-CG 4.46Å; L404-L408 WeakPolarHBondContact O-CG 3.31Å; L404-L408 PolarHBondContact O-N 3.3Å; L405-L408 PolarHBondContact O-N 3.29Å; A406-L408 PolarHBondContact O-N 3.22Å; L408-M411 WeakPolarHBondContact O-CB 2.92Å; L408-M411 PolarHBondContact O-N 3.38Å; L408-V412 WeakPolarHBondContact O-CG2 3.16Å; L408-V412 PolarHBondContact O-N 2.91Å; L408-T451 HydrophobicContact CD2-CG2 3.91Å; L408-T451 HydrophobicContact CG-CG2 4.15Å; L408-T512 HydrophobicContact CB-CG2 4.05Å; L408-V515 HydrophobicContact CD1-CB 4.07Å; L408-V515 HydrophobicContact CD1-CG1 4.32Å; L408-V515 HydrophobicContact CD1-CG2 3.93Å
409	V	98.4	Very high	97.3	Very high	64 Å²	64	34.8 Å²	34.8	39%	0.388	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-43.9	175.2	170.7	0	0	0	0	110.9	L405 A406 M411 V412 I413 T512	L405-V409 HydrophobicContact CD1-CG2 4.26Å; L405-V409 HydrophobicContact CG-CG2 4.49Å; L405-V409 WeakPolarHBondContact O-CG2 3.19Å; L405-V409 PolarHBondContact O-N 2.96Å; A406-V409 PolarHBondContact O-N 3.35Å; V409-M411 VanDerWaalsContact C-N 3.27Å; V409-M411 PolarHBondContact O-N 2.82Å; V409-V412 PolarHBondContact O-N 3.41Å; V409-I413 HydrophobicContact CG1-CD1 3.85Å; V409-I413 HydrophobicContact CG1-CG1 4.46Å; V409-I413 VanDerWaalsContact O-CG1 3.32Å; V409-I413 WeakPolarHBondContact O-CG1 3.45Å; V409-I413 PolarHBondContact O-N 3.36Å; V409-T512 HydrophobicContact CG2-CG2 4.23Å
410	T	98.3	Very high	97.4	Very high	41 Å²	41	34.6 Å²	34.6	25%	0.252	19%	0.188	S	C	.	.	H	α-helix	trans	-57.8	-40.5	174.6	-59.3	0	0	0	0	111.9	A406 G407 I413 S414 I443 L446	A406-T410 PolarHBondContact O-N 2.97Å; A406-T410 PolarHBondContact O-OG1 2.9Å; G407-T410 WeakPolarHBondContact O-CB 3.42Å; G407-T410 PolarHBondContact O-N 2.96Å; T410-I413 PolarHBondContact O-N 3.37Å; T410-S414 PolarHBondContact O-N 3.37Å; T410-I443 HydrophobicContact CG2-CG2 3.67Å; T410-I443 WeakPolarHBondContact CG2-O 3.32Å; T410-I443 WeakPolarHBondContact O-CG2 3.42Å; T410-L446 HydrophobicContact CG2-CB 4.35Å
411	M	97.9	Very high	97.3	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-45.2	177.5	-69.2	-72.8	-79.9	0	0	112.2	G407 L408 V409 I413 S414 Y415 I448 T451	G407-M411 WeakPolarHBondContact O-CG 3.21Å; G407-M411 PolarHBondContact O-N 2.79Å; L408-M411 WeakPolarHBondContact O-CB 2.92Å; L408-M411 PolarHBondContact O-N 3.38Å; V409-M411 VanDerWaalsContact C-N 3.27Å; V409-M411 PolarHBondContact O-N 2.82Å; M411-I413 VanDerWaalsContact C-N 3.34Å; M411-I413 PolarHBondContact O-N 3.44Å; M411-S414 WeakPolarHBondContact O-CB 2.96Å; M411-S414 PolarHBondContact O-N 3.3Å; M411-Y415 HydrophobicContact CB-CE2 4.17Å; M411-Y415 HydrophobicContact CE-CE2 3.69Å; M411-Y415 WeakPolarHBondContact CE-OH 3.1Å; M411-Y415 WeakPolarHBondContact O-CD2 3.38Å; M411-Y415 PolarHBondContact O-N 3.05Å; M411-Y415 HydrophobicContact SD-CE2 4.39Å; M411-I448 HydrophobicContact CE-CD1 3.27Å; M411-I448 HydrophobicContact CE-CG1 3.68Å; M411-I448 HydrophobicContact SD-CB 4.5Å; M411-I448 HydrophobicContact SD-CD1 4.07Å; M411-I448 HydrophobicContact SD-CG1 3.79Å; M411-T451 HydrophobicContact CG-CG2 3.91Å
412	V	98.3	Very high	97.1	Very high	27 Å²	27	32 Å²	32	16%	0.164	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-44.1	176	173	0	0	0	0	111.1	L408 V409 S414 Y415 L416 F505 T512	L408-V412 WeakPolarHBondContact O-CG2 3.16Å; L408-V412 PolarHBondContact O-N 2.91Å; V409-V412 PolarHBondContact O-N 3.41Å; V412-S414 PolarHBondContact O-N 2.86Å; V412-Y415 PolarHBondContact O-N 3.01Å; V412-L416 WeakPolarHBondContact O-CB 3.49Å; V412-L416 PolarHBondContact O-N 3.4Å; V412-F505 HydrophobicContact CG1-CD2 4.09Å; V412-F505 HydrophobicContact CG1-CE2 3.64Å; V412-T512 HydrophobicContact CG2-CG2 4.26Å; V412-T512 WeakPolarHBondContact CG2-OG1 3.42Å
413	I	98.4	Very high	96.9	Very high	90 Å²	90	36.5 Å²	36.5	46%	0.462	19%	0.191	S	C	.	.	H	α-helix	trans	-60.1	-46.9	176.1	-68.7	167.4	0	0	0	110.7	V409 T410 M411 Y415 L416 W417 I443	V409-I413 HydrophobicContact CG1-CD1 3.85Å; V409-I413 HydrophobicContact CG1-CG1 4.46Å; V409-I413 VanDerWaalsContact O-CG1 3.32Å; V409-I413 WeakPolarHBondContact O-CG1 3.45Å; V409-I413 PolarHBondContact O-N 3.36Å; T410-I413 PolarHBondContact O-N 3.37Å; M411-I413 VanDerWaalsContact C-N 3.34Å; M411-I413 PolarHBondContact O-N 3.44Å; I413-Y415 PolarHBondContact O-N 2.88Å; I413-L416 PolarHBondContact O-N 3.04Å; I413-W417 VanDerWaalsContact O-CB 3.26Å; I413-W417 WeakPolarHBondContact O-CB 3.23Å; I413-W417 PolarHBondContact O-N 3.35Å; I413-I443 HydrophobicContact CG2-CG2 4.48Å
414	S	98.2	Very high	96.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58	-47	178.5	174.6	0	0	0	0	112.1	T410 M411 V412 W417 L418 G440 H444	T410-S414 PolarHBondContact O-N 3.37Å; M411-S414 WeakPolarHBondContact O-CB 2.96Å; M411-S414 PolarHBondContact O-N 3.3Å; V412-S414 PolarHBondContact O-N 2.86Å; S414-W417 WeakPolarHBondContact O-CB 3.49Å; S414-W417 PolarHBondContact O-N 2.59Å; S414-L418 WeakPolarHBondContact O-CB 3.38Å; S414-L418 WeakPolarHBondContact O-CG 3.27Å; S414-L418 PolarHBondContact O-N 3.41Å; S414-G440 PolarHBondContact OG-O 2.8Å; S414-H444 WeakPolarHBondContact OG-CA 3.45Å; S414-H444 VanDerWaalsContact OG-CB 3.24Å; S414-H444 WeakPolarHBondContact OG-CB 2.99Å; S414-H444 PolarHBondContact OG-N 3.09Å
415	Y	97.6	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-76.4	-31	-175.7	-58.5	-41	0	0	0	113.5	S350 M411 V412 I413 L418 T419 H444 M504 S508	S350-Y415 VanDerWaalsContact CB-CZ 3.43Å; S350-Y415 WeakPolarHBondContact CB-OH 3.18Å; M411-Y415 HydrophobicContact CB-CE2 4.17Å; M411-Y415 HydrophobicContact CE-CE2 3.69Å; M411-Y415 WeakPolarHBondContact CE-OH 3.1Å; M411-Y415 WeakPolarHBondContact O-CD2 3.38Å; M411-Y415 PolarHBondContact O-N 3.05Å; M411-Y415 HydrophobicContact SD-CE2 4.39Å; V412-Y415 PolarHBondContact O-N 3.01Å; I413-Y415 PolarHBondContact O-N 2.88Å; Y415-L418 HydrophobicContact CD1-CD1 4.22Å; Y415-T419 VanDerWaalsContact O-CB 3.27Å; Y415-T419 WeakPolarHBondContact O-CB 3.22Å; Y415-T419 PolarHBondContact O-N 2.99Å; Y415-T419 PolarHBondContact O-OG1 3.44Å; Y415-H444 HydrophobicContact CE1-CB 4.44Å; Y415-H444 AromaticContact CE1-ND1 3.61Å; Y415-H444 AromaticContact CZ-ND1 3.52Å; Y415-H444 PolarHBondContact OH-CE1 2.73Å; Y415-H444 PolarHBondContact OH-ND1 2.69Å; Y415-M504 HydrophobicContact CD1-CB 4.15Å; Y415-M504 HydrophobicContact CD1-CE 3.71Å; Y415-M504 HydrophobicContact CD2-CB 4.1Å; Y415-M504 HydrophobicContact CE1-CB 4.44Å; Y415-M504 HydrophobicContact CE1-CE 3.25Å; Y415-M504 HydrophobicContact CE2-CB 4.33Å; Y415-M504 HydrophobicContact CG-CB 3.99Å; Y415-S508 WeakPolarHBondContact CD2-OG 3.46Å
416	L	97.8	Very high	95.5	Very high	86 Å²	86	43.1 Å²	43.1	45%	0.45	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-48.6	167.7	-178.1	60.1	0	0	0	110.4	V412 I413 L418 T419 V420 F505	V412-L416 WeakPolarHBondContact O-CB 3.49Å; V412-L416 PolarHBondContact O-N 3.4Å; I413-L416 PolarHBondContact O-N 3.04Å; L416-L418 PolarHBondContact O-N 2.95Å; L416-T419 PolarHBondContact O-N 2.9Å; L416-V420 HydrophobicContact CD1-CG2 4.42Å; L416-V420 WeakPolarHBondContact O-CG2 3.4Å; L416-V420 PolarHBondContact O-N 3.16Å; L416-F505 HydrophobicContact CB-CD2 3.79Å; L416-F505 HydrophobicContact CB-CE2 3.75Å; L416-F505 HydrophobicContact CD1-CD2 4.48Å; L416-F505 HydrophobicContact CD1-CE2 4.09Å; L416-F505 HydrophobicContact CD1-CZ 4.15Å; L416-F505 HydrophobicContact CD2-CE2 4.48Å; L416-F505 HydrophobicContact CG-CE2 4.32Å
417	W	98	Very high	95	Very high	99 Å²	99	47.9 Å²	47.9	38%	0.375	25%	0.249	S	C	.	.	H	α-helix	trans	-58.7	-48.2	178.2	179.2	-81.4	0	0	0	112.3	I413 S414 V420 T421 L436 T439 G440	I413-W417 VanDerWaalsContact O-CB 3.26Å; I413-W417 WeakPolarHBondContact O-CB 3.23Å; I413-W417 PolarHBondContact O-N 3.35Å; S414-W417 WeakPolarHBondContact O-CB 3.49Å; S414-W417 PolarHBondContact O-N 2.59Å; W417-V420 PolarHBondContact O-N 2.97Å; W417-T421 PolarHBondContact NE1-OG1 2.99Å; W417-T421 VanDerWaalsContact O-CB 3.25Å; W417-T421 WeakPolarHBondContact O-CB 3.5Å; W417-T421 PolarHBondContact O-N 3.03Å; W417-T421 PolarHBondContact O-OG1 3.24Å; W417-L436 HydrophobicContact CH2-CD2 4.19Å; W417-L436 HydrophobicContact CZ2-CD2 3.59Å; W417-L436 PolarHBondContact NE1-O 3.15Å; W417-T439 HydrophobicContact CZ2-CG2 4.19Å; W417-G440 VanDerWaalsContact CD1-CA 3.44Å
418	L	95.8	Very high	94.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-40.2	178.3	-75.4	167.4	0	0	0	111.6	S414 Y415 L416 T421 V422 T437 I441 F501	S414-L418 WeakPolarHBondContact O-CB 3.38Å; S414-L418 WeakPolarHBondContact O-CG 3.27Å; S414-L418 PolarHBondContact O-N 3.41Å; Y415-L418 HydrophobicContact CD1-CD1 4.22Å; L416-L418 PolarHBondContact O-N 2.95Å; L418-T421 PolarHBondContact O-N 3.42Å; L418-V422 WeakPolarHBondContact O-CB 3.26Å; L418-V422 WeakPolarHBondContact O-CG2 3.33Å; L418-V422 PolarHBondContact O-N 3.45Å; L418-T437 HydrophobicContact CD2-CG2 4.46Å; L418-I441 HydrophobicContact CD2-CG1 4.35Å; L418-F501 HydrophobicContact CB-CB 4.4Å; L418-F501 HydrophobicContact CB-CD1 3.71Å; L418-F501 HydrophobicContact CB-CE1 4.13Å; L418-F501 HydrophobicContact CB-CG 3.97Å; L418-F501 HydrophobicContact CD1-CD1 4.04Å; L418-F501 HydrophobicContact CD1-CE1 3.88Å; L418-F501 HydrophobicContact CG-CD1 4.43Å; L418-F501 HydrophobicContact CG-CE1 4.42Å
419	T	95.3	Very high	94.1	Very high	16 Å²	16	52.8 Å²	52.8	10%	0.098	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-49.2	176.6	-58.4	0	0	0	0	111.1	Y415 L416 Y423 T498 F501 L502	Y415-T419 VanDerWaalsContact O-CB 3.27Å; Y415-T419 WeakPolarHBondContact O-CB 3.22Å; Y415-T419 PolarHBondContact O-N 2.99Å; Y415-T419 PolarHBondContact O-OG1 3.44Å; L416-T419 PolarHBondContact O-N 2.9Å; T419-Y423 VanDerWaalsContact O-CB 3.32Å; T419-Y423 WeakPolarHBondContact O-CB 3.32Å; T419-Y423 PolarHBondContact O-N 3.21Å; T419-T498 HydrophobicContact CG2-CG2 4.07Å; T419-F501 WeakPolarHBondContact OG1-CB 3.47Å; T419-F501 PolarHBondContact OG1-O 2.86Å; T419-L502 HydrophobicContact CG2-CB 4.02Å; T419-L502 HydrophobicContact CG2-CD1 4.28Å; T419-L502 PolarHBondContact OG1-N 3.2Å
420	V	95.4	Very high	93.6	Very high	74 Å²	74	54 Å²	54	45%	0.448	28%	0.282	S	S	.	.	H	α-helix	trans	-65.6	-47	178.9	173.6	0	0	0	0	111.1	L416 W417 V422 Y423 L424	L416-V420 HydrophobicContact CD1-CG2 4.42Å; L416-V420 WeakPolarHBondContact O-CG2 3.4Å; L416-V420 PolarHBondContact O-N 3.16Å; W417-V420 PolarHBondContact O-N 2.97Å; V420-V422 VanDerWaalsContact C-N 3.34Å; V420-V422 PolarHBondContact O-N 2.89Å; V420-Y423 PolarHBondContact O-N 3.44Å; V420-L424 HydrophobicContact CG1-CD1 3.8Å; V420-L424 HydrophobicContact CG1-CG 4.46Å; V420-L424 WeakPolarHBondContact O-CG 3.28Å; V420-L424 PolarHBondContact O-N 3.18Å
421	T	93.8	Very high	93.1	Very high	9 Å²	9	61.7 Å²	61.7	6%	0.055	31%	0.307	C	S	.	.	H	α-helix	trans	-58.1	-48.5	179.5	-60.7	0	0	0	0	110.5	W417 L418 Y423 L424 L425 L436	W417-T421 PolarHBondContact NE1-OG1 2.99Å; W417-T421 VanDerWaalsContact O-CB 3.25Å; W417-T421 WeakPolarHBondContact O-CB 3.5Å; W417-T421 PolarHBondContact O-N 3.03Å; W417-T421 PolarHBondContact O-OG1 3.24Å; L418-T421 PolarHBondContact O-N 3.42Å; T421-Y423 PolarHBondContact O-N 3.47Å; T421-L424 CarbonylContact O-C 3.52Å; T421-L424 PolarHBondContact O-N 3.3Å; T421-L425 WeakPolarHBondContact O-CG 3.26Å; T421-L425 PolarHBondContact O-N 2.95Å; T421-L436 HydrophobicContact CG2-CB 3.67Å
422	V	91.1	Very high	92.8	Very high	8 Å²	8	66.4 Å²	66.4	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-67.5	-36.7	-177.4	170.4	0	0	0	0	112.3	L418 V420 L424 L425 P497 F501	L418-V422 WeakPolarHBondContact O-CB 3.26Å; L418-V422 WeakPolarHBondContact O-CG2 3.33Å; L418-V422 PolarHBondContact O-N 3.45Å; V420-V422 VanDerWaalsContact C-N 3.34Å; V420-V422 PolarHBondContact O-N 2.89Å; V422-L424 VanDerWaalsContact C-N 3.33Å; V422-L425 HydrophobicContact CB-CD1 4.12Å; V422-L425 HydrophobicContact CG1-CD1 4.14Å; V422-L425 HydrophobicContact CG2-CD1 3.98Å; V422-L425 WeakPolarHBondContact O-CB 3.46Å; V422-L425 PolarHBondContact O-N 3.33Å; V422-P497 HydrophobicContact CG1-CB 3.71Å; V422-P497 HydrophobicContact CG1-CG 3.62Å; V422-F501 HydrophobicContact CB-CD2 4.09Å; V422-F501 HydrophobicContact CB-CE2 4.43Å; V422-F501 HydrophobicContact CG1-CD2 4.18Å; V422-F501 HydrophobicContact CG1-CE2 4.43Å; V422-F501 HydrophobicContact CG2-CD2 3.7Å; V422-F501 HydrophobicContact CG2-CE2 3.63Å
423	Y	92.1	Very high	92.5	Very high	151 Å²	151	65.2 Å²	65.2	59%	0.592	32%	0.323	S	S	*	.	H	α-helix	trans	-62.4	-40.8	172.7	-179.8	-99.5	0	0	0	112.2	T419 V420 T421 L425 T498	T419-Y423 VanDerWaalsContact O-CB 3.32Å; T419-Y423 WeakPolarHBondContact O-CB 3.32Å; T419-Y423 PolarHBondContact O-N 3.21Å; V420-Y423 PolarHBondContact O-N 3.44Å; T421-Y423 PolarHBondContact O-N 3.47Å; Y423-L425 VanDerWaalsContact C-N 3.34Å; Y423-T498 HydrophobicContact CD2-CG2 4.12Å; Y423-T498 HydrophobicContact CG-CG2 4.5Å
424	L	92.6	Very high	92.2	Very high	55 Å²	55	63 Å²	63	29%	0.288	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-85.8	0.8	-178.9	-61.5	175.7	0	0	0	113.9	V420 T421 V422 S426 E427 I428	V420-L424 HydrophobicContact CG1-CD1 3.8Å; V420-L424 HydrophobicContact CG1-CG 4.46Å; V420-L424 WeakPolarHBondContact O-CG 3.28Å; V420-L424 PolarHBondContact O-N 3.18Å; T421-L424 CarbonylContact O-C 3.52Å; T421-L424 PolarHBondContact O-N 3.3Å; V422-L424 VanDerWaalsContact C-N 3.33Å; L424-S426 PolarHBondContact O-N 2.94Å; L424-S426 VanDerWaalsContact O-N 3.14Å; L424-E427 PolarHBondContact O-N 3.35Å; L424-I428 HydrophobicContact CB-CD1 3.62Å; L424-I428 HydrophobicContact CB-CG1 4.2Å; L424-I428 VanDerWaalsContact O-CG1 3.31Å; L424-I428 WeakPolarHBondContact O-CG1 3.49Å; L424-I428 PolarHBondContact O-N 3.4Å; L424-I428 VanDerWaalsContact O-N 3.13Å
425	L	87.3	Confident	92	Very high	19 Å²	19	65.8 Å²	65.8	10%	0.099	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-57	-33.3	-175.7	-85.1	171.4	0	0	0	113.4	V365 F366 T421 V422 Y423 E427	V365-L425 HydrophobicContact CG1-CD1 4.16Å; V365-L425 HydrophobicContact CG1-CD2 4.22Å; V365-L425 HydrophobicContact CG2-CD1 4.32Å; F366-L425 HydrophobicContact CE1-CD2 3.98Å; F366-L425 HydrophobicContact CZ-CD2 4.18Å; T421-L425 WeakPolarHBondContact O-CG 3.26Å; T421-L425 PolarHBondContact O-N 2.95Å; V422-L425 HydrophobicContact CB-CD1 4.12Å; V422-L425 HydrophobicContact CG1-CD1 4.14Å; V422-L425 HydrophobicContact CG2-CD1 3.98Å; V422-L425 WeakPolarHBondContact O-CB 3.46Å; V422-L425 PolarHBondContact O-N 3.33Å; Y423-L425 VanDerWaalsContact C-N 3.34Å; L425-E427 VanDerWaalsContact C-N 3.27Å; L425-E427 PolarHBondContact O-N 3.39Å
426	S	84.3	Confident	91.9	Very high	112 Å²	112	68.2 Å²	68.2	78%	0.783	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-71.2	-21.9	178.6	50.4	0	0	0	0	113.6	L424	L424-S426 PolarHBondContact O-N 2.94Å; L424-S426 VanDerWaalsContact O-N 3.14Å
427	E	88.2	Confident	91.7	Very high	145 Å²	145	64.5 Å²	64.5	68%	0.678	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-20	-177	-60.4	-179.2	-173.1	0	0	112.2	L424 L425	L424-E427 PolarHBondContact O-N 3.35Å; L425-E427 VanDerWaalsContact C-N 3.27Å; L425-E427 PolarHBondContact O-N 3.39Å
428	I	87.8	Confident	91.6	Very high	41 Å²	41	62.8 Å²	62.8	21%	0.21	32%	0.321	C	S	.	.	S	Bend	trans	-94.7	133.2	-175.1	-63	170.1	0	0	0	110.1	L424 M432 S433 L436	L424-I428 HydrophobicContact CB-CD1 3.62Å; L424-I428 HydrophobicContact CB-CG1 4.2Å; L424-I428 VanDerWaalsContact O-CG1 3.31Å; L424-I428 WeakPolarHBondContact O-CG1 3.49Å; L424-I428 PolarHBondContact O-N 3.4Å; L424-I428 VanDerWaalsContact O-N 3.13Å; I428-M432 HydrophobicContact CG2-CB 3.53Å; I428-S433 VanDerWaalsContact CG2-OG 3.31Å; I428-S433 WeakPolarHBondContact CG2-OG 3.44Å; I428-S433 PolarHBondContact O-OG 3.43Å; I428-S433 VanDerWaalsContact O-OG 3.09Å; I428-L436 HydrophobicContact CD1-CD1 3.98Å; I428-L436 HydrophobicContact CG2-CD1 4.25Å
429	P	90.2	Very high	91.6	Very high	68 Å²	68	65.8 Å²	65.8	44%	0.442	34%	0.34	S	S	.	.			trans	-63.2	141.4	175	27.3	-35.4	0	0	0	111.1	R431 M432 S433	P429-R431 HydrophobicContact CB-CG 4.29Å; P429-R431 HydrophobicContact CG-CG 4.38Å; P429-R431 PolarHBondContact O-N 3.13Å; P429-M432 HydrophobicContact CG-CB 4.42Å; P429-M432 HydrophobicContact CG-CG 4.2Å; P429-M432 PolarHBondContact O-N 2.98Å; P429-S433 PolarHBondContact O-N 2.86Å; P429-S433 VanDerWaalsContact O-N 3.13Å; P429-S433 PolarHBondContact O-OG 2.92Å
430	L	86.6	Confident	91.7	Very high	90 Å²	90	65 Å²	65	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-46.9	-39.3	-174.5	-177.1	63.5	0	0	0	114.4	F366 M432 S433 I434	F366-L430 HydrophobicContact CB-CD1 4.34Å; F366-L430 HydrophobicContact CD1-CD1 3.48Å; F366-L430 VanDerWaalsContact CD1-CD1 3.48Å; F366-L430 HydrophobicContact CE1-CD1 4.24Å; F366-L430 HydrophobicContact CG-CD1 4.32Å; L430-M432 PolarHBondContact O-N 3.21Å; L430-S433 PolarHBondContact O-N 3.04Å; L430-I434 HydrophobicContact CD1-CD1 4.01Å; L430-I434 HydrophobicContact CD1-CG1 4.09Å; L430-I434 HydrophobicContact CG-CD1 4.11Å; L430-I434 PolarHBondContact O-N 3.41Å
431	R	88.6	Confident	91.7	Very high	202 Å²	202	62 Å²	62	76%	0.762	32%	0.316	S	S	*	.	H	α-helix	trans	-57.6	-28.1	177.8	69.6	-175.2	178.6	-172.6	-1.4	114.3	P429 P435	P429-R431 HydrophobicContact CB-CG 4.29Å; P429-R431 HydrophobicContact CG-CG 4.38Å; P429-R431 PolarHBondContact O-N 3.13Å; R431-P435 VanDerWaalsContact O-CD 3.23Å; R431-P435 WeakPolarHBondContact O-CD 3.33Å; R431-P435 WeakPolarHBondContact O-CG 3.4Å
432	M	91.7	Very high	91.9	Very high	103 Å²	103	63.4 Å²	63.4	51%	0.507	33%	0.328	S	S	.	.	H	α-helix	trans	-97.7	-34.6	176.4	-66.5	-58	-163.6	0	0	111.2	I428 P429 L430 I434 P435 L436	I428-M432 HydrophobicContact CG2-CB 3.53Å; P429-M432 HydrophobicContact CG-CB 4.42Å; P429-M432 HydrophobicContact CG-CG 4.2Å; P429-M432 PolarHBondContact O-N 2.98Å; L430-M432 PolarHBondContact O-N 3.21Å; M432-I434 PolarHBondContact O-N 3.44Å; M432-P435 VanDerWaalsContact O-CD 3.22Å; M432-P435 WeakPolarHBondContact O-CD 3.24Å; M432-P435 VanDerWaalsContact O-CG 3.29Å; M432-P435 WeakPolarHBondContact O-CG 3.34Å; M432-L436 HydrophobicContact CB-CD1 4.44Å; M432-L436 WeakPolarHBondContact O-CB 3.5Å; M432-L436 WeakPolarHBondContact O-CD1 3.42Å; M432-L436 WeakPolarHBondContact O-CG 3.38Å; M432-L436 PolarHBondContact O-N 3.06Å; M432-L436 VanDerWaalsContact O-N 3.14Å
433	S	91.4	Very high	92.2	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.014	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-46.1	-179.9	-59.5	0	0	0	0	112.8	I428 P429 L430 L436 T437	I428-S433 VanDerWaalsContact CG2-OG 3.31Å; I428-S433 WeakPolarHBondContact CG2-OG 3.44Å; I428-S433 PolarHBondContact O-OG 3.43Å; I428-S433 VanDerWaalsContact O-OG 3.09Å; P429-S433 PolarHBondContact O-N 2.86Å; P429-S433 VanDerWaalsContact O-N 3.13Å; P429-S433 PolarHBondContact O-OG 2.92Å; L430-S433 PolarHBondContact O-N 3.04Å; S433-L436 PolarHBondContact O-N 3.34Å; S433-T437 PolarHBondContact O-N 3.09Å; S433-T437 PolarHBondContact O-OG1 2.91Å; S433-T437 VanDerWaalsContact O-OG1 3.11Å
434	I	92.5	Very high	92.4	Very high	42 Å²	42	57.9 Å²	57.9	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-58.2	-59.1	178.8	-69.6	169.4	0	0	0	112.3	F366 W368 L430 M432 L436 T437 L438	F366-I434 HydrophobicContact CB-CG1 4.47Å; F366-I434 HydrophobicContact CD1-CG1 3.82Å; F366-I434 HydrophobicContact CD2-CG1 4.27Å; F366-I434 HydrophobicContact CE1-CG1 4.05Å; F366-I434 HydrophobicContact CE2-CG1 4.49Å; F366-I434 HydrophobicContact CG-CG1 3.94Å; F366-I434 HydrophobicContact CZ-CG1 4.38Å; W368-I434 HydrophobicContact CH2-CG2 4.07Å; W368-I434 HydrophobicContact CZ2-CB 4.35Å; W368-I434 HydrophobicContact CZ2-CD1 4.03Å; W368-I434 HydrophobicContact CZ2-CG1 3.91Å; W368-I434 HydrophobicContact CZ2-CG2 3.6Å; L430-I434 HydrophobicContact CD1-CD1 4.01Å; L430-I434 HydrophobicContact CD1-CG1 4.09Å; L430-I434 HydrophobicContact CG-CD1 4.11Å; L430-I434 PolarHBondContact O-N 3.41Å; M432-I434 PolarHBondContact O-N 3.44Å; I434-L436 VanDerWaalsContact C-N 3.28Å; I434-L436 PolarHBondContact O-N 3.14Å; I434-T437 PolarHBondContact O-N 3.33Å; I434-L438 HydrophobicContact CG2-CD1 3.81Å; I434-L438 HydrophobicContact CG2-CG 4.33Å; I434-L438 WeakPolarHBondContact O-CG 3.38Å; I434-L438 PolarHBondContact O-N 3.17Å
435	P	94.6	Very high	92.6	Very high	60 Å²	60	55.6 Å²	55.6	39%	0.39	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-32	-177.8	22.8	-33.2	0	0	0	112.9	R431 M432 L438 T439	R431-P435 VanDerWaalsContact O-CD 3.23Å; R431-P435 WeakPolarHBondContact O-CD 3.33Å; R431-P435 WeakPolarHBondContact O-CG 3.4Å; M432-P435 VanDerWaalsContact O-CD 3.22Å; M432-P435 WeakPolarHBondContact O-CD 3.24Å; M432-P435 VanDerWaalsContact O-CG 3.29Å; M432-P435 WeakPolarHBondContact O-CG 3.34Å; P435-L438 PolarHBondContact O-N 3.45Å; P435-T439 WeakPolarHBondContact O-CB 3.4Å; P435-T439 PolarHBondContact O-N 3.12Å; P435-T439 PolarHBondContact O-OG1 3.31Å
436	L	95.2	Very high	93.1	Very high	50 Å²	50	58.1 Å²	58.1	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-65	-45.4	174.9	-69.4	171.2	0	0	0	111.6	W417 T421 I428 M432 S433 I434 T439 G440	W417-L436 HydrophobicContact CH2-CD2 4.19Å; W417-L436 HydrophobicContact CZ2-CD2 3.59Å; W417-L436 PolarHBondContact NE1-O 3.15Å; T421-L436 HydrophobicContact CG2-CB 3.67Å; I428-L436 HydrophobicContact CD1-CD1 3.98Å; I428-L436 HydrophobicContact CG2-CD1 4.25Å; M432-L436 HydrophobicContact CB-CD1 4.44Å; M432-L436 WeakPolarHBondContact O-CB 3.5Å; M432-L436 WeakPolarHBondContact O-CD1 3.42Å; M432-L436 WeakPolarHBondContact O-CG 3.38Å; M432-L436 PolarHBondContact O-N 3.06Å; M432-L436 VanDerWaalsContact O-N 3.14Å; S433-L436 PolarHBondContact O-N 3.34Å; I434-L436 VanDerWaalsContact C-N 3.28Å; I434-L436 PolarHBondContact O-N 3.14Å; L436-T439 PolarHBondContact O-N 2.83Å; L436-G440 PolarHBondContact O-N 2.92Å
437	T	93.9	Very high	93.7	Very high	8 Å²	8	52.8 Å²	52.8	5%	0.049	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-45.2	175.5	-61.4	0	0	0	0	111.3	F366 L418 S433 I434 T439 G440 I441	F366-T437 HydrophobicContact CE2-CG2 4.17Å; F366-T437 HydrophobicContact CZ-CG2 4.26Å; L418-T437 HydrophobicContact CD2-CG2 4.46Å; S433-T437 PolarHBondContact O-N 3.09Å; S433-T437 PolarHBondContact O-OG1 2.91Å; S433-T437 VanDerWaalsContact O-OG1 3.11Å; I434-T437 PolarHBondContact O-N 3.33Å; T437-T439 VanDerWaalsContact C-N 3.29Å; T437-T439 PolarHBondContact O-N 2.88Å; T437-G440 PolarHBondContact O-N 2.8Å; T437-G440 VanDerWaalsContact O-N 3.17Å; T437-I441 HydrophobicContact CG2-CD1 4.02Å; T437-I441 WeakPolarHBondContact O-CG1 3.5Å; T437-I441 PolarHBondContact O-N 3.01Å
438	L	95.1	Very high	94	Very high	63 Å²	63	46.2 Å²	46.2	33%	0.33	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-35.5	177	-70.4	178.2	0	0	0	112.6	W368 V376 I434 P435 I441 A442	W368-L438 HydrophobicContact CH2-CD1 4.48Å; W368-L438 HydrophobicContact CH2-CD2 4.14Å; W368-L438 HydrophobicContact CH2-CG 4.42Å; V376-L438 HydrophobicContact CG1-CD2 4.01Å; V376-L438 HydrophobicContact CG2-CD2 3.72Å; I434-L438 HydrophobicContact CG2-CD1 3.81Å; I434-L438 HydrophobicContact CG2-CG 4.33Å; I434-L438 WeakPolarHBondContact O-CG 3.38Å; I434-L438 PolarHBondContact O-N 3.17Å; P435-L438 PolarHBondContact O-N 3.45Å; L438-I441 PolarHBondContact O-N 2.56Å; L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 2.92Å
439	T	96.7	Very high	94.4	Very high	63 Å²	63	44.4 Å²	44.4	39%	0.387	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-45.5	174.5	-60.6	0	0	0	0	110.9	W417 P435 L436 T437 I441 A442 I443	W417-T439 HydrophobicContact CZ2-CG2 4.19Å; P435-T439 WeakPolarHBondContact O-CB 3.4Å; P435-T439 PolarHBondContact O-N 3.12Å; P435-T439 PolarHBondContact O-OG1 3.31Å; L436-T439 PolarHBondContact O-N 2.83Å; T437-T439 VanDerWaalsContact C-N 3.29Å; T437-T439 PolarHBondContact O-N 2.88Å; T439-I441 PolarHBondContact O-N 2.96Å; T439-A442 PolarHBondContact O-N 2.72Å; T439-I443 HydrophobicContact CG2-CD1 4.11Å; T439-I443 VanDerWaalsContact O-CG1 3.3Å; T439-I443 WeakPolarHBondContact O-CG1 3.46Å; T439-I443 PolarHBondContact O-N 3.49Å
440	G	96.9	Very high	94.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-43.9	176	0	0	0	0	0	112.9	S414 W417 L436 T437 I443 H444	S414-G440 PolarHBondContact OG-O 2.8Å; W417-G440 VanDerWaalsContact CD1-CA 3.44Å; L436-G440 PolarHBondContact O-N 2.92Å; T437-G440 PolarHBondContact O-N 2.8Å; T437-G440 VanDerWaalsContact O-N 3.17Å; G440-I443 PolarHBondContact O-N 2.93Å; G440-H444 PolarHBondContact O-N 3.44Å
441	I	96	Very high	95.3	Very high	11 Å²	11	38.1 Å²	38.1	6%	0.056	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-42.7	175.7	-64.7	167.1	0	0	0	110.8	L354 L358 V376 L418 T437 L438 T439 I443 H444 V445	L354-I441 HydrophobicContact CD1-CG1 4.47Å; L358-I441 HydrophobicContact CD1-CD1 3.64Å; L358-I441 HydrophobicContact CD2-CD1 4.09Å; V376-I441 HydrophobicContact CG1-CD1 4.39Å; V376-I441 HydrophobicContact CG1-CG2 4.39Å; L418-I441 HydrophobicContact CD2-CG1 4.35Å; T437-I441 HydrophobicContact CG2-CD1 4.02Å; T437-I441 WeakPolarHBondContact O-CG1 3.5Å; T437-I441 PolarHBondContact O-N 3.01Å; L438-I441 PolarHBondContact O-N 2.56Å; T439-I441 PolarHBondContact O-N 2.96Å; I441-I443 PolarHBondContact O-N 3.42Å; I441-H444 WeakPolarHBondContact O-CB 3.22Å; I441-H444 PolarHBondContact O-N 3.47Å; I441-V445 HydrophobicContact CG2-CG2 4.35Å; I441-V445 WeakPolarHBondContact O-CB 3.41Å; I441-V445 VanDerWaalsContact O-CG2 3.28Å; I441-V445 WeakPolarHBondContact O-CG2 3.37Å; I441-V445 PolarHBondContact O-N 3.43Å
442	A	97.2	Very high	95.6	Very high	38 Å²	38	29.3 Å²	29.3	31%	0.314	16%	0.162	S	C	.	.	H	α-helix	trans	-61.1	-43.6	177.1	0	0	0	0	0	111.5	L383 L438 T439 H444 V445 L446	L383-A442 HydrophobicContact CD2-CB 4.48Å; L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 2.92Å; T439-A442 PolarHBondContact O-N 2.72Å; A442-H444 VanDerWaalsContact C-N 3.34Å; A442-H444 PolarHBondContact O-N 3.31Å; A442-V445 WeakPolarHBondContact O-CB 3.45Å; A442-V445 PolarHBondContact O-N 2.7Å; A442-L446 WeakPolarHBondContact O-CG 3.45Å; A442-L446 PolarHBondContact O-N 2.85Å
443	I	97.9	Very high	95.8	Very high	38 Å²	38	24.4 Å²	24.4	20%	0.195	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-41.1	175.9	-60.4	165.8	0	0	0	110.9	T410 I413 T439 G440 I441 V445 L446 G447	T410-I443 HydrophobicContact CG2-CG2 3.67Å; T410-I443 WeakPolarHBondContact CG2-O 3.32Å; T410-I443 WeakPolarHBondContact O-CG2 3.42Å; I413-I443 HydrophobicContact CG2-CG2 4.48Å; T439-I443 HydrophobicContact CG2-CD1 4.11Å; T439-I443 VanDerWaalsContact O-CG1 3.3Å; T439-I443 WeakPolarHBondContact O-CG1 3.46Å; T439-I443 PolarHBondContact O-N 3.49Å; G440-I443 PolarHBondContact O-N 2.93Å; I441-I443 PolarHBondContact O-N 3.42Å; I443-V445 VanDerWaalsContact C-N 3.33Å; I443-V445 PolarHBondContact O-N 3.47Å; I443-L446 WeakPolarHBondContact O-CB 3.46Å; I443-L446 PolarHBondContact O-N 3.07Å; I443-G447 PolarHBondContact O-N 3.28Å
444	H	96.9	Very high	96.1	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.023	14%	0.137	C	C	.	.	H	α-helix	trans	-57.4	-48.1	173.7	163.2	73.5	0	0	0	111.3	L354 S414 Y415 G440 I441 A442 L446 G447 I448	L354-H444 WeakPolarHBondContact CD2-CD2 3.3Å; L354-H444 WeakPolarHBondContact CD2-NE2 3.25Å; S414-H444 WeakPolarHBondContact OG-CA 3.45Å; S414-H444 VanDerWaalsContact OG-CB 3.24Å; S414-H444 WeakPolarHBondContact OG-CB 2.99Å; S414-H444 PolarHBondContact OG-N 3.09Å; Y415-H444 HydrophobicContact CE1-CB 4.44Å; Y415-H444 AromaticContact CE1-ND1 3.61Å; Y415-H444 AromaticContact CZ-ND1 3.52Å; Y415-H444 PolarHBondContact OH-CE1 2.73Å; Y415-H444 PolarHBondContact OH-ND1 2.69Å; G440-H444 PolarHBondContact O-N 3.44Å; I441-H444 WeakPolarHBondContact O-CB 3.22Å; I441-H444 PolarHBondContact O-N 3.47Å; A442-H444 VanDerWaalsContact C-N 3.34Å; A442-H444 PolarHBondContact O-N 3.31Å; H444-L446 VanDerWaalsContact C-N 3.27Å; H444-L446 PolarHBondContact O-N 3.48Å; H444-G447 PolarHBondContact O-N 2.86Å; H444-G447 VanDerWaalsContact O-N 3.08Å; H444-I448 WeakPolarHBondContact CE1-CG1 3.33Å; H444-I448 PolarHBondContact O-N 3.48Å
445	V	96.2	Very high	96.3	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-34.5	179.2	167.4	0	0	0	0	112	A380 L383 I384 I441 A442 I443 P449	A380-V445 HydrophobicContact CB-CG2 3.75Å; L383-V445 HydrophobicContact CB-CG1 3.87Å; L383-V445 HydrophobicContact CD2-CB 4.16Å; L383-V445 HydrophobicContact CD2-CG1 3.6Å; L383-V445 HydrophobicContact CG-CG1 3.69Å; I384-V445 HydrophobicContact CD1-CG1 4.37Å; I384-V445 HydrophobicContact CG1-CG1 3.53Å; I441-V445 HydrophobicContact CG2-CG2 4.35Å; I441-V445 WeakPolarHBondContact O-CB 3.41Å; I441-V445 VanDerWaalsContact O-CG2 3.28Å; I441-V445 WeakPolarHBondContact O-CG2 3.37Å; I441-V445 PolarHBondContact O-N 3.43Å; A442-V445 WeakPolarHBondContact O-CB 3.45Å; A442-V445 PolarHBondContact O-N 2.7Å; I443-V445 VanDerWaalsContact C-N 3.33Å; I443-V445 PolarHBondContact O-N 3.47Å; V445-P449 WeakPolarHBondContact O-CD 3.37Å
446	L	96.7	Very high	96.4	Very high	73 Å²	73	19.5 Å²	19.5	38%	0.382	11%	0.108	S	C	.	.	H	α-helix	trans	-67.1	-40	172.7	-67.3	175	0	0	0	112.2	L383 V387 T410 A442 I443 H444 F450	L383-L446 HydrophobicContact CD1-CD2 4.24Å; L383-L446 HydrophobicContact CD2-CD2 4.43Å; L383-L446 HydrophobicContact CG-CD2 4.46Å; V387-L446 HydrophobicContact CG2-CD2 3.48Å; V387-L446 VanDerWaalsContact CG2-CD2 3.48Å; T410-L446 HydrophobicContact CG2-CB 4.35Å; A442-L446 WeakPolarHBondContact O-CG 3.45Å; A442-L446 PolarHBondContact O-N 2.85Å; I443-L446 WeakPolarHBondContact O-CB 3.46Å; I443-L446 PolarHBondContact O-N 3.07Å; H444-L446 VanDerWaalsContact C-N 3.27Å; H444-L446 PolarHBondContact O-N 3.48Å; L446-F450 WeakPolarHBondContact O-CD2 3.36Å; L446-F450 WeakPolarHBondContact O-CE2 3.43Å
447	G	97.3	Very high	96.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-79.1	-37.8	-174.6	0	0	0	0	0	114.9	I443 H444 F450 T451	I443-G447 PolarHBondContact O-N 3.28Å; H444-G447 PolarHBondContact O-N 2.86Å; H444-G447 VanDerWaalsContact O-N 3.08Å; G447-F450 WeakPolarHBondContact O-CB 3.45Å; G447-F450 PolarHBondContact O-N 3.01Å; G447-T451 PolarHBondContact O-N 3.42Å
448	I	95.9	Very high	96.5	Very high	6 Å²	6	16.8 Å²	16.8	3%	0.031	9%	0.094	C	C	.	.	H	α-helix	trans	-53.1	-51.7	-173.8	-86.6	-70.2	0	0	0	113.3	A347 F351 M411 H444 F450 T451 Y452	A347-I448 HydrophobicContact CB-CD1 4.39Å; A347-I448 WeakPolarHBondContact O-CD1 3.44Å; F351-I448 HydrophobicContact CB-CD1 3.93Å; M411-I448 HydrophobicContact CE-CD1 3.27Å; M411-I448 HydrophobicContact CE-CG1 3.68Å; M411-I448 HydrophobicContact SD-CB 4.5Å; M411-I448 HydrophobicContact SD-CD1 4.07Å; M411-I448 HydrophobicContact SD-CG1 3.79Å; H444-I448 WeakPolarHBondContact CE1-CG1 3.33Å; H444-I448 PolarHBondContact O-N 3.48Å; I448-F450 VanDerWaalsContact C-N 3.26Å; I448-F450 PolarHBondContact O-N 2.63Å; I448-T451 PolarHBondContact O-N 3.04Å; I448-T451 PolarHBondContact O-OG1 2.71Å; I448-Y452 HydrophobicContact CD1-CE1 3.93Å; I448-Y452 HydrophobicContact CG2-CD2 3.92Å; I448-Y452 HydrophobicContact CG2-CE1 4.41Å; I448-Y452 HydrophobicContact CG2-CE2 3.66Å; I448-Y452 HydrophobicContact CG2-CG 4.4Å; I448-Y452 PolarHBondContact O-N 2.92Å
449	P	95.9	Very high	96.5	Very high	4 Å²	4	13.8 Å²	13.8	3%	0.026	8%	0.078	C	C	.	.	H	α-helix	trans	-62.3	-34.2	-174.2	-27	38.5	0	0	0	112.8	I384 V387 V388 L391 V445 A453	I384-P449 HydrophobicContact CG2-CG 3.76Å; V387-P449 HydrophobicContact CB-CG 4.22Å; V387-P449 HydrophobicContact CG1-CB 3.87Å; V387-P449 HydrophobicContact CG1-CG 3.75Å; V388-P449 HydrophobicContact CG2-CB 3.92Å; V388-P449 HydrophobicContact CG2-CG 4.38Å; L391-P449 HydrophobicContact CD1-CB 3.82Å; L391-P449 WeakPolarHBondContact CD1-O 3.43Å; V445-P449 WeakPolarHBondContact O-CD 3.37Å; P449-A453 WeakPolarHBondContact O-CB 3.22Å; P449-A453 PolarHBondContact O-N 3.31Å
450	F	96.9	Very high	96.4	Very high	25 Å²	25	10.8 Å²	10.8	11%	0.11	6%	0.06	C	C	.	.	H	α-helix	trans	-61.3	-49.7	173.8	-73.8	-103.1	0	0	0	110.3	V387 L391 L394 L403 L446 G447 I448 Y452 Y454	V387-F450 HydrophobicContact CG1-CD2 4.2Å; V387-F450 HydrophobicContact CG1-CE2 3.88Å; L391-F450 HydrophobicContact CD2-CB 4.41Å; L391-F450 HydrophobicContact CD2-CD1 3.44Å; L391-F450 VanDerWaalsContact CD2-CD1 3.44Å; L391-F450 HydrophobicContact CD2-CD2 3.39Å; L391-F450 HydrophobicContact CD2-CE1 3.34Å; L391-F450 HydrophobicContact CD2-CE2 3.28Å; L391-F450 HydrophobicContact CD2-CG 3.47Å; L391-F450 VanDerWaalsContact CD2-CG 3.47Å; L391-F450 HydrophobicContact CD2-CZ 3.26Å; L394-F450 HydrophobicContact CD1-CE1 3.93Å; L394-F450 HydrophobicContact CD1-CZ 3.82Å; L403-F450 HydrophobicContact CB-CD1 4.18Å; L403-F450 HydrophobicContact CD2-CE1 4.2Å; L403-F450 WeakPolarHBondContact O-CD1 3.17Å; L446-F450 WeakPolarHBondContact O-CD2 3.36Å; L446-F450 WeakPolarHBondContact O-CE2 3.43Å; G447-F450 WeakPolarHBondContact O-CB 3.45Å; G447-F450 PolarHBondContact O-N 3.01Å; I448-F450 VanDerWaalsContact C-N 3.26Å; I448-F450 PolarHBondContact O-N 2.63Å; F450-Y452 VanDerWaalsContact C-N 3.33Å; F450-Y452 PolarHBondContact O-N 2.78Å; F450-Y454 HydrophobicContact CB-CD2 4.15Å; F450-Y454 HydrophobicContact CB-CE2 4.35Å; F450-Y454 HydrophobicContact CD1-CD2 4.15Å; F450-Y454 AromaticContact CD1-CE2 3.72Å; F450-Y454 HydrophobicContact CD1-CE2 3.72Å; F450-Y454 HydrophobicContact CE1-CE2 4.41Å; F450-Y454 HydrophobicContact CG-CE2 4.27Å; F450-Y454 WeakPolarHBondContact O-CB 3.18Å; F450-Y454 WeakPolarHBondContact O-CD2 3.28Å; F450-Y454 PolarHBondContact O-N 3.41Å
451	T	97.3	Very high	96.2	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63	-39.6	-178.7	62	0	0	0	0	111.9	A347 L408 M411 G447 I448 S455	A347-T451 WeakPolarHBondContact CB-OG1 3.17Å; L408-T451 HydrophobicContact CD2-CG2 3.91Å; L408-T451 HydrophobicContact CG-CG2 4.15Å; M411-T451 HydrophobicContact CG-CG2 3.91Å; G447-T451 PolarHBondContact O-N 3.42Å; I448-T451 PolarHBondContact O-N 3.04Å; I448-T451 PolarHBondContact O-OG1 2.71Å; T451-S455 WeakPolarHBondContact O-CB 3.39Å; T451-S455 PolarHBondContact O-N 3.02Å; T451-S455 PolarHBondContact O-OG 3.21Å
452	Y	96.1	Very high	96.1	Very high	18 Å²	18	13.7 Å²	13.7	7%	0.071	7%	0.074	C	C	.	.	H	α-helix	trans	-69.2	-54.9	177.1	-69.1	-2	0	0	0	111.7	L215 A347 Y348 F351 I448 F450 Y454 E456	L215-Y452 HydrophobicContact CD2-CD2 4.4Å; A347-Y452 HydrophobicContact CB-CD1 3.98Å; A347-Y452 HydrophobicContact CB-CE1 3.57Å; A347-Y452 PolarHBondContact O-OH 3.34Å; Y348-Y452 WeakPolarHBondContact CA-OH 3.42Å; Y348-Y452 HydrophobicContact CD1-CE1 4.13Å; Y348-Y452 HydrophobicContact CD1-CE2 4.26Å; Y348-Y452 AromaticContact CD1-CZ 3.7Å; Y348-Y452 WeakPolarHBondContact CD1-OH 3.24Å; Y348-Y452 HydrophobicContact CD2-CD1 4.07Å; Y348-Y452 AromaticContact CD2-CE1 3.57Å; Y348-Y452 HydrophobicContact CD2-CE1 3.57Å; Y348-Y452 HydrophobicContact CE1-CD2 4.37Å; Y348-Y452 HydrophobicContact CE1-CE1 4.16Å; Y348-Y452 AromaticContact CE1-CE2 3.8Å; Y348-Y452 HydrophobicContact CE1-CE2 3.8Å; Y348-Y452 AromaticContact CE1-CZ 3.69Å; Y348-Y452 AromaticContact CE2-CD1 3.69Å; Y348-Y452 HydrophobicContact CE2-CD1 3.69Å; Y348-Y452 AromaticContact CE2-CE1 3.6Å; Y348-Y452 HydrophobicContact CE2-CE1 3.6Å; Y348-Y452 HydrophobicContact CE2-CE2 4.44Å; Y348-Y452 HydrophobicContact CE2-CG 4.16Å; Y348-Y452 AromaticContact CG-CE1 3.85Å; Y348-Y452 HydrophobicContact CG-CE1 3.85Å; Y348-Y452 AromaticContact CG-CZ 3.89Å; Y348-Y452 AromaticContact CZ-CE1 3.91Å; Y348-Y452 AromaticContact CZ-CE2 3.9Å; Y348-Y452 AromaticContact CZ-CZ 3.85Å; F351-Y452 WeakPolarHBondContact CB-OH 3.4Å; F351-Y452 WeakPolarHBondContact CG-OH 3.3Å; I448-Y452 HydrophobicContact CD1-CE1 3.93Å; I448-Y452 HydrophobicContact CG2-CD2 3.92Å; I448-Y452 HydrophobicContact CG2-CE1 4.41Å; I448-Y452 HydrophobicContact CG2-CE2 3.66Å; I448-Y452 HydrophobicContact CG2-CG 4.4Å; I448-Y452 PolarHBondContact O-N 2.92Å; F450-Y452 VanDerWaalsContact C-N 3.33Å; F450-Y452 PolarHBondContact O-N 2.78Å; Y452-Y454 PolarHBondContact O-N 2.98Å; Y452-E456 WeakPolarHBondContact O-CB 3.36Å; Y452-E456 PolarHBondContact O-N 3.46Å
453	A	96.2	Very high	95.8	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62.8	-49	-172.8	0	0	0	0	0	112.5	I212 L215 L391 P449 S457	I212-A453 HydrophobicContact CG1-CB 3.85Å; L215-A453 HydrophobicContact CD1-CB 3.59Å; L391-A453 HydrophobicContact CD1-CB 3.89Å; P449-A453 WeakPolarHBondContact O-CB 3.22Å; P449-A453 PolarHBondContact O-N 3.31Å; A453-S457 WeakPolarHBondContact O-CB 3.26Å; A453-S457 PolarHBondContact O-N 2.94Å
454	Y	97	Very high	95.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-84.9	-30.8	-170.9	-61.5	-64.1	0	0	0	113.2	T208 L391 N395 D400 L403 F450 Y452 L458	T208-Y454 HydrophobicContact CG2-CD1 3.64Å; T208-Y454 HydrophobicContact CG2-CE1 3.51Å; L391-Y454 WeakPolarHBondContact CB-OH 3.38Å; L391-Y454 HydrophobicContact CD1-CE2 4.18Å; L391-Y454 HydrophobicContact CD2-CE2 3.8Å; L391-Y454 HydrophobicContact CG-CE2 4.39Å; L391-Y454 PolarHBondContact O-OH 3.45Å; N395-Y454 HydrophobicContact CB-CE1 4.32Å; D400-Y454 HydrophobicContact CB-CD1 3.99Å; L403-Y454 HydrophobicContact CB-CD1 4.24Å; L403-Y454 HydrophobicContact CB-CD2 3.52Å; L403-Y454 HydrophobicContact CB-CE1 4.09Å; L403-Y454 HydrophobicContact CB-CE2 3.38Å; L403-Y454 HydrophobicContact CB-CG 3.99Å; L403-Y454 HydrophobicContact CD1-CD1 4.47Å; L403-Y454 HydrophobicContact CD1-CE1 3.63Å; L403-Y454 HydrophobicContact CD1-CE2 3.96Å; L403-Y454 VanDerWaalsContact CD1-OH 3.28Å; L403-Y454 WeakPolarHBondContact CD1-OH 3.17Å; L403-Y454 HydrophobicContact CG-CE2 4.25Å; F450-Y454 HydrophobicContact CB-CD2 4.15Å; F450-Y454 HydrophobicContact CB-CE2 4.35Å; F450-Y454 HydrophobicContact CD1-CD2 4.15Å; F450-Y454 AromaticContact CD1-CE2 3.72Å; F450-Y454 HydrophobicContact CD1-CE2 3.72Å; F450-Y454 HydrophobicContact CE1-CE2 4.41Å; F450-Y454 HydrophobicContact CG-CE2 4.27Å; F450-Y454 WeakPolarHBondContact O-CB 3.18Å; F450-Y454 WeakPolarHBondContact O-CD2 3.28Å; F450-Y454 PolarHBondContact O-N 3.41Å; Y452-Y454 PolarHBondContact O-N 2.98Å; Y454-L458 VanDerWaalsContact O-CB 3.28Å; Y454-L458 WeakPolarHBondContact O-CB 3.28Å; Y454-L458 WeakPolarHBondContact O-CD1 3.32Å; Y454-L458 VanDerWaalsContact O-CG 3.31Å; Y454-L458 WeakPolarHBondContact O-CG 3.38Å; Y454-L458 PolarHBondContact O-N 3.3Å
455	S	97.3	Very high	94.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-68.3	-40.6	174.8	72.7	0	0	0	0	111.1	N344 T451 Y459	N344-S455 VanDerWaalsContact CG-OG 3.32Å; N344-S455 WeakPolarHBondContact ND2-CB 3.06Å; N344-S455 PolarHBondContact ND2-OG 2.9Å; N344-S455 PolarHBondContact OD1-OG 3.49Å; N344-S455 VanDerWaalsContact OD1-OG 3.12Å; T451-S455 WeakPolarHBondContact O-CB 3.39Å; T451-S455 PolarHBondContact O-N 3.02Å; T451-S455 PolarHBondContact O-OG 3.21Å; S455-Y459 VanDerWaalsContact O-CB 3.3Å; S455-Y459 WeakPolarHBondContact O-CB 3.2Å; S455-Y459 PolarHBondContact O-N 3.29Å
456	E	96.2	Very high	94	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-67.6	-45.3	175.8	-175	175.8	143.3	0	0	111.3	Y195 I211 Y452 L458 Y459 T460 F475 R476	Y195-E456 VanDerWaalsContact CD1-OE1 3.32Å; Y195-E456 WeakPolarHBondContact CD1-OE1 3.22Å; Y195-E456 WeakPolarHBondContact CE1-OE1 3.34Å; I211-E456 HydrophobicContact CD1-CG 4.1Å; I211-E456 HydrophobicContact CG2-CB 4.37Å; I211-E456 HydrophobicContact CG2-CG 4.36Å; Y452-E456 WeakPolarHBondContact O-CB 3.36Å; Y452-E456 PolarHBondContact O-N 3.46Å; E456-L458 PolarHBondContact O-N 2.95Å; E456-Y459 WeakPolarHBondContact O-CB 3.38Å; E456-Y459 PolarHBondContact O-N 3.33Å; E456-Y459 VanDerWaalsContact O-N 3.17Å; E456-T460 WeakPolarHBondContact O-CG2 3.33Å; E456-T460 PolarHBondContact O-N 3.44Å; E456-F475 HydrophobicContact CB-CE1 4.16Å; E456-F475 HydrophobicContact CB-CZ 4.12Å; E456-F475 HydrophobicContact CG-CE1 3.82Å; E456-F475 HydrophobicContact CG-CZ 4.25Å; E456-R476 IonicContact OE1-CZ 3.16Å; E456-R476 IonicContact OE1-NH1 2.99Å; E456-R476 IonicContact OE1-NH2 2.97Å; E456-R476 PolarHBondContact OE1-NH2 3.49Å; E456-R476 IonicContact OE2-CZ 3.62Å; E456-R476 VanDerWaalsContact OE2-CZ 3.28Å; E456-R476 IonicContact OE2-NH1 3.52Å; E456-R476 PolarHBondContact OE2-NH1 2.97Å; E456-R476 IonicContact OE2-NH2 2.67Å; E456-R476 PolarHBondContact OE2-NH2 2.96Å
457	S	95	Very high	93.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.5	-50.7	174.9	179.3	0	0	0	0	111.9	T208 D400 A453 Y459 T460 K461	T208-S457 PolarHBondContact OG1-OG 3.04Å; D400-S457 WeakPolarHBondContact OD2-CB 3.14Å; D400-S457 PolarHBondContact OD2-OG 2.92Å; A453-S457 WeakPolarHBondContact O-CB 3.26Å; A453-S457 PolarHBondContact O-N 2.94Å; S457-Y459 VanDerWaalsContact C-N 3.31Å; S457-Y459 PolarHBondContact O-N 3.27Å; S457-T460 PolarHBondContact O-N 2.86Å; S457-T460 PolarHBondContact O-OG1 3.27Å; S457-K461 VanDerWaalsContact O-CG 3.31Å; S457-K461 WeakPolarHBondContact O-CG 3.43Å; S457-K461 PolarHBondContact O-N 2.99Å; S457-K461 WeakPolarHBondContact OG-CE 3.36Å; S457-K461 PolarHBondContact OG-NZ 2.9Å
458	L	95.6	Very high	93.4	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-59.7	-41.7	176	-78.9	163.2	0	0	0	111.8	L340 D400 R401 L404 Y454 E456 T460 K461 L462 V524	L340-L458 HydrophobicContact CD1-CB 4.07Å; L340-L458 HydrophobicContact CD2-CB 4.27Å; D400-L458 HydrophobicContact CB-CD1 4.07Å; D400-L458 HydrophobicContact CB-CD2 3.99Å; D400-L458 HydrophobicContact CB-CG 3.75Å; R401-L458 HydrophobicContact CB-CD1 4.29Å; L404-L458 HydrophobicContact CB-CD1 4.23Å; L404-L458 HydrophobicContact CD2-CD1 3.6Å; Y454-L458 VanDerWaalsContact O-CB 3.28Å; Y454-L458 WeakPolarHBondContact O-CB 3.28Å; Y454-L458 WeakPolarHBondContact O-CD1 3.32Å; Y454-L458 VanDerWaalsContact O-CG 3.31Å; Y454-L458 WeakPolarHBondContact O-CG 3.38Å; Y454-L458 PolarHBondContact O-N 3.3Å; E456-L458 PolarHBondContact O-N 2.95Å; L458-T460 VanDerWaalsContact C-N 3.33Å; L458-T460 PolarHBondContact O-N 3.09Å; L458-K461 PolarHBondContact O-N 3.37Å; L458-K461 VanDerWaalsContact O-N 3.13Å; L458-L462 WeakPolarHBondContact O-CB 3.06Å; L458-L462 VanDerWaalsContact O-CG 3.28Å; L458-L462 WeakPolarHBondContact O-CG 3.19Å; L458-L462 PolarHBondContact O-N 2.98Å; L458-V524 HydrophobicContact CD2-CG2 3.84Å
459	Y	96.3	Very high	93.2	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.9	-48.9	176	-179.6	-96.3	0	0	0	110.9	I337 L340 Y341 S455 E456 S457 K461 L462 A463 A471 F475	I337-Y459 HydrophobicContact CD1-CD2 3.9Å; I337-Y459 HydrophobicContact CD1-CE2 3.95Å; I337-Y459 HydrophobicContact CG2-CD2 4.45Å; I337-Y459 HydrophobicContact CG2-CE2 3.83Å; L340-Y459 HydrophobicContact CB-CD2 4.46Å; L340-Y459 HydrophobicContact CD1-CD2 4.46Å; Y341-Y459 HydrophobicContact CD1-CE2 4.26Å; Y341-Y459 HydrophobicContact CE1-CD2 4.16Å; Y341-Y459 AromaticContact CE1-CE2 3.36Å; Y341-Y459 HydrophobicContact CE1-CE2 3.36Å; Y341-Y459 AromaticContact CE1-CZ 3.94Å; Y341-Y459 AromaticContact CZ-CE2 3.87Å; Y341-Y459 PolarHBondContact OH-OH 3.14Å; S455-Y459 VanDerWaalsContact O-CB 3.3Å; S455-Y459 WeakPolarHBondContact O-CB 3.2Å; S455-Y459 PolarHBondContact O-N 3.29Å; E456-Y459 WeakPolarHBondContact O-CB 3.38Å; E456-Y459 PolarHBondContact O-N 3.33Å; E456-Y459 VanDerWaalsContact O-N 3.17Å; S457-Y459 VanDerWaalsContact C-N 3.31Å; S457-Y459 PolarHBondContact O-N 3.27Å; Y459-K461 PolarHBondContact O-N 3Å; Y459-L462 PolarHBondContact O-N 2.94Å; Y459-A463 HydrophobicContact CE1-CB 4.18Å; Y459-A463 WeakPolarHBondContact O-CB 3.31Å; Y459-A463 PolarHBondContact O-N 2.94Å; Y459-A471 HydrophobicContact CE1-CB 4.06Å; Y459-A471 VanDerWaalsContact OH-CA 3.28Å; Y459-A471 WeakPolarHBondContact OH-CA 3.42Å; Y459-A471 WeakPolarHBondContact OH-CB 3.44Å; Y459-A471 PolarHBondContact OH-O 2.92Å; Y459-F475 HydrophobicContact CD1-CB 4.1Å; Y459-F475 HydrophobicContact CD1-CD1 4.2Å; Y459-F475 AromaticContact CD1-CD2 3.76Å; Y459-F475 HydrophobicContact CD1-CD2 3.76Å; Y459-F475 HydrophobicContact CD1-CE2 4.19Å; Y459-F475 AromaticContact CD1-CG 3.77Å; Y459-F475 HydrophobicContact CD1-CG 3.77Å; Y459-F475 AromaticContact CD2-CD2 3.65Å; Y459-F475 HydrophobicContact CD2-CD2 3.65Å; Y459-F475 AromaticContact CD2-CE2 3.99Å; Y459-F475 HydrophobicContact CD2-CE2 3.99Å; Y459-F475 HydrophobicContact CD2-CG 4.41Å; Y459-F475 HydrophobicContact CE1-CB 3.55Å; Y459-F475 HydrophobicContact CE1-CD1 4.46Å; Y459-F475 AromaticContact CE1-CD2 3.98Å; Y459-F475 HydrophobicContact CE1-CD2 3.98Å; Y459-F475 AromaticContact CE1-CG 3.77Å; Y459-F475 HydrophobicContact CE1-CG 3.77Å; Y459-F475 HydrophobicContact CE2-CB 4.31Å; Y459-F475 AromaticContact CE2-CD2 3.85Å; Y459-F475 HydrophobicContact CE2-CD2 3.85Å; Y459-F475 HydrophobicContact CE2-CG 4.39Å; Y459-F475 AromaticContact CG-CD2 3.6Å; Y459-F475 HydrophobicContact CG-CD2 3.6Å; Y459-F475 AromaticContact CG-CE2 3.75Å; Y459-F475 HydrophobicContact CG-CE2 3.75Å; Y459-F475 HydrophobicContact CG-CG 4.12Å; Y459-F475 HydrophobicContact CG-CZ 4.38Å
460	T	94.2	Very high	93	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-67.8	-21.6	179.6	72.7	0	0	0	0	114	V199 R207 I211 E456 S457 L458	V199-T460 HydrophobicContact CG2-CG2 3.68Å; R207-T460 PolarHBondContact NH1-O 2.69Å; I211-T460 HydrophobicContact CD1-CG2 4.33Å; E456-T460 WeakPolarHBondContact O-CG2 3.33Å; E456-T460 PolarHBondContact O-N 3.44Å; S457-T460 PolarHBondContact O-N 2.86Å; S457-T460 PolarHBondContact O-OG1 3.27Å; L458-T460 VanDerWaalsContact C-N 3.33Å; L458-T460 PolarHBondContact O-N 3.09Å
461	K	93.1	Very high	92.9	Very high	21 Å²	21	18.3 Å²	18.3	9%	0.091	10%	0.104	C	C	.	.	H	α-helix	trans	-85.6	-32	177	-70.1	172.7	-171	-172.8	0	112.5	R204 T208 D400 S457 L458 Y459 V524	R204-K461 WeakPolarHBondContact O-CE 3.11Å; R204-K461 PolarHBondContact O-NZ 3.24Å; T208-K461 PolarHBondContact OG1-NZ 3.37Å; D400-K461 IonicContact OD1-NZ 3.65Å; D400-K461 PolarHBondContact OD1-NZ 3.49Å; D400-K461 WeakPolarHBondContact OD2-CE 3.42Å; D400-K461 IonicContact OD2-NZ 2.69Å; D400-K461 PolarHBondContact OD2-NZ 3.44Å; S457-K461 VanDerWaalsContact O-CG 3.31Å; S457-K461 WeakPolarHBondContact O-CG 3.43Å; S457-K461 PolarHBondContact O-N 2.99Å; S457-K461 WeakPolarHBondContact OG-CE 3.36Å; S457-K461 PolarHBondContact OG-NZ 2.9Å; L458-K461 PolarHBondContact O-N 3.37Å; L458-K461 VanDerWaalsContact O-N 3.13Å; Y459-K461 PolarHBondContact O-N 3Å; K461-V524 HydrophobicContact CB-CG1 4.03Å; K461-V524 HydrophobicContact CB-CG2 3.8Å; K461-V524 HydrophobicContact CD-CG1 4.25Å; K461-V524 HydrophobicContact CD-CG2 3.93Å; K461-V524 HydrophobicContact CG-CG1 4.48Å; K461-V524 HydrophobicContact CG-CG2 4.48Å
462	L	92.3	Very high	92.8	Very high	51 Å²	51	18.3 Å²	18.3	27%	0.267	10%	0.104	S	C	.	.	H	α-helix	trans	-93.5	-28.7	-177.4	-65.5	174	0	0	0	113.2	N336 I337 L340 L458 Y459 F522 V524	N336-L462 HydrophobicContact CB-CD1 4.1Å; I337-L462 HydrophobicContact CD1-CB 4.03Å; L340-L462 HydrophobicContact CD1-CD1 4.08Å; L458-L462 WeakPolarHBondContact O-CB 3.06Å; L458-L462 VanDerWaalsContact O-CG 3.28Å; L458-L462 WeakPolarHBondContact O-CG 3.19Å; L458-L462 PolarHBondContact O-N 2.98Å; Y459-L462 PolarHBondContact O-N 2.94Å; L462-F522 HydrophobicContact CD1-CD1 4.37Å; L462-V524 HydrophobicContact CD2-CG2 4.41Å
463	A	91.8	Very high	92.9	Very high	2 Å²	2	18.1 Å²	18.1	2%	0.017	10%	0.104	C	C	.	.	S	Bend	trans	-70.3	149.5	176.7	0	0	0	0	0	111.7	I337 Y459 V465 M468 A471	I337-A463 HydrophobicContact CD1-CB 4.39Å; Y459-A463 HydrophobicContact CE1-CB 4.18Å; Y459-A463 WeakPolarHBondContact O-CB 3.31Å; Y459-A463 PolarHBondContact O-N 2.94Å; A463-V465 PolarHBondContact O-N 3.39Å; A463-M468 HydrophobicContact CB-CE 4.26Å; A463-A471 HydrophobicContact CB-CB 4.01Å
464	P	86.2	Confident	92.9	Very high	36 Å²	36	20.5 Å²	20.5	23%	0.234	12%	0.117	C	C	.	.			trans	-62.9	120.8	177.7	25.8	-33.8	0	0	0	110.8	Y332 S466 D467 M468	Y332-P464 HydrophobicContact CE1-CG 4.34Å; P464-S466 VanDerWaalsContact C-N 3.27Å; P464-S466 PolarHBondContact O-N 3Å; P464-D467 HydrophobicContact CG-CB 4.42Å; P464-D467 CarbonylContact O-C 3.59Å; P464-D467 PolarHBondContact O-N 2.78Å; P464-M468 PolarHBondContact O-N 3.29Å
465	V	83.8	Confident	92.9	Very high	48 Å²	48	20.5 Å²	20.5	29%	0.291	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-67.1	-30.1	-178.3	-177.8	0	0	0	0	111.8	A463 D467 M468	A463-V465 PolarHBondContact O-N 3.39Å; V465-D467 VanDerWaalsContact C-N 3.26Å; V465-D467 PolarHBondContact O-N 3.48Å; V465-M468 HydrophobicContact CG2-CE 4.41Å; V465-M468 WeakPolarHBondContact O-CB 3.28Å; V465-M468 PolarHBondContact O-N 3.04Å
466	S	83.5	Confident	92.9	Very high	117 Å²	117	20.7 Å²	20.7	82%	0.818	12%	0.118	S	C	*	.	G	3₁₀ helix	trans	-66.2	-24.6	177.1	52	0	0	0	0	113.9	P464	P464-S466 VanDerWaalsContact C-N 3.27Å; P464-S466 PolarHBondContact O-N 3Å
467	D	89	Confident	92.9	Very high	22 Å²	22	22.3 Å²	22.3	12%	0.118	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-121.4	39.8	179.8	-160.8	8	0	0	0	111.1	Y145 Y332 P464 V465 D469 R470 A471	Y145-D467 WeakPolarHBondContact CD2-OD1 3.31Å; Y145-D467 WeakPolarHBondContact CE2-OD1 3.29Å; Y332-D467 WeakPolarHBondContact OH-CB 3.47Å; Y332-D467 VanDerWaalsContact OH-CG 3.28Å; Y332-D467 PolarHBondContact OH-O 2.97Å; Y332-D467 VanDerWaalsContact OH-O 3.04Å; Y332-D467 PolarHBondContact OH-OD2 3.44Å; P464-D467 HydrophobicContact CG-CB 4.42Å; P464-D467 CarbonylContact O-C 3.59Å; P464-D467 PolarHBondContact O-N 2.78Å; V465-D467 VanDerWaalsContact C-N 3.26Å; V465-D467 PolarHBondContact O-N 3.48Å; D467-D469 VanDerWaalsContact C-N 3.33Å; D467-D469 PolarHBondContact O-N 3.25Å; D467-R470 PolarHBondContact O-N 3Å; D467-R470 WeakPolarHBondContact OD1-CB 3.44Å; D467-R470 IonicContact OD1-NE 3.04Å; D467-R470 WeakPolarHBondContact OD2-CD 3.4Å; D467-R470 IonicContact OD2-CZ 3.4Å; D467-R470 IonicContact OD2-NE 2.68Å; D467-R470 PolarHBondContact OD2-NE 2.84Å; D467-R470 IonicContact OD2-NH1 3.9Å; D467-A471 WeakPolarHBondContact O-CB 3.2Å; D467-A471 PolarHBondContact O-N 3.22Å
468	M	91.3	Very high	93.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.2	-29.2	-174.4	-170.5	58.4	52.3	0	0	113.2	A196 V199 A463 P464 V465 A471 Q472	A196-M468 HydrophobicContact CB-CB 4.28Å; A196-M468 HydrophobicContact CB-CG 3.85Å; V199-M468 HydrophobicContact CB-CG 4.03Å; V199-M468 HydrophobicContact CB-SD 4.26Å; V199-M468 HydrophobicContact CG1-CE 3.67Å; V199-M468 HydrophobicContact CG1-CG 4.01Å; V199-M468 HydrophobicContact CG1-SD 3.91Å; V199-M468 HydrophobicContact CG2-SD 4.31Å; A463-M468 HydrophobicContact CB-CE 4.26Å; P464-M468 PolarHBondContact O-N 3.29Å; V465-M468 HydrophobicContact CG2-CE 4.41Å; V465-M468 WeakPolarHBondContact O-CB 3.28Å; V465-M468 PolarHBondContact O-N 3.04Å; M468-A471 PolarHBondContact O-N 3.26Å; M468-A471 HydrophobicContact SD-CB 4.13Å; M468-Q472 HydrophobicContact CG-CG 4.17Å; M468-Q472 WeakPolarHBondContact O-CB 3.33Å; M468-Q472 WeakPolarHBondContact O-CG 3.39Å; M468-Q472 PolarHBondContact O-N 2.94Å; M468-Q472 HydrophobicContact SD-CG 3.93Å
469	D	92.3	Very high	93.2	Very high	6 Å²	6	24 Å²	24	3%	0.032	14%	0.137	C	C	.	.	H	α-helix	trans	-60	-51	174.2	-63.7	-55.9	0	0	0	110.1	S144 R200 D467 T473	S144-D469 PolarHBondContact OG-OD1 3.35Å; R200-D469 IonicContact CZ-OD1 2.76Å; R200-D469 IonicContact CZ-OD2 3.62Å; R200-D469 IonicContact NH1-OD1 3.5Å; R200-D469 PolarHBondContact NH1-OD1 3.11Å; R200-D469 VanDerWaalsContact NH1-OD1 3.16Å; R200-D469 IonicContact NH1-OD2 3.18Å; R200-D469 IonicContact NH2-OD1 2.78Å; R200-D469 PolarHBondContact NH2-OD1 2.93Å; R200-D469 IonicContact NH2-OD2 3.47Å; R200-D469 PolarHBondContact NH2-OD2 3.48Å; D467-D469 VanDerWaalsContact C-N 3.33Å; D467-D469 PolarHBondContact O-N 3.25Å; D469-T473 WeakPolarHBondContact O-CB 3.11Å; D469-T473 PolarHBondContact O-N 3.48Å; D469-T473 PolarHBondContact O-OG1 3.2Å
470	R	92.7	Very high	93.2	Very high	62 Å²	62	24.8 Å²	24.8	23%	0.234	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-41.3	177.9	-173.2	-177	-66.9	-176.8	-4.4	111.5	Y145 S328 Y332 D467 T473 I474	Y145-R470 HydrophobicContact CD2-CB 4.45Å; Y145-R470 PolarHBondContact OH-NH2 2.97Å; S328-R470 PolarHBondContact OG-NH1 3.05Å; Y332-R470 HydrophobicContact CE2-CG 4.31Å; D467-R470 PolarHBondContact O-N 3Å; D467-R470 WeakPolarHBondContact OD1-CB 3.44Å; D467-R470 IonicContact OD1-NE 3.04Å; D467-R470 WeakPolarHBondContact OD2-CD 3.4Å; D467-R470 IonicContact OD2-CZ 3.4Å; D467-R470 IonicContact OD2-NE 2.68Å; D467-R470 PolarHBondContact OD2-NE 2.84Å; D467-R470 IonicContact OD2-NH1 3.9Å; R470-T473 WeakPolarHBondContact O-CB 3.4Å; R470-T473 PolarHBondContact O-N 2.85Å; R470-I474 HydrophobicContact CG-CD1 4.06Å; R470-I474 WeakPolarHBondContact O-CG1 3.28Å; R470-I474 PolarHBondContact O-N 3.13Å
471	A	94.4	Very high	93.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-56.4	-57.7	176.8	0	0	0	0	0	111.3	Y332 Y459 A463 D467 M468 T473 I474 F475	Y332-A471 HydrophobicContact CE1-CB 3.67Å; Y459-A471 HydrophobicContact CE1-CB 4.06Å; Y459-A471 VanDerWaalsContact OH-CA 3.28Å; Y459-A471 WeakPolarHBondContact OH-CA 3.42Å; Y459-A471 WeakPolarHBondContact OH-CB 3.44Å; Y459-A471 PolarHBondContact OH-O 2.92Å; A463-A471 HydrophobicContact CB-CB 4.01Å; D467-A471 WeakPolarHBondContact O-CB 3.2Å; D467-A471 PolarHBondContact O-N 3.22Å; M468-A471 PolarHBondContact O-N 3.26Å; M468-A471 HydrophobicContact SD-CB 4.13Å; A471-T473 PolarHBondContact O-N 2.91Å; A471-I474 PolarHBondContact O-N 3.32Å; A471-F475 WeakPolarHBondContact O-CB 3.46Å; A471-F475 PolarHBondContact O-N 3.43Å
472	Q	95.3	Very high	93.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-34.7	178.8	-72.5	-63.3	-27.8	0	0	112.1	P192 A196 M468 F475 R476	P192-Q472 HydrophobicContact CB-CB 4.07Å; P192-Q472 WeakPolarHBondContact O-CB 3.42Å; A196-Q472 HydrophobicContact CB-CG 4.28Å; M468-Q472 HydrophobicContact CG-CG 4.17Å; M468-Q472 WeakPolarHBondContact O-CB 3.33Å; M468-Q472 WeakPolarHBondContact O-CG 3.39Å; M468-Q472 PolarHBondContact O-N 2.94Å; M468-Q472 HydrophobicContact SD-CG 3.93Å; Q472-F475 PolarHBondContact O-N 3.19Å; Q472-R476 WeakPolarHBondContact O-CB 3.32Å; Q472-R476 WeakPolarHBondContact O-CG 3.27Å; Q472-R476 PolarHBondContact O-N 3.39Å
473	T	96.7	Very high	93.5	Very high	13 Å²	13	25.6 Å²	25.6	8%	0.08	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-54.1	176.5	-57.5	0	0	0	0	111.5	P138 G141 D469 R470 A471 F475 R476 T477	P138-T473 HydrophobicContact CB-CG2 4.47Å; G141-T473 WeakPolarHBondContact CA-OG1 3.14Å; D469-T473 WeakPolarHBondContact O-CB 3.11Å; D469-T473 PolarHBondContact O-N 3.48Å; D469-T473 PolarHBondContact O-OG1 3.2Å; R470-T473 WeakPolarHBondContact O-CB 3.4Å; R470-T473 PolarHBondContact O-N 2.85Å; A471-T473 PolarHBondContact O-N 2.91Å; T473-F475 VanDerWaalsContact C-N 3.31Å; T473-F475 PolarHBondContact O-N 2.91Å; T473-R476 PolarHBondContact O-N 2.87Å; T473-T477 WeakPolarHBondContact O-CB 3.4Å; T473-T477 PolarHBondContact O-N 3.07Å; T473-T477 PolarHBondContact O-OG1 2.76Å
474	I	96.4	Very high	93.5	Very high	51 Å²	51	28.2 Å²	28.2	26%	0.262	16%	0.161	S	C	.	.	H	α-helix	trans	-59.4	-46.9	178.8	-64.1	166.5	0	0	0	110	Y332 Y341 R470 A471 R476 T477 V478	Y332-I474 HydrophobicContact CD1-CD1 4.06Å; Y332-I474 HydrophobicContact CD2-CD1 4.06Å; Y332-I474 HydrophobicContact CE1-CD1 4.39Å; Y332-I474 HydrophobicContact CE2-CD1 4.39Å; Y332-I474 HydrophobicContact CG-CD1 3.88Å; Y341-I474 HydrophobicContact CE1-CG2 4.12Å; Y341-I474 HydrophobicContact CE2-CG2 4.15Å; Y341-I474 WeakPolarHBondContact OH-CG2 3.48Å; R470-I474 HydrophobicContact CG-CD1 4.06Å; R470-I474 WeakPolarHBondContact O-CG1 3.28Å; R470-I474 PolarHBondContact O-N 3.13Å; A471-I474 PolarHBondContact O-N 3.32Å; I474-R476 PolarHBondContact O-N 3.36Å; I474-T477 PolarHBondContact O-N 2.78Å; I474-V478 WeakPolarHBondContact O-CG2 3.46Å; I474-V478 PolarHBondContact O-N 2.65Å
475	F	97.5	Very high	93.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-47.2	-178.4	-173.7	-109.1	0	0	0	112.9	Y341 N344 E456 Y459 A471 Q472 T473 V478 I479	Y341-F475 AromaticContact CD1-CD2 3.96Å; Y341-F475 HydrophobicContact CD1-CD2 3.96Å; Y341-F475 HydrophobicContact CE1-CB 4.34Å; Y341-F475 AromaticContact CE1-CD2 3.99Å; Y341-F475 HydrophobicContact CE1-CD2 3.99Å; N344-F475 HydrophobicContact CB-CE2 4.14Å; N344-F475 HydrophobicContact CB-CZ 4.22Å; N344-F475 WeakPolarHBondContact ND2-CE2 3.28Å; N344-F475 WeakPolarHBondContact ND2-CZ 3.43Å; N344-F475 WeakPolarHBondContact OD1-CZ 3.42Å; E456-F475 HydrophobicContact CB-CE1 4.16Å; E456-F475 HydrophobicContact CB-CZ 4.12Å; E456-F475 HydrophobicContact CG-CE1 3.82Å; E456-F475 HydrophobicContact CG-CZ 4.25Å; Y459-F475 HydrophobicContact CD1-CB 4.1Å; Y459-F475 HydrophobicContact CD1-CD1 4.2Å; Y459-F475 AromaticContact CD1-CD2 3.76Å; Y459-F475 HydrophobicContact CD1-CD2 3.76Å; Y459-F475 HydrophobicContact CD1-CE2 4.19Å; Y459-F475 AromaticContact CD1-CG 3.77Å; Y459-F475 HydrophobicContact CD1-CG 3.77Å; Y459-F475 AromaticContact CD2-CD2 3.65Å; Y459-F475 HydrophobicContact CD2-CD2 3.65Å; Y459-F475 AromaticContact CD2-CE2 3.99Å; Y459-F475 HydrophobicContact CD2-CE2 3.99Å; Y459-F475 HydrophobicContact CD2-CG 4.41Å; Y459-F475 HydrophobicContact CE1-CB 3.55Å; Y459-F475 HydrophobicContact CE1-CD1 4.46Å; Y459-F475 AromaticContact CE1-CD2 3.98Å; Y459-F475 HydrophobicContact CE1-CD2 3.98Å; Y459-F475 AromaticContact CE1-CG 3.77Å; Y459-F475 HydrophobicContact CE1-CG 3.77Å; Y459-F475 HydrophobicContact CE2-CB 4.31Å; Y459-F475 AromaticContact CE2-CD2 3.85Å; Y459-F475 HydrophobicContact CE2-CD2 3.85Å; Y459-F475 HydrophobicContact CE2-CG 4.39Å; Y459-F475 AromaticContact CG-CD2 3.6Å; Y459-F475 HydrophobicContact CG-CD2 3.6Å; Y459-F475 AromaticContact CG-CE2 3.75Å; Y459-F475 HydrophobicContact CG-CE2 3.75Å; Y459-F475 HydrophobicContact CG-CG 4.12Å; Y459-F475 HydrophobicContact CG-CZ 4.38Å; A471-F475 WeakPolarHBondContact O-CB 3.46Å; A471-F475 PolarHBondContact O-N 3.43Å; Q472-F475 PolarHBondContact O-N 3.19Å; T473-F475 VanDerWaalsContact C-N 3.31Å; T473-F475 PolarHBondContact O-N 2.91Å; F475-V478 PolarHBondContact O-N 2.65Å; F475-I479 HydrophobicContact CD1-CD1 3.97Å; F475-I479 HydrophobicContact CE1-CD1 3.61Å; F475-I479 HydrophobicContact CZ-CD1 4.06Å; F475-I479 PolarHBondContact O-N 3.26Å
476	R	96.8	Very high	94.3	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.015	15%	0.15	C	C	.	.	H	α-helix	trans	-73.2	-32.3	178.5	-63.8	-41.3	177.8	178.1	4.5	113.2	T137 P192 E456 Q472 T473 I474 V478 I479 N480	T137-R476 HydrophobicContact CG2-CB 3.81Å; P192-R476 HydrophobicContact CG-CB 4.04Å; P192-R476 HydrophobicContact CG-CG 4.13Å; E456-R476 IonicContact OE1-CZ 3.16Å; E456-R476 IonicContact OE1-NH1 2.99Å; E456-R476 IonicContact OE1-NH2 2.97Å; E456-R476 PolarHBondContact OE1-NH2 3.49Å; E456-R476 IonicContact OE2-CZ 3.62Å; E456-R476 VanDerWaalsContact OE2-CZ 3.28Å; E456-R476 IonicContact OE2-NH1 3.52Å; E456-R476 PolarHBondContact OE2-NH1 2.97Å; E456-R476 IonicContact OE2-NH2 2.67Å; E456-R476 PolarHBondContact OE2-NH2 2.96Å; Q472-R476 WeakPolarHBondContact O-CB 3.32Å; Q472-R476 WeakPolarHBondContact O-CG 3.27Å; Q472-R476 PolarHBondContact O-N 3.39Å; T473-R476 PolarHBondContact O-N 2.87Å; I474-R476 PolarHBondContact O-N 3.36Å; R476-V478 VanDerWaalsContact C-N 3.31Å; R476-V478 PolarHBondContact O-N 3.31Å; R476-I479 PolarHBondContact O-N 3.29Å; R476-N480 WeakPolarHBondContact O-CB 3.38Å; R476-N480 PolarHBondContact O-N 3.33Å; R476-N480 PolarHBondContact O-ND2 3.05Å
477	T	97.6	Very high	94.6	Very high	33 Å²	33	22.9 Å²	22.9	20%	0.202	12%	0.123	C	C	.	.	H	α-helix	trans	-59.3	-44.1	170.5	-62.5	0	0	0	0	110.9	L134 P138 T473 I474 I479 N480 V481	L134-T477 HydrophobicContact CD1-CG2 4.15Å; P138-T477 HydrophobicContact CG-CG2 4.36Å; P138-T477 WeakPolarHBondContact CG-OG1 3.43Å; T473-T477 WeakPolarHBondContact O-CB 3.4Å; T473-T477 PolarHBondContact O-N 3.07Å; T473-T477 PolarHBondContact O-OG1 2.76Å; I474-T477 PolarHBondContact O-N 2.78Å; T477-I479 VanDerWaalsContact C-N 3.32Å; T477-I479 PolarHBondContact O-N 3.05Å; T477-N480 PolarHBondContact O-N 3.03Å; T477-N480 VanDerWaalsContact O-N 3.16Å; T477-V481 WeakPolarHBondContact O-CG2 3.49Å; T477-V481 PolarHBondContact O-N 3.19Å
478	V	97.9	Very high	94.7	Very high	32 Å²	32	29.7 Å²	29.7	19%	0.194	15%	0.149	C	C	.	.	H	α-helix	trans	-58.4	-44.4	174.8	171.7	0	0	0	0	111.6	Y341 F345 I474 F475 R476 V481 A482	Y341-V478 HydrophobicContact CD1-CG2 4.29Å; Y341-V478 HydrophobicContact CG-CG2 4.29Å; F345-V478 HydrophobicContact CB-CG1 3.94Å; F345-V478 HydrophobicContact CD2-CG1 4.46Å; I474-V478 WeakPolarHBondContact O-CG2 3.46Å; I474-V478 PolarHBondContact O-N 2.65Å; F475-V478 PolarHBondContact O-N 2.65Å; R476-V478 VanDerWaalsContact C-N 3.31Å; R476-V478 PolarHBondContact O-N 3.31Å; V478-V481 PolarHBondContact O-N 3.4Å; V478-A482 PolarHBondContact O-N 2.96Å
479	I	97.4	Very high	94.7	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-43.6	175.9	-71.4	170.2	0	0	0	111.2	N344 Y348 F475 R476 T477 V481 A482 F483	N344-I479 HydrophobicContact CB-CD1 4.31Å; N344-I479 HydrophobicContact CB-CG1 3.96Å; Y348-I479 HydrophobicContact CD1-CG2 3.76Å; Y348-I479 HydrophobicContact CD2-CB 4.3Å; Y348-I479 HydrophobicContact CD2-CD1 4.09Å; Y348-I479 HydrophobicContact CD2-CG1 3.75Å; Y348-I479 HydrophobicContact CD2-CG2 3.76Å; Y348-I479 HydrophobicContact CE1-CG2 3.88Å; Y348-I479 HydrophobicContact CE2-CD1 3.62Å; Y348-I479 HydrophobicContact CE2-CG1 3.83Å; Y348-I479 HydrophobicContact CE2-CG2 3.89Å; Y348-I479 HydrophobicContact CG-CG1 4.47Å; Y348-I479 HydrophobicContact CG-CG2 3.7Å; F475-I479 HydrophobicContact CD1-CD1 3.97Å; F475-I479 HydrophobicContact CE1-CD1 3.61Å; F475-I479 HydrophobicContact CZ-CD1 4.06Å; F475-I479 PolarHBondContact O-N 3.26Å; R476-I479 PolarHBondContact O-N 3.29Å; T477-I479 VanDerWaalsContact C-N 3.32Å; T477-I479 PolarHBondContact O-N 3.05Å; I479-V481 VanDerWaalsContact C-N 3.33Å; I479-V481 PolarHBondContact O-N 3.36Å; I479-A482 CarbonylContact O-C 3.54Å; I479-A482 WeakPolarHBondContact O-CA 3.32Å; I479-A482 WeakPolarHBondContact O-CB 3.14Å; I479-A482 PolarHBondContact O-N 3Å; I479-A482 VanDerWaalsContact O-N 3.08Å; I479-F483 PolarHBondContact O-N 3.11Å
480	N	96.4	Very high	94.5	Very high	16 Å²	16	30.9 Å²	30.9	9%	0.086	16%	0.156	C	C	.	.	H	α-helix	trans	-68.6	-30.9	-179.1	-69.1	-25.9	0	0	0	112.7	I133 L134 T137 R476 T477 A482 F483 L484	I133-N480 HydrophobicContact CG2-CB 4.37Å; I133-N480 WeakPolarHBondContact CG2-ND2 3.29Å; L134-N480 HydrophobicContact CB-CB 4.36Å; L134-N480 HydrophobicContact CD1-CB 3.93Å; T137-N480 PolarHBondContact OG1-ND2 3.06Å; R476-N480 WeakPolarHBondContact O-CB 3.38Å; R476-N480 PolarHBondContact O-N 3.33Å; R476-N480 PolarHBondContact O-ND2 3.05Å; T477-N480 PolarHBondContact O-N 3.03Å; T477-N480 VanDerWaalsContact O-N 3.16Å; N480-A482 VanDerWaalsContact C-N 3.35Å; N480-F483 PolarHBondContact O-N 3.42Å; N480-L484 PolarHBondContact O-N 3.22Å
481	V	97.4	Very high	94.1	Very high	53 Å²	53	29.3 Å²	29.3	32%	0.321	16%	0.159	S	C	.	.	H	α-helix	trans	-62.6	-45.8	169.1	179.6	0	0	0	0	109.7	L134 F345 T477 V478 I479 F483 L484 V485	L134-V481 HydrophobicContact CD1-CG2 3.6Å; F345-V481 HydrophobicContact CE2-CB 4.4Å; F345-V481 HydrophobicContact CE2-CG1 3.95Å; T477-V481 WeakPolarHBondContact O-CG2 3.49Å; T477-V481 PolarHBondContact O-N 3.19Å; V478-V481 PolarHBondContact O-N 3.4Å; I479-V481 VanDerWaalsContact C-N 3.33Å; I479-V481 PolarHBondContact O-N 3.36Å; V481-F483 VanDerWaalsContact C-N 3.28Å; V481-F483 PolarHBondContact O-N 2.99Å; V481-L484 PolarHBondContact O-N 3.44Å; V481-V485 HydrophobicContact CG1-CG2 4.07Å; V481-V485 WeakPolarHBondContact O-CB 3.3Å; V481-V485 VanDerWaalsContact O-CG2 3.26Å; V481-V485 WeakPolarHBondContact O-CG2 3.37Å; V481-V485 PolarHBondContact O-N 3.41Å
482	A	96.9	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-37.4	176.6	0	0	0	0	0	112.4	F345 F349 V478 I479 N480 L484 V485 G486	F345-A482 HydrophobicContact CD2-CB 3.63Å; F345-A482 HydrophobicContact CE2-CB 3.91Å; F345-A482 HydrophobicContact CG-CB 4.13Å; F345-A482 WeakPolarHBondContact O-CB 3.31Å; F349-A482 HydrophobicContact CB-CB 4.11Å; V478-A482 PolarHBondContact O-N 2.96Å; I479-A482 CarbonylContact O-C 3.54Å; I479-A482 WeakPolarHBondContact O-CA 3.32Å; I479-A482 WeakPolarHBondContact O-CB 3.14Å; I479-A482 PolarHBondContact O-N 3Å; I479-A482 VanDerWaalsContact O-N 3.08Å; N480-A482 VanDerWaalsContact C-N 3.35Å; A482-L484 VanDerWaalsContact C-N 3.29Å; A482-L484 PolarHBondContact O-N 3.16Å; A482-V485 PolarHBondContact O-N 3.38Å; A482-G486 PolarHBondContact O-N 3.26Å
483	F	91.7	Very high	93.3	Very high	37 Å²	37	35.8 Å²	35.8	16%	0.162	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-31	177.9	-150.7	-100.4	0	0	0	113.2	Y348 M352 I479 N480 V481 P487	Y348-F483 HydrophobicContact CD1-CD2 4.49Å; M352-F483 HydrophobicContact CE-CD1 3.73Å; M352-F483 HydrophobicContact CE-CD2 3.77Å; M352-F483 HydrophobicContact CE-CE1 3.6Å; M352-F483 HydrophobicContact CE-CE2 3.66Å; M352-F483 HydrophobicContact CE-CG 3.85Å; M352-F483 HydrophobicContact CE-CZ 3.61Å; M352-F483 HydrophobicContact CG-CD2 3.63Å; M352-F483 HydrophobicContact CG-CE2 4.02Å; M352-F483 HydrophobicContact CG-CG 4.21Å; M352-F483 HydrophobicContact SD-CD2 3.56Å; M352-F483 VanDerWaalsContact SD-CD2 3.56Å; M352-F483 HydrophobicContact SD-CE1 4.39Å; M352-F483 HydrophobicContact SD-CE2 3.31Å; M352-F483 WeakPolarHBondContact SD-CE2 3.26Å; M352-F483 HydrophobicContact SD-CG 4.24Å; M352-F483 HydrophobicContact SD-CZ 3.81Å; I479-F483 PolarHBondContact O-N 3.11Å; N480-F483 PolarHBondContact O-N 3.42Å; V481-F483 VanDerWaalsContact C-N 3.28Å; V481-F483 PolarHBondContact O-N 2.99Å; F483-P487 WeakPolarHBondContact O-CD 3.38Å; F483-P487 WeakPolarHBondContact O-CG 3.28Å
484	L	92.1	Very high	92.5	Very high	56 Å²	56	38 Å²	38	29%	0.293	21%	0.21	S	C	.	.	H	α-helix	trans	-81	-46.2	173.7	-177.2	66.7	0	0	0	112	L134 N480 V481 A482	L134-L484 HydrophobicContact CD2-CD2 3.77Å; N480-L484 PolarHBondContact O-N 3.22Å; V481-L484 PolarHBondContact O-N 3.44Å; A482-L484 VanDerWaalsContact C-N 3.29Å; A482-L484 PolarHBondContact O-N 3.16Å
485	V	93.4	Very high	91.9	Very high	49 Å²	49	37.4 Å²	37.4	30%	0.297	22%	0.217	S	C	.	.	H	α-helix	trans	-76.4	-32.9	-172.8	178	0	0	0	0	112.3	F349 V481 A482 Y488 V489	F349-V485 HydrophobicContact CD2-CB 4.44Å; F349-V485 HydrophobicContact CD2-CG1 4.11Å; F349-V485 HydrophobicContact CE2-CG1 3.92Å; V481-V485 HydrophobicContact CG1-CG2 4.07Å; V481-V485 WeakPolarHBondContact O-CB 3.3Å; V481-V485 VanDerWaalsContact O-CG2 3.26Å; V481-V485 WeakPolarHBondContact O-CG2 3.37Å; V481-V485 PolarHBondContact O-N 3.41Å; A482-V485 PolarHBondContact O-N 3.38Å; V485-Y488 WeakPolarHBondContact O-CB 2.86Å; V485-Y488 PolarHBondContact O-N 3.38Å; V485-V489 HydrophobicContact CG1-CG2 4.17Å; V485-V489 WeakPolarHBondContact O-CG2 3.3Å; V485-V489 PolarHBondContact O-N 3.15Å
486	G	94.1	Very high	91.5	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-60.3	179.5	0	0	0	0	0	113.2	F349 S353 A482 Y488 V489 G490	F349-G486 VanDerWaalsContact CD2-CA 3.47Å; S353-G486 WeakPolarHBondContact CA-O 3.47Å; S353-G486 WeakPolarHBondContact CB-O 3.34Å; A482-G486 PolarHBondContact O-N 3.26Å; G486-Y488 VanDerWaalsContact C-N 3.25Å; G486-Y488 PolarHBondContact O-N 3.36Å; G486-V489 PolarHBondContact O-N 3.36Å; G486-G490 PolarHBondContact O-N 3.35Å
487	P	90.6	Very high	91.1	Very high	41 Å²	41	46 Å²	46	27%	0.266	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-32.9	178.2	-23.6	36	0	0	0	112.8	M352 A356 F483 G491	M352-P487 HydrophobicContact CB-CG 3.85Å; M352-P487 HydrophobicContact CE-CG 3.74Å; A356-P487 HydrophobicContact CB-CB 4.04Å; F483-P487 WeakPolarHBondContact O-CD 3.38Å; F483-P487 WeakPolarHBondContact O-CG 3.28Å; P487-G491 WeakPolarHBondContact O-CA 3.39Å; P487-G491 PolarHBondContact O-N 2.99Å
488	Y	89.8	Confident	90.9	Very high	165 Å²	165	46.2 Å²	46.2	65%	0.647	26%	0.255	S	S	*	.	H	α-helix	trans	-61.4	-48.2	175.5	175.7	-101.4	0	0	0	111.3	V485 G486 S492	V485-Y488 WeakPolarHBondContact O-CB 2.86Å; V485-Y488 PolarHBondContact O-N 3.38Å; G486-Y488 VanDerWaalsContact C-N 3.25Å; G486-Y488 PolarHBondContact O-N 3.36Å; Y488-S492 WeakPolarHBondContact O-CB 3.43Å; Y488-S492 PolarHBondContact O-N 3.43Å; Y488-S492 PolarHBondContact O-OG 2.86Å
489	V	91.9	Very high	90.7	Very high	30 Å²	30	48.9 Å²	48.9	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-69.3	-48.7	178	176	0	0	0	0	111.2	F349 V485 G486 G491 S492 L493	F349-V489 HydrophobicContact CE2-CB 3.93Å; F349-V489 HydrophobicContact CE2-CG1 4.49Å; F349-V489 HydrophobicContact CE2-CG2 3.82Å; F349-V489 HydrophobicContact CZ-CB 3.86Å; F349-V489 HydrophobicContact CZ-CG1 3.94Å; F349-V489 HydrophobicContact CZ-CG2 4.06Å; V485-V489 HydrophobicContact CG1-CG2 4.17Å; V485-V489 WeakPolarHBondContact O-CG2 3.3Å; V485-V489 PolarHBondContact O-N 3.15Å; G486-V489 PolarHBondContact O-N 3.36Å; V489-G491 VanDerWaalsContact C-N 3.29Å; V489-G491 PolarHBondContact O-N 3.36Å; V489-S492 PolarHBondContact O-N 3.46Å; V489-L493 HydrophobicContact CG1-CD1 3.93Å; V489-L493 WeakPolarHBondContact O-CB 3.38Å; V489-L493 PolarHBondContact O-N 3.42Å; V489-L493 VanDerWaalsContact O-N 3.12Å
490	G	88.4	Confident	90.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-36.3	180	0	0	0	0	0	113.2	S353 G486 I494	S353-G490 WeakPolarHBondContact OG-CA 3.29Å; G486-G490 PolarHBondContact O-N 3.35Å; G490-I494 WeakPolarHBondContact O-CG1 3.39Å
491	G	84.6	Confident	90.4	Very high	29 Å²	29	48.1 Å²	48.1	30%	0.299	26%	0.263	S	S	.	.	H	α-helix	trans	-84.5	-32.1	178.3	0	0	0	0	0	114.7	P487 V489 I494	P487-G491 WeakPolarHBondContact O-CA 3.39Å; P487-G491 PolarHBondContact O-N 2.99Å; V489-G491 VanDerWaalsContact C-N 3.29Å; V489-G491 PolarHBondContact O-N 3.36Å; G491-I494 WeakPolarHBondContact O-CD1 3.45Å; G491-I494 WeakPolarHBondContact O-CG1 3.39Å
492	S	86.1	Confident	90.4	Very high	73 Å²	73	48.8 Å²	48.8	51%	0.51	26%	0.264	S	S	.	.	H	α-helix	trans	-81	-28	-179.1	-56.6	0	0	0	0	112.7	Y488 V489	Y488-S492 WeakPolarHBondContact O-CB 3.43Å; Y488-S492 PolarHBondContact O-N 3.43Å; Y488-S492 PolarHBondContact O-OG 2.86Å; V489-S492 PolarHBondContact O-N 3.46Å
493	L	86.4	Confident	90.3	Very high	64 Å²	64	50.4 Å²	50.4	34%	0.335	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	23.1	-178.1	-61.9	179.8	0	0	0	113.3	V489 G495 Y496 V500	V489-L493 HydrophobicContact CG1-CD1 3.93Å; V489-L493 WeakPolarHBondContact O-CB 3.38Å; V489-L493 PolarHBondContact O-N 3.42Å; V489-L493 VanDerWaalsContact O-N 3.12Å; L493-G495 PolarHBondContact O-N 3.45Å; L493-G495 VanDerWaalsContact O-N 3.1Å; L493-Y496 CarbonylContact O-C 3.49Å; L493-Y496 WeakPolarHBondContact O-CA 3.44Å; L493-Y496 PolarHBondContact O-N 3.26Å; L493-V500 HydrophobicContact CB-CG2 3.58Å
494	I	79.3	Confident	90.6	Very high	58 Å²	58	48.6 Å²	48.6	30%	0.297	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.3	177.4	-68.6	166.1	0	0	0	112.3	P360 G490 G491 Y496	P360-I494 HydrophobicContact CB-CD1 3.94Å; P360-I494 HydrophobicContact CB-CG1 4.24Å; P360-I494 HydrophobicContact CB-CG2 3.6Å; P360-I494 HydrophobicContact CG-CB 4.44Å; P360-I494 HydrophobicContact CG-CD1 3.56Å; P360-I494 HydrophobicContact CG-CG1 3.67Å; P360-I494 HydrophobicContact CG-CG2 3.89Å; G490-I494 WeakPolarHBondContact O-CG1 3.39Å; G491-I494 WeakPolarHBondContact O-CD1 3.45Å; G491-I494 WeakPolarHBondContact O-CG1 3.39Å; I494-Y496 PolarHBondContact O-N 3.3Å
495	G	83.7	Confident	90.8	Very high	40 Å²	40	48 Å²	48	41%	0.412	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.9	176	0	0	0	0	0	113.7	R364 L493	R364-G495 PolarHBondContact NH1-O 3.49Å; L493-G495 PolarHBondContact O-N 3.45Å; L493-G495 VanDerWaalsContact O-N 3.1Å
496	Y	90.1	Very high	91	Very high	160 Å²	160	50.6 Å²	50.6	63%	0.627	27%	0.274	S	S	*	.			trans	-133.1	66.6	-173.2	-55.5	-79.3	0	0	0	110.8	L493 I494 T498 L499 V500	L493-Y496 CarbonylContact O-C 3.49Å; L493-Y496 WeakPolarHBondContact O-CA 3.44Å; L493-Y496 PolarHBondContact O-N 3.26Å; I494-Y496 PolarHBondContact O-N 3.3Å; Y496-T498 PolarHBondContact O-N 3.44Å; Y496-T498 VanDerWaalsContact O-N 3.14Å; Y496-L499 HydrophobicContact CG-CD1 4.18Å; Y496-L499 WeakPolarHBondContact O-CB 3.46Å; Y496-L499 PolarHBondContact O-N 3.29Å; Y496-V500 PolarHBondContact O-N 3.36Å
497	P	88.5	Confident	91.1	Very high	24 Å²	24	53 Å²	53	16%	0.156	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-28.1	-173.2	27.7	-36.3	0	0	0	112.9	V361 V422 L499 V500 F501	V361-P497 HydrophobicContact CG2-CB 3.62Å; V361-P497 HydrophobicContact CG2-CG 4.31Å; V422-P497 HydrophobicContact CG1-CB 3.71Å; V422-P497 HydrophobicContact CG1-CG 3.62Å; P497-L499 VanDerWaalsContact C-N 3.28Å; P497-L499 PolarHBondContact O-N 3.02Å; P497-V500 WeakPolarHBondContact O-CB 3.39Å; P497-V500 PolarHBondContact O-N 3.43Å; P497-V500 VanDerWaalsContact O-N 3.15Å; P497-F501 HydrophobicContact CB-CE2 4.49Å; P497-F501 WeakPolarHBondContact O-CD2 3.42Å; P497-F501 PolarHBondContact O-N 3.28Å; P497-F501 VanDerWaalsContact O-N 3.08Å
498	T	92.6	Very high	91.5	Very high	38 Å²	38	51.2 Å²	51.2	23%	0.233	28%	0.276	C	S	.	.	H	α-helix	trans	-57.7	-39.3	171.8	-48	0	0	0	0	112.2	T419 Y423 Y496 L502	T419-T498 HydrophobicContact CG2-CG2 4.07Å; Y423-T498 HydrophobicContact CD2-CG2 4.12Å; Y423-T498 HydrophobicContact CG-CG2 4.5Å; Y496-T498 PolarHBondContact O-N 3.44Å; Y496-T498 VanDerWaalsContact O-N 3.14Å; T498-L502 WeakPolarHBondContact O-CB 3.48Å; T498-L502 PolarHBondContact O-N 3.21Å
499	L	93.9	Very high	91.9	Very high	87 Å²	87	44.4 Å²	44.4	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-68.9	-35.4	177.6	-66.1	-179.5	0	0	0	111.8	Y496 P497 S503	Y496-L499 HydrophobicContact CG-CD1 4.18Å; Y496-L499 WeakPolarHBondContact O-CB 3.46Å; Y496-L499 PolarHBondContact O-N 3.29Å; P497-L499 VanDerWaalsContact C-N 3.28Å; P497-L499 PolarHBondContact O-N 3.02Å; L499-S503 WeakPolarHBondContact O-CB 3.19Å; L499-S503 PolarHBondContact O-N 3.41Å
500	V	93.4	Very high	92.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-54.2	174.7	178.9	0	0	0	0	110	S353 A357 L493 Y496 P497 L502 S503 M504	S353-V500 WeakPolarHBondContact OG-CG1 3.48Å; A357-V500 HydrophobicContact CB-CG1 4.12Å; L493-V500 HydrophobicContact CB-CG2 3.58Å; Y496-V500 PolarHBondContact O-N 3.36Å; P497-V500 WeakPolarHBondContact O-CB 3.39Å; P497-V500 PolarHBondContact O-N 3.43Å; P497-V500 VanDerWaalsContact O-N 3.15Å; V500-L502 PolarHBondContact O-N 3.06Å; V500-S503 PolarHBondContact O-N 3.28Å; V500-S503 PolarHBondContact O-OG 2.97Å; V500-M504 HydrophobicContact CG1-SD 3.96Å; V500-M504 WeakPolarHBondContact O-CG 3.5Å; V500-M504 PolarHBondContact O-N 3.1Å; V500-M504 VanDerWaalsContact O-N 3.15Å
501	F	94.7	Very high	92.6	Very high	7 Å²	7	48.6 Å²	48.6	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-36.5	-179.6	-68.4	-63.6	0	0	0	113	L354 L418 T419 V422 P497 S503 M504 F505	L354-F501 HydrophobicContact CD1-CE1 3.63Å; L354-F501 HydrophobicContact CD1-CZ 3.96Å; L418-F501 HydrophobicContact CB-CB 4.4Å; L418-F501 HydrophobicContact CB-CD1 3.71Å; L418-F501 HydrophobicContact CB-CE1 4.13Å; L418-F501 HydrophobicContact CB-CG 3.97Å; L418-F501 HydrophobicContact CD1-CD1 4.04Å; L418-F501 HydrophobicContact CD1-CE1 3.88Å; L418-F501 HydrophobicContact CG-CD1 4.43Å; L418-F501 HydrophobicContact CG-CE1 4.42Å; T419-F501 WeakPolarHBondContact OG1-CB 3.47Å; T419-F501 PolarHBondContact OG1-O 2.86Å; V422-F501 HydrophobicContact CB-CD2 4.09Å; V422-F501 HydrophobicContact CB-CE2 4.43Å; V422-F501 HydrophobicContact CG1-CD2 4.18Å; V422-F501 HydrophobicContact CG1-CE2 4.43Å; V422-F501 HydrophobicContact CG2-CD2 3.7Å; V422-F501 HydrophobicContact CG2-CE2 3.63Å; P497-F501 HydrophobicContact CB-CE2 4.49Å; P497-F501 WeakPolarHBondContact O-CD2 3.42Å; P497-F501 PolarHBondContact O-N 3.28Å; P497-F501 VanDerWaalsContact O-N 3.08Å; F501-S503 VanDerWaalsContact C-N 3.32Å; F501-S503 PolarHBondContact O-N 3.34Å; F501-M504 HydrophobicContact CD1-CE 4.32Å; F501-M504 HydrophobicContact CD1-SD 4.16Å; F501-M504 HydrophobicContact CE1-CE 4.48Å; F501-M504 PolarHBondContact O-N 3.21Å; F501-F505 WeakPolarHBondContact O-CB 3.35Å; F501-F505 PolarHBondContact O-N 2.88Å
502	L	95.7	Very high	93.2	Very high	66 Å²	66	47.9 Å²	47.9	35%	0.346	26%	0.258	S	S	.	.	H	α-helix	trans	-62.1	-41.4	174	-178.7	63.2	0	0	0	111.2	T419 T498 V500 M504 F505 L506	T419-L502 HydrophobicContact CG2-CB 4.02Å; T419-L502 HydrophobicContact CG2-CD1 4.28Å; T419-L502 PolarHBondContact OG1-N 3.2Å; T498-L502 WeakPolarHBondContact O-CB 3.48Å; T498-L502 PolarHBondContact O-N 3.21Å; V500-L502 PolarHBondContact O-N 3.06Å; L502-M504 VanDerWaalsContact C-N 3.32Å; L502-M504 PolarHBondContact O-N 3.25Å; L502-F505 HydrophobicContact CD1-CD1 4.2Å; L502-F505 PolarHBondContact O-N 2.76Å; L502-L506 HydrophobicContact CD1-CD1 4.43Å; L502-L506 HydrophobicContact CD1-CG 4.31Å; L502-L506 HydrophobicContact CG-CD1 4.23Å; L502-L506 WeakPolarHBondContact O-CG 3.44Å; L502-L506 PolarHBondContact O-N 3.09Å
503	S	96	Very high	93.8	Very high	34 Å²	34	49.5 Å²	49.5	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-41.1	176.2	78.3	0	0	0	0	111.9	L499 V500 F501 L506 L507	L499-S503 WeakPolarHBondContact O-CB 3.19Å; L499-S503 PolarHBondContact O-N 3.41Å; V500-S503 PolarHBondContact O-N 3.28Å; V500-S503 PolarHBondContact O-OG 2.97Å; F501-S503 VanDerWaalsContact C-N 3.32Å; F501-S503 PolarHBondContact O-N 3.34Å; S503-L506 PolarHBondContact O-N 3.39Å; S503-L507 WeakPolarHBondContact O-CB 3.49Å; S503-L507 PolarHBondContact O-N 3.19Å
504	M	96.8	Very high	94.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68	-39	177.1	-64.8	161.5	57.3	0	0	111.5	F349 S350 L354 Y415 V500 F501 L502 S508	F349-M504 HydrophobicContact CD1-CG 4.29Å; F349-M504 HydrophobicContact CE1-CG 3.86Å; S350-M504 WeakPolarHBondContact O-CE 3.2Å; L354-M504 HydrophobicContact CB-CE 4.02Å; Y415-M504 HydrophobicContact CD1-CB 4.15Å; Y415-M504 HydrophobicContact CD1-CE 3.71Å; Y415-M504 HydrophobicContact CD2-CB 4.1Å; Y415-M504 HydrophobicContact CE1-CB 4.44Å; Y415-M504 HydrophobicContact CE1-CE 3.25Å; Y415-M504 HydrophobicContact CE2-CB 4.33Å; Y415-M504 HydrophobicContact CG-CB 3.99Å; V500-M504 HydrophobicContact CG1-SD 3.96Å; V500-M504 WeakPolarHBondContact O-CG 3.5Å; V500-M504 PolarHBondContact O-N 3.1Å; V500-M504 VanDerWaalsContact O-N 3.15Å; F501-M504 HydrophobicContact CD1-CE 4.32Å; F501-M504 HydrophobicContact CD1-SD 4.16Å; F501-M504 HydrophobicContact CE1-CE 4.48Å; F501-M504 PolarHBondContact O-N 3.21Å; L502-M504 VanDerWaalsContact C-N 3.32Å; L502-M504 PolarHBondContact O-N 3.25Å; M504-S508 VanDerWaalsContact O-CB 3.26Å; M504-S508 WeakPolarHBondContact O-CB 3.47Å; M504-S508 PolarHBondContact O-N 3.49Å; M504-S508 PolarHBondContact O-OG 3.15Å
505	F	97.7	Very high	95.2	Very high	43 Å²	43	45.4 Å²	45.4	19%	0.189	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-50.3	173.8	169.5	-106.2	0	0	0	111.9	V412 L416 F501 L502 S508 S509	V412-F505 HydrophobicContact CG1-CD2 4.09Å; V412-F505 HydrophobicContact CG1-CE2 3.64Å; L416-F505 HydrophobicContact CB-CD2 3.79Å; L416-F505 HydrophobicContact CB-CE2 3.75Å; L416-F505 HydrophobicContact CD1-CD2 4.48Å; L416-F505 HydrophobicContact CD1-CE2 4.09Å; L416-F505 HydrophobicContact CD1-CZ 4.15Å; L416-F505 HydrophobicContact CD2-CE2 4.48Å; L416-F505 HydrophobicContact CG-CE2 4.32Å; F501-F505 WeakPolarHBondContact O-CB 3.35Å; F501-F505 PolarHBondContact O-N 2.88Å; L502-F505 HydrophobicContact CD1-CD1 4.2Å; L502-F505 PolarHBondContact O-N 2.76Å; F505-S508 PolarHBondContact O-N 3.47Å; F505-S508 PolarHBondContact O-OG 3.15Å; F505-S509 VanDerWaalsContact O-CB 3.28Å; F505-S509 WeakPolarHBondContact O-CB 3.34Å; F505-S509 PolarHBondContact O-N 3.25Å; F505-S509 PolarHBondContact O-OG 3.35Å
506	L	97.3	Very high	95.8	Very high	103 Å²	103	45.7 Å²	45.7	54%	0.539	24%	0.238	S	C	.	.	H	α-helix	trans	-64.5	-45	179.6	-66.9	175.7	0	0	0	111.3	L502 S503 S508 S509 F510	L502-L506 HydrophobicContact CD1-CD1 4.43Å; L502-L506 HydrophobicContact CD1-CG 4.31Å; L502-L506 HydrophobicContact CG-CD1 4.23Å; L502-L506 WeakPolarHBondContact O-CG 3.44Å; L502-L506 PolarHBondContact O-N 3.09Å; S503-L506 PolarHBondContact O-N 3.39Å; L506-S508 VanDerWaalsContact C-N 3.33Å; L506-S508 PolarHBondContact O-N 3.42Å; L506-S509 PolarHBondContact O-N 2.77Å; L506-F510 PolarHBondContact O-N 3.46Å
507	L	96.7	Very high	96.1	Very high	50 Å²	50	43.1 Å²	43.1	26%	0.262	24%	0.242	S	C	.	.	H	α-helix	trans	-66.5	-32.7	-178.3	-171	69.3	0	0	0	112.7	F345 A346 F349 S503 P511	F345-L507 HydrophobicContact CD1-CD1 4.15Å; F345-L507 HydrophobicContact CD1-CD2 3.99Å; F345-L507 HydrophobicContact CD1-CG 4.46Å; F345-L507 HydrophobicContact CE1-CD1 4.04Å; F345-L507 HydrophobicContact CE1-CD2 3.77Å; F345-L507 HydrophobicContact CE1-CG 4.47Å; A346-L507 HydrophobicContact CB-CD2 4.25Å; A346-L507 HydrophobicContact CB-CG 3.86Å; A346-L507 WeakPolarHBondContact CB-O 3.48Å; F349-L507 HydrophobicContact CB-CD2 3.89Å; F349-L507 HydrophobicContact CD1-CD2 3.28Å; F349-L507 HydrophobicContact CD2-CD2 4.36Å; F349-L507 HydrophobicContact CE1-CD2 3.85Å; F349-L507 HydrophobicContact CG-CD2 3.58Å; S503-L507 WeakPolarHBondContact O-CB 3.49Å; S503-L507 PolarHBondContact O-N 3.19Å; L507-P511 WeakPolarHBondContact O-CD 3.13Å; L507-P511 WeakPolarHBondContact O-CG 3.46Å
508	S	97.2	Very high	96.4	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.028	26%	0.256	C	S	.	.	H	α-helix	trans	-81.9	-31.4	175	58.7	0	0	0	0	113	Y415 M504 F505 L506 F510 P511 T512	Y415-S508 WeakPolarHBondContact CD2-OG 3.46Å; M504-S508 VanDerWaalsContact O-CB 3.26Å; M504-S508 WeakPolarHBondContact O-CB 3.47Å; M504-S508 PolarHBondContact O-N 3.49Å; M504-S508 PolarHBondContact O-OG 3.15Å; F505-S508 PolarHBondContact O-N 3.47Å; F505-S508 PolarHBondContact O-OG 3.15Å; L506-S508 VanDerWaalsContact C-N 3.33Å; L506-S508 PolarHBondContact O-N 3.42Å; S508-F510 PolarHBondContact O-N 2.97Å; S508-P511 WeakPolarHBondContact O-CD 3.27Å; S508-P511 WeakPolarHBondContact O-CG 3.48Å; S508-T512 WeakPolarHBondContact O-CB 3.22Å; S508-T512 PolarHBondContact O-N 3.32Å; S508-T512 PolarHBondContact O-OG1 3.46Å
509	S	98.2	Very high	96.6	Very high	23 Å²	23	48.1 Å²	48.1	16%	0.161	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-40.7	177.3	-64.3	0	0	0	0	111.9	F505 L506 T512 L513	F505-S509 VanDerWaalsContact O-CB 3.28Å; F505-S509 WeakPolarHBondContact O-CB 3.34Å; F505-S509 PolarHBondContact O-N 3.25Å; F505-S509 PolarHBondContact O-OG 3.35Å; L506-S509 PolarHBondContact O-N 2.77Å; S509-T512 WeakPolarHBondContact O-CB 3.32Å; S509-T512 PolarHBondContact O-N 2.77Å; S509-L513 WeakPolarHBondContact O-CG 3.36Å; S509-L513 PolarHBondContact O-N 3.14Å
510	F	97.6	Very high	96.6	Very high	116 Å²	116	51.9 Å²	51.9	51%	0.509	27%	0.268	S	S	.	.	H	α-helix	trans	-56.1	-59.3	179.5	176.3	-107.3	0	0	0	114.1	C342 L506 S508 T512 L513 L514	C342-F510 HydrophobicContact CB-CE1 4.45Å; L506-F510 PolarHBondContact O-N 3.46Å; S508-F510 PolarHBondContact O-N 2.97Å; F510-T512 VanDerWaalsContact C-N 3.27Å; F510-T512 PolarHBondContact O-N 3.3Å; F510-L513 PolarHBondContact O-N 3.12Å; F510-L514 HydrophobicContact CD1-CD1 4.26Å; F510-L514 HydrophobicContact CE1-CD1 3.68Å; F510-L514 HydrophobicContact CE1-CG 4.42Å; F510-L514 HydrophobicContact CE2-CD2 4.4Å; F510-L514 HydrophobicContact CE2-CG 4.49Å; F510-L514 HydrophobicContact CZ-CD1 3.83Å; F510-L514 HydrophobicContact CZ-CD2 4.33Å; F510-L514 HydrophobicContact CZ-CG 4.28Å; F510-L514 WeakPolarHBondContact O-CG 3.35Å; F510-L514 PolarHBondContact O-N 3.25Å; F510-L514 VanDerWaalsContact O-N 3.1Å
511	P	97.4	Very high	96.5	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-28.6	177.5	26.3	-33.4	0	0	0	112.8	C342 V343 A346 L507 S508 L513 L514 V515	C342-P511 HydrophobicContact CB-CB 3.93Å; V343-P511 HydrophobicContact CB-CB 4.39Å; V343-P511 HydrophobicContact CG2-CB 3.7Å; A346-P511 HydrophobicContact CB-CG 3.91Å; L507-P511 WeakPolarHBondContact O-CD 3.13Å; L507-P511 WeakPolarHBondContact O-CG 3.46Å; S508-P511 WeakPolarHBondContact O-CD 3.27Å; S508-P511 WeakPolarHBondContact O-CG 3.48Å; P511-L513 VanDerWaalsContact C-N 3.34Å; P511-L514 PolarHBondContact O-N 3.35Å; P511-V515 WeakPolarHBondContact O-CG2 3.43Å; P511-V515 PolarHBondContact O-N 3.44Å
512	T	98.1	Very high	96.5	Very high	14 Å²	14	54 Å²	54	9%	0.086	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-45.4	172.9	-56.8	0	0	0	0	110.9	L405 L408 V409 V412 S508 S509 F510 V515 A516	L405-T512 HydrophobicContact CD1-CG2 4.41Å; L408-T512 HydrophobicContact CB-CG2 4.05Å; V409-T512 HydrophobicContact CG2-CG2 4.23Å; V412-T512 HydrophobicContact CG2-CG2 4.26Å; V412-T512 WeakPolarHBondContact CG2-OG1 3.42Å; S508-T512 WeakPolarHBondContact O-CB 3.22Å; S508-T512 PolarHBondContact O-N 3.32Å; S508-T512 PolarHBondContact O-OG1 3.46Å; S509-T512 WeakPolarHBondContact O-CB 3.32Å; S509-T512 PolarHBondContact O-N 2.77Å; F510-T512 VanDerWaalsContact C-N 3.27Å; F510-T512 PolarHBondContact O-N 3.3Å; T512-V515 PolarHBondContact O-N 2.8Å; T512-A516 VanDerWaalsContact O-CB 3.22Å; T512-A516 WeakPolarHBondContact O-CB 3.17Å; T512-A516 PolarHBondContact O-N 3.23Å
513	L	97.8	Very high	96.3	Very high	108 Å²	108	54.2 Å²	54.2	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-64.3	-42.4	175	-70.3	169.2	0	0	0	111.9	S509 F510 P511 V515 A516 C517	S509-L513 WeakPolarHBondContact O-CG 3.36Å; S509-L513 PolarHBondContact O-N 3.14Å; F510-L513 PolarHBondContact O-N 3.12Å; P511-L513 VanDerWaalsContact C-N 3.34Å; L513-V515 VanDerWaalsContact C-N 3.34Å; L513-V515 PolarHBondContact O-N 3.27Å; L513-A516 PolarHBondContact O-N 3.47Å; L513-C517 VanDerWaalsContact O-CB 3.27Å; L513-C517 WeakPolarHBondContact O-CB 3.48Å; L513-C517 PolarHBondContact O-N 3.37Å; L513-C517 PolarHBondContact O-SG 3.41Å
514	L	97.2	Very high	95.8	Very high	36 Å²	36	54.1 Å²	54.1	19%	0.188	28%	0.278	C	S	.	.	H	α-helix	trans	-57.2	-47	176.5	-65	-178.2	0	0	0	111.9	F335 A339 F510 P511 R518	F335-L514 HydrophobicContact CE2-CD2 4.07Å; F335-L514 HydrophobicContact CZ-CB 4.09Å; F335-L514 HydrophobicContact CZ-CD2 4.16Å; A339-L514 HydrophobicContact CB-CB 4.2Å; A339-L514 HydrophobicContact CB-CD1 4.26Å; F510-L514 HydrophobicContact CD1-CD1 4.26Å; F510-L514 HydrophobicContact CE1-CD1 3.68Å; F510-L514 HydrophobicContact CE1-CG 4.42Å; F510-L514 HydrophobicContact CE2-CD2 4.4Å; F510-L514 HydrophobicContact CE2-CG 4.49Å; F510-L514 HydrophobicContact CZ-CD1 3.83Å; F510-L514 HydrophobicContact CZ-CD2 4.33Å; F510-L514 HydrophobicContact CZ-CG 4.28Å; F510-L514 WeakPolarHBondContact O-CG 3.35Å; F510-L514 PolarHBondContact O-N 3.25Å; F510-L514 VanDerWaalsContact O-N 3.1Å; P511-L514 PolarHBondContact O-N 3.35Å; L514-R518 PolarHBondContact O-N 3.25Å
515	V	97.7	Very high	94.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-69.9	-41.3	179.5	175.5	0	0	0	0	111.4	V343 L405 L408 P511 T512 L513 R518 F519 F522	V343-V515 HydrophobicContact CG2-CG2 3.97Å; L405-V515 HydrophobicContact CD1-CG1 4.41Å; L408-V515 HydrophobicContact CD1-CB 4.07Å; L408-V515 HydrophobicContact CD1-CG1 4.32Å; L408-V515 HydrophobicContact CD1-CG2 3.93Å; P511-V515 WeakPolarHBondContact O-CG2 3.43Å; P511-V515 PolarHBondContact O-N 3.44Å; T512-V515 PolarHBondContact O-N 2.8Å; L513-V515 VanDerWaalsContact C-N 3.34Å; L513-V515 PolarHBondContact O-N 3.27Å; V515-R518 CarbonylContact O-C 3.58Å; V515-F519 WeakPolarHBondContact O-CA 3.15Å; V515-F519 WeakPolarHBondContact O-CB 3.41Å; V515-F519 PolarHBondContact O-N 2.68Å; V515-F522 HydrophobicContact CB-CE2 4.25Å; V515-F522 HydrophobicContact CB-CZ 4.42Å; V515-F522 HydrophobicContact CG1-CD2 4.32Å; V515-F522 HydrophobicContact CG1-CE2 4.23Å; V515-F522 HydrophobicContact CG2-CE1 4.31Å; V515-F522 HydrophobicContact CG2-CE2 4.15Å; V515-F522 HydrophobicContact CG2-CZ 3.82Å
516	A	97.1	Very high	92.9	Very high	46 Å²	46	60.7 Å²	60.7	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-67	-48.2	-179.8	0	0	0	0	0	112.3	L405 T512 L513 R518	L405-A516 HydrophobicContact CD1-CB 4.01Å; T512-A516 VanDerWaalsContact O-CB 3.22Å; T512-A516 WeakPolarHBondContact O-CB 3.17Å; T512-A516 PolarHBondContact O-N 3.23Å; L513-A516 PolarHBondContact O-N 3.47Å; A516-R518 VanDerWaalsContact C-N 3.34Å; A516-R518 PolarHBondContact O-N 2.95Å
517	C	96.7	Very high	90.2	Very high	106 Å²	106	65.4 Å²	65.4	72%	0.716	33%	0.326	S	S	*	.	H	α-helix	trans	-66.6	-35	-177.5	-68.9	0	0	0	0	112.6	L513	L513-C517 VanDerWaalsContact O-CB 3.27Å; L513-C517 WeakPolarHBondContact O-CB 3.48Å; L513-C517 PolarHBondContact O-N 3.37Å; L513-C517 PolarHBondContact O-SG 3.41Å
518	R	95.6	Very high	87.5	Confident	119 Å²	119	65 Å²	65	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	39.8	-179.1	-67.3	-170.8	63.8	169.5	4.8	112.2	F335 L514 V515 A516 K520 D521 F522	F335-R518 HydrophobicContact CD1-CB 4.28Å; F335-R518 HydrophobicContact CE1-CB 3.49Å; F335-R518 VanDerWaalsContact CE1-CB 3.49Å; F335-R518 HydrophobicContact CE1-CG 4Å; F335-R518 HydrophobicContact CZ-CB 3.94Å; F335-R518 HydrophobicContact CZ-CG 4.04Å; L514-R518 PolarHBondContact O-N 3.25Å; V515-R518 CarbonylContact O-C 3.58Å; A516-R518 VanDerWaalsContact C-N 3.34Å; A516-R518 PolarHBondContact O-N 2.95Å; R518-K520 PolarHBondContact O-N 3.47Å; R518-K520 VanDerWaalsContact O-N 3.07Å; R518-D521 IonicContact CZ-OD2 2.93Å; R518-D521 IonicContact NE-OD2 2.69Å; R518-D521 PolarHBondContact NE-OD2 3.42Å; R518-D521 IonicContact NH2-OD2 3.74Å; R518-D521 PolarHBondContact NH2-OD2 3.07Å; R518-D521 PolarHBondContact O-N 3.06Å; R518-F522 WeakPolarHBondContact O-CD2 3.36Å; R518-F522 WeakPolarHBondContact O-CE2 3.25Å
519	F	95.5	Very high	84.9	Confident	48 Å²	48	71.5 Å²	71.5	21%	0.211	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-56.8	-27.6	-176.5	-171.8	-105.9	0	0	0	114.9	R401 V402 L405 V515 D521	R401-F519 HydrophobicContact CB-CE2 3.91Å; R401-F519 HydrophobicContact CB-CZ 4.04Å; R401-F519 HydrophobicContact CG-CE1 4.18Å; R401-F519 HydrophobicContact CG-CE2 3.98Å; R401-F519 HydrophobicContact CG-CZ 3.57Å; R401-F519 PolarHBondContact NH1-O 3.43Å; R401-F519 WeakPolarHBondContact O-CE2 3.22Å; V402-F519 HydrophobicContact CB-CZ 4.48Å; V402-F519 HydrophobicContact CG2-CE1 4.44Å; V402-F519 HydrophobicContact CG2-CZ 3.74Å; L405-F519 HydrophobicContact CB-CE2 4.14Å; L405-F519 HydrophobicContact CD2-CD2 3.98Å; L405-F519 HydrophobicContact CD2-CE2 3.96Å; V515-F519 WeakPolarHBondContact O-CA 3.15Å; V515-F519 WeakPolarHBondContact O-CB 3.41Å; V515-F519 PolarHBondContact O-N 2.68Å; F519-D521 VanDerWaalsContact C-N 3.28Å; F519-D521 PolarHBondContact O-N 2.92Å
520	K	93.5	Very high	82.1	Confident	166 Å²	166	72.2 Å²	72.2	72%	0.722	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-69.5	-25	177.2	-68.1	-175.6	179.7	179.2	0	112.8	R518 F522 I523	R518-K520 PolarHBondContact O-N 3.47Å; R518-K520 VanDerWaalsContact O-N 3.07Å; K520-F522 PolarHBondContact O-N 2.93Å; K520-I523 HydrophobicContact CB-CD1 4.45Å; K520-I523 WeakPolarHBondContact O-CB 3.31Å; K520-I523 VanDerWaalsContact O-CD1 3.32Å; K520-I523 WeakPolarHBondContact O-CD1 3.39Å; K520-I523 WeakPolarHBondContact O-CG1 3.47Å; K520-I523 PolarHBondContact O-N 3.42Å
521	D	92.4	Very high	79.1	Confident	51 Å²	51	72 Å²	72	27%	0.273	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-78	-15	-176.4	-59.4	-14.1	0	0	0	112.2	N336 R518 F519 I523	N336-D521 PolarHBondContact ND2-O 3.23Å; N336-D521 WeakPolarHBondContact OD1-CB 3.45Å; R518-D521 IonicContact CZ-OD2 2.93Å; R518-D521 IonicContact NE-OD2 2.69Å; R518-D521 PolarHBondContact NE-OD2 3.42Å; R518-D521 IonicContact NH2-OD2 3.74Å; R518-D521 PolarHBondContact NH2-OD2 3.07Å; R518-D521 PolarHBondContact O-N 3.06Å; F519-D521 VanDerWaalsContact C-N 3.28Å; F519-D521 PolarHBondContact O-N 2.92Å; D521-I523 VanDerWaalsContact C-N 3.25Å; D521-I523 PolarHBondContact O-N 3.07Å
522	F	93.7	Very high	76.7	Confident	1 Å²	1	75.6 Å²	75.6	0%	0.004	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-89.2	16.7	174	-56.1	-88.2	0	0	0	112.8	F335 N336 A339 L340 R401 L462 V515 R518 K520 V524	F335-F522 HydrophobicContact CE1-CE2 4.43Å; F335-F522 HydrophobicContact CE1-CZ 4.39Å; N336-F522 HydrophobicContact CB-CD1 4.49Å; N336-F522 HydrophobicContact CB-CE1 4.19Å; A339-F522 HydrophobicContact CB-CE1 4.25Å; A339-F522 HydrophobicContact CB-CZ 3.77Å; L340-F522 HydrophobicContact CD2-CE1 4.29Å; L340-F522 HydrophobicContact CG-CE1 4.11Å; R401-F522 HydrophobicContact CB-CB 3.99Å; L462-F522 HydrophobicContact CD1-CD1 4.37Å; V515-F522 HydrophobicContact CB-CE2 4.25Å; V515-F522 HydrophobicContact CB-CZ 4.42Å; V515-F522 HydrophobicContact CG1-CD2 4.32Å; V515-F522 HydrophobicContact CG1-CE2 4.23Å; V515-F522 HydrophobicContact CG2-CE1 4.31Å; V515-F522 HydrophobicContact CG2-CE2 4.15Å; V515-F522 HydrophobicContact CG2-CZ 3.82Å; R518-F522 WeakPolarHBondContact O-CD2 3.36Å; R518-F522 WeakPolarHBondContact O-CE2 3.25Å; K520-F522 PolarHBondContact O-N 2.93Å; F522-V524 PolarHBondContact O-N 3.37Å
523	I	91.3	Very high	73.8	Confident	69 Å²	69	79.6 Å²	79.6	35%	0.354	42%	0.419	S	S	.	.			trans	-72.8	123.6	170.4	-66.3	169.3	0	0	0	108.4	K520 D521 N525	K520-I523 HydrophobicContact CB-CD1 4.45Å; K520-I523 WeakPolarHBondContact O-CB 3.31Å; K520-I523 VanDerWaalsContact O-CD1 3.32Å; K520-I523 WeakPolarHBondContact O-CD1 3.39Å; K520-I523 WeakPolarHBondContact O-CG1 3.47Å; K520-I523 PolarHBondContact O-N 3.42Å; D521-I523 VanDerWaalsContact C-N 3.25Å; D521-I523 PolarHBondContact O-N 3.07Å; I523-N525 WeakPolarHBondContact CG2-OD1 2.89Å
524	V	85.8	Confident	70.9	Confident	33 Å²	33	78.8 Å²	78.8	20%	0.2	41%	0.414	C	S	.	.			trans	-89.3	108.3	167.4	-177.8	0	0	0	0	106.7	L458 K461 L462 F522 D526	L458-V524 HydrophobicContact CD2-CG2 3.84Å; K461-V524 HydrophobicContact CB-CG1 4.03Å; K461-V524 HydrophobicContact CB-CG2 3.8Å; K461-V524 HydrophobicContact CD-CG1 4.25Å; K461-V524 HydrophobicContact CD-CG2 3.93Å; K461-V524 HydrophobicContact CG-CG1 4.48Å; K461-V524 HydrophobicContact CG-CG2 4.48Å; L462-V524 HydrophobicContact CD2-CG2 4.41Å; F522-V524 PolarHBondContact O-N 3.37Å; V524-D526 PolarHBondContact O-N 3.44Å
525	N	75.2	Confident	68.2	Low	100 Å²	100	84 Å²	84	54%	0.535	44%	0.438	S	S	.	.			trans	-75.6	111.6	172.9	-69.3	-28.6	0	0	0	108.1	I523 R527	I523-N525 WeakPolarHBondContact CG2-OD1 2.89Å; N525-R527 PolarHBondContact O-N 3.38Å
526	D	58.7	Low	65.6	Low	80 Å²	80	89.7 Å²	89.7	43%	0.428	47%	0.467	S	S	.	.	S	Bend	trans	-71.8	-7	175.2	-65.5	-38.7	0	0	0	112.7	R36 V524	R36-D526 IonicContact CZ-OD2 3.78Å; R36-D526 IonicContact NH1-OD2 2.68Å; R36-D526 IonicContact NH2-OD2 2.69Å; R36-D526 PolarHBondContact NH2-OD2 2.84Å; V524-D526 PolarHBondContact O-N 3.44Å
527	R	40.7	Very low	62.8	Low	203 Å²	203	90 Å²	90	77%	0.766	47%	0.47	S	S	*	.	S	Bend	trans	-113.2	122.4	177.8	-70.1	-177	-178.9	173.9	-0.5	110.3	N525 N529	N525-R527 PolarHBondContact O-N 3.38Å; R527-N529 PolarHBondContact O-N 2.95Å
528	P	40.8	Very low	59.9	Low	41 Å²	41	93.2 Å²	93.2	27%	0.266	47%	0.471	S	S	.	.			trans	-59.5	124.6	165	22	-28.6	0	0	0	109.9	E533	P528-E533 WeakPolarHBondContact CA-OE2 3.26Å; P528-E533 HydrophobicContact CB-CB 3.15Å; P528-E533 HydrophobicContact CB-CG 3.99Å; P528-E533 WeakPolarHBondContact CB-OE2 3.42Å; P528-E533 HydrophobicContact CG-CB 3.81Å
529	N	42.2	Very low	57.4	Low	141 Å²	141	95.4 Å²	95.4	75%	0.754	49%	0.487	S	S	*	.			trans	-90.3	2.6	-179.9	-90.3	-5.7	0	0	0	112.9	R527	R527-N529 PolarHBondContact O-N 2.95Å
530	S	38.5	Very low	54.8	Low	38 Å²	38	100.2 Å²	100.2	27%	0.266	53%	0.526	S	S	.	.	S	Bend	trans	-95.2	135.6	169.6	70.9	0	0	0	0	110.4	S532 E533 L534	S530-S532 WeakPolarHBondContact CB-OG 3.16Å; S530-S532 PolarHBondContact O-N 3.37Å; S530-S532 VanDerWaalsContact O-N 3.11Å; S530-S532 PolarHBondContact OG-OG 3.15Å; S530-E533 PolarHBondContact O-N 3.07Å; S530-E533 WeakPolarHBondContact OG-CB 3.32Å; S530-E533 VanDerWaalsContact OG-CG 3.31Å; S530-E533 WeakPolarHBondContact OG-CG 3.32Å; S530-E533 PolarHBondContact OG-N 3.15Å; S530-L534 PolarHBondContact O-N 3.38Å
531	P	35.8	Very low	52.9	Low	111 Å²	111	96.9 Å²	96.9	72%	0.721	52%	0.517	S	S	*	.	H	α-helix	trans	-51	-32.5	170.8	-25.5	32.9	0	0	0	112.6	E533 L534 E535	P531-E533 VanDerWaalsContact C-N 3.3Å; P531-E533 PolarHBondContact O-N 3.01Å; P531-L534 PolarHBondContact O-N 3.34Å; P531-E535 PolarHBondContact O-N 2.97Å
532	S	47	Very low	50.8	Low	76 Å²	76	99.3 Å²	99.3	53%	0.531	53%	0.529	S	S	.	.	H	α-helix	trans	-65.1	-27.5	177	59.7	0	0	0	0	114.5	S530	S530-S532 WeakPolarHBondContact CB-OG 3.16Å; S530-S532 PolarHBondContact O-N 3.37Å; S530-S532 VanDerWaalsContact O-N 3.11Å; S530-S532 PolarHBondContact OG-OG 3.15Å
533	E	37.3	Very low	48.4	Very low	99 Å²	99	104.8 Å²	104.8	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-93.4	-17.1	177.9	-75.5	178.2	155.4	0	0	111.5	P528 S530 P531 I536 A537	P528-E533 WeakPolarHBondContact CA-OE2 3.26Å; P528-E533 HydrophobicContact CB-CB 3.15Å; P528-E533 HydrophobicContact CB-CG 3.99Å; P528-E533 WeakPolarHBondContact CB-OE2 3.42Å; P528-E533 HydrophobicContact CG-CB 3.81Å; S530-E533 PolarHBondContact O-N 3.07Å; S530-E533 WeakPolarHBondContact OG-CB 3.32Å; S530-E533 VanDerWaalsContact OG-CG 3.31Å; S530-E533 WeakPolarHBondContact OG-CG 3.32Å; S530-E533 PolarHBondContact OG-N 3.15Å; P531-E533 VanDerWaalsContact C-N 3.3Å; P531-E533 PolarHBondContact O-N 3.01Å; E533-I536 PolarHBondContact O-N 3.11Å; E533-A537 PolarHBondContact O-N 3.47Å; E533-A537 VanDerWaalsContact O-N 3.12Å
534	L	35.5	Very low	45.9	Very low	90 Å²	90	106.9 Å²	106.9	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-73	-30.7	174.6	-151.5	99.3	0	0	0	112.4	S530 P531 K538	S530-L534 PolarHBondContact O-N 3.38Å; P531-L534 PolarHBondContact O-N 3.34Å; L534-K538 PolarHBondContact O-N 3.15Å
535	E	41.6	Very low	43.4	Very low	146 Å²	146	111.5 Å²	111.5	68%	0.682	59%	0.594	S	S	*	*	H	α-helix	trans	-67.2	-42.2	171.3	-79.7	178.4	155.6	0	0	110.8	P531 A537 K538	P531-E535 PolarHBondContact O-N 2.97Å; E535-A537 PolarHBondContact O-N 2.91Å; E535-K538 PolarHBondContact O-N 2.8Å
536	I	43.4	Very low	41.2	Very low	119 Å²	119	112.3 Å²	112.3	61%	0.61	60%	0.598	S	S	*	*	H	α-helix	trans	-67	-39.1	-179.8	-58.8	171.5	0	0	0	111.7	E533 K538 E539 S540	E533-I536 PolarHBondContact O-N 3.11Å; I536-K538 VanDerWaalsContact C-N 3.33Å; I536-K538 PolarHBondContact O-N 2.69Å; I536-E539 PolarHBondContact O-N 3.03Å; I536-S540 PolarHBondContact O-N 3.34Å
537	A	37.5	Very low	40	Very low	54 Å²	54	114.6 Å²	114.6	45%	0.446	61%	0.61	S	S	.	*	H	α-helix	trans	-76.1	-16.2	-178.6	0	0	0	0	0	114.4	E533 E535	E533-A537 PolarHBondContact O-N 3.47Å; E533-A537 VanDerWaalsContact O-N 3.12Å; E535-A537 PolarHBondContact O-N 2.91Å
538	K	35.6	Very low	39.9	Very low	172 Å²	172	107.8 Å²	107.8	75%	0.748	60%	0.598	S	S	*	*	H	α-helix	trans	-83.3	-18	172.8	-83.1	-177.4	176.3	178.6	0	112.9	L534 E535 I536	L534-K538 PolarHBondContact O-N 3.15Å; E535-K538 PolarHBondContact O-N 2.8Å; I536-K538 VanDerWaalsContact C-N 3.33Å; I536-K538 PolarHBondContact O-N 2.69Å
539	E	43.9	Very low	39.9	Very low	165 Å²	165	113.3 Å²	113.3	77%	0.771	63%	0.625	S	S	*	*	H	α-helix	trans	-104	-5.3	-176.9	-67.8	-169.4	158.5	0	0	114.4	I536	I536-E539 PolarHBondContact O-N 3.03Å
540	S	40.2	Very low	39.7	Very low	149 Å²	149	110.8 Å²	110.8	100%	1.042	61%	0.614	S	S	*	*			trans	-92.6	0	167	69.3	0	0	0	0	111.9	I536	I536-S540 PolarHBondContact O-N 3.34Å

Retrieved 540 of 540 residues in 663.5 ms (Link to these results)

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