X5D9C4_HUMAN Loading...

Transporter

Creatine:sodium symporter which mediates the uptake of creatine. Plays an important role in supplying creatine to the brain via the blood-brain barrier.

AlphaFold DB (P48029), UniProt , Accession X5D9C4, Species HUMAN (Homo sapiens, Human), Gene SLC6A8, Length 635 aa.

Structure Viewer

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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	31.5	Very low	28.8	Very low	247 Å²	247	150.5 Å²	150.5	100%	1.217	82%	0.819	S	S	*	*				0	98.3	0	-81.4	177.1	174.2	0	0	108.6	K3	M1-K3 PolarHBondContact O-N 2.93Å
2	A	30.2	Very low	28.3	Very low	103 Å²	103	146.4 Å²	146.4	85%	0.851	81%	0.81	S	S	*	*			trans	-77.4	110.9	-176.9	0	0	0	0	0	110.4	K4	A2-K4 PolarHBondContact O-N 2.97Å
3	K	28.3	Very low	28	Very low	209 Å²	209	145.1 Å²	145.1	91%	0.909	81%	0.808	S	S	*	*			trans	-74.1	104.7	165.3	-85.5	-179.4	173.6	177.9	0	108	M1 S5	M1-K3 PolarHBondContact O-N 2.93Å; K3-S5 PolarHBondContact O-N 3.28Å
4	K	26.9	Very low	27.8	Very low	206 Å²	206	141.3 Å²	141.3	90%	0.896	80%	0.796	S	S	*	*			trans	-66.9	103.2	163.5	-85.5	179.3	171.5	178.6	0	108.1	A2	A2-K4 PolarHBondContact O-N 2.97Å
5	S	30.5	Very low	27.5	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	79%	0.794	S	S	*	*			trans	-86.6	109.3	159.1	-173.2	0	0	0	0	106.9	K3 E7	K3-S5 PolarHBondContact O-N 3.28Å; S5-E7 PolarHBondContact O-N 3.22Å
6	A	31.5	Very low	27.4	Very low	92 Å²	92	136.3 Å²	136.3	76%	0.76	79%	0.787	S	S	*	*			trans	-76.5	93.1	168.4	0	0	0	0	0	107.2	N8	A6-N8 PolarHBondContact O-N 2.74Å
7	E	31.7	Very low	27.3	Very low	176 Å²	176	137.9 Å²	137.9	82%	0.822	79%	0.786	S	S	*	*			trans	-69.8	119.1	170	-79.3	-179.5	159.3	0	0	109.1	S5 G9	S5-E7 PolarHBondContact O-N 3.22Å; E7-G9 PolarHBondContact O-N 2.79Å
8	N	29.7	Very low	27.3	Very low	145 Å²	145	140.5 Å²	140.5	78%	0.775	79%	0.787	S	S	*	*			trans	-52.8	123.5	172.1	-70.2	-32	0	0	0	109.5	A6 I10	A6-N8 PolarHBondContact O-N 2.74Å; N8-I10 VanDerWaalsContact C-N 3.27Å; N8-I10 PolarHBondContact O-N 2.93Å
9	G	26.6	Very low	27.2	Very low	65 Å²	65	142.5 Å²	142.5	67%	0.67	79%	0.786	S	S	*	*			trans	-65.2	85.2	172.8	0	0	0	0	0	111	E7 Y11	E7-G9 PolarHBondContact O-N 2.79Å; G9-Y11 PolarHBondContact O-N 3.32Å
10	I	24.9	Very low	27	Very low	147 Å²	147	138.5 Å²	138.5	75%	0.754	78%	0.779	S	S	*	*			trans	-84.2	104.4	160.5	-60.9	176.3	0	0	0	105.5	N8 S12	N8-I10 VanDerWaalsContact C-N 3.27Å; N8-I10 PolarHBondContact O-N 2.93Å; I10-S12 PolarHBondContact O-N 3.34Å; I10-S12 VanDerWaalsContact O-N 3.1Å
11	Y	25	Very low	27.1	Very low	164 Å²	164	137.6 Å²	137.6	64%	0.643	78%	0.779	S	S	*	*			trans	-73.5	96.2	172	-69.1	-94.1	0	0	0	108.5	G9	G9-Y11 PolarHBondContact O-N 3.32Å
12	S	22.8	Very low	26.8	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	76%	0.763	S	S	*	*			trans	-96.4	111.5	157.6	59.6	0	0	0	0	107.9	I10 S14	I10-S12 PolarHBondContact O-N 3.34Å; I10-S12 VanDerWaalsContact O-N 3.1Å; S12-S14 PolarHBondContact O-N 3.27Å; S12-S14 VanDerWaalsContact O-N 3.16Å
13	V	24.2	Very low	26.5	Very low	129 Å²	129	137 Å²	137	78%	0.782	76%	0.764	S	S	*	*			trans	-69.7	105.8	162.1	178.1	0	0	0	0	105.6	G15	V13-G15 PolarHBondContact O-N 2.99Å; V13-G15 VanDerWaalsContact O-N 3.16Å
14	S	25.2	Very low	26.5	Very low	92 Å²	92	131 Å²	131	64%	0.643	75%	0.753	S	S	*	*			trans	-65	114.5	167.2	63.6	0	0	0	0	107.1	S12 D16	S12-S14 PolarHBondContact O-N 3.27Å; S12-S14 VanDerWaalsContact O-N 3.16Å; S14-D16 PolarHBondContact O-N 3.09Å
15	G	23.5	Very low	26.4	Very low	74 Å²	74	127.5 Å²	127.5	76%	0.763	75%	0.752	S	S	*	*			trans	-66.4	82.5	165.4	0	0	0	0	0	109.1	V13 E17	V13-G15 PolarHBondContact O-N 2.99Å; V13-G15 VanDerWaalsContact O-N 3.16Å; G15-E17 PolarHBondContact O-N 3.33Å
16	D	26.2	Very low	26.2	Very low	129 Å²	129	126 Å²	126	69%	0.69	75%	0.752	S	S	*	*			trans	-87.3	91.9	158.1	-95	-9.3	0	0	0	106.8	S14 K18	S14-D16 PolarHBondContact O-N 3.09Å; D16-K18 PolarHBondContact O-N 2.81Å
17	E	25.3	Very low	26.2	Very low	163 Å²	163	127 Å²	127	76%	0.762	75%	0.751	S	S	*	*			trans	-53.5	84.7	152.2	-79.7	-173.4	115.7	0	0	108.7	G15 K19	G15-E17 PolarHBondContact O-N 3.33Å; E17-K19 VanDerWaalsContact C-N 3.3Å; E17-K19 PolarHBondContact O-N 3.15Å
18	K	27.4	Very low	26.2	Very low	185 Å²	185	126.4 Å²	126.4	80%	0.804	75%	0.753	S	S	*	*			trans	-85.7	87.2	154.7	-78.3	-171.5	179.6	177.6	0	107.6	D16 G20	D16-K18 PolarHBondContact O-N 2.81Å; K18-G20 PolarHBondContact O-N 2.9Å
19	K	24.7	Very low	26.1	Very low	178 Å²	178	123.3 Å²	123.3	77%	0.774	76%	0.756	S	S	*	*			trans	-49.7	89.5	152.2	-72.7	176.3	177.5	170.7	0	107.9	E17	E17-K19 VanDerWaalsContact C-N 3.3Å; E17-K19 PolarHBondContact O-N 3.15Å
20	G	24.9	Very low	26.2	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-70.7	132.2	164.8	0	0	0	0	0	108.2	K18	K18-G20 PolarHBondContact O-N 2.9Å
21	P	27.2	Very low	26.4	Very low	119 Å²	119	124 Å²	124	77%	0.773	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-73.2	135.7	-157.1	27.9	-33.9	0	0	0	112.3	I23	P21-I23 PolarHBondContact O-N 2.9Å
22	L	25.4	Very low	26.6	Very low	170 Å²	170	121 Å²	121	89%	0.89	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-48.6	119.1	159.1	-74.2	156.4	0	0	0	108.2	A24	L22-A24 PolarHBondContact O-N 3.44Å
23	I	25.4	Very low	26.7	Very low	168 Å²	168	126.4 Å²	126.4	86%	0.862	79%	0.786	S	S	*	*			trans	-60.4	104.8	175.3	-65.5	169	0	0	0	107.2	P21	P21-I23 PolarHBondContact O-N 2.9Å
24	A	27.7	Very low	26.8	Very low	83 Å²	83	123.7 Å²	123.7	69%	0.686	78%	0.783	S	S	*	*			trans	-77	134.9	168.5	0	0	0	0	0	108.7	L22 G26	L22-A24 PolarHBondContact O-N 3.44Å; A24-G26 PolarHBondContact O-N 2.95Å
25	P	24.8	Very low	27	Very low	133 Å²	133	127.3 Å²	127.3	86%	0.864	80%	0.796	S	S	*	*			trans	-77.8	113	-177.3	30.1	-30.7	0	0	0	109.8
26	G	27	Very low	27.2	Very low	69 Å²	69	127 Å²	127	71%	0.711	79%	0.792	S	S	*	*			trans	-100.2	143.9	168.4	0	0	0	0	0	110.8	A24	A24-G26 PolarHBondContact O-N 2.95Å
27	P	31.3	Very low	27.3	Very low	115 Å²	115	127 Å²	127	75%	0.747	80%	0.799	S	S	*	*			trans	-84.4	159.5	-170	35.8	-34.8	0	0	0	112.5
28	D	30.6	Very low	27.4	Very low	162 Å²	162	125.9 Å²	125.9	87%	0.866	80%	0.803	S	S	*	*			trans	74	126.8	165.3	-53.7	-27.9	0	0	0	117.8
29	G	28	Very low	27.5	Very low	81 Å²	81	120.2 Å²	120.2	84%	0.835	80%	0.797	S	S	*	*			trans	-84.4	144.1	-167.8	0	0	0	0	0	114.6
30	A	29.1	Very low	27.8	Very low	93 Å²	93	120 Å²	120	77%	0.769	80%	0.803	S	S	*	*				-174.2	142.3	129.5	0	0	0	0	0	109	A32	A30-A32 PolarHBondContact O-N 3.36Å
31	P	28.5	Very low	27.8	Very low	133 Å²	133	120.1 Å²	120.1	86%	0.864	81%	0.805	S	S	*	*			trans	-87.2	108	-169.3	33	-31	0	0	0	111.3	K33	P31-K33 PolarHBondContact O-N 2.91Å
32	A	29	Very low	27.8	Very low	100 Å²	100	120.9 Å²	120.9	83%	0.826	81%	0.808	S	S	*	*			trans	-87.9	107.6	170.8	0	0	0	0	0	110.5	A30 G34	A30-A32 PolarHBondContact O-N 3.36Å; A32-G34 PolarHBondContact O-N 3.26Å
33	K	24.4	Very low	28	Very low	216 Å²	216	118.8 Å²	118.8	94%	0.939	80%	0.804	S	S	*	*			trans	-59.8	122.1	159.9	-72.9	173.8	173	177	0	108.7	P31	P31-K33 PolarHBondContact O-N 2.91Å
34	G	28	Very low	28.1	Very low	71 Å²	71	113.7 Å²	113.7	73%	0.732	79%	0.793	S	S	*	*			trans	-157	117.8	174.8	0	0	0	0	0	110.4	A32 G36	A32-G34 PolarHBondContact O-N 3.26Å; G34-G36 PolarHBondContact O-N 3.17Å
35	D	27.8	Very low	28.2	Very low	169 Å²	169	113.6 Å²	113.6	90%	0.904	80%	0.8	S	S	*	*			trans	-36.3	120.5	-174.9	-63.4	-50.3	0	0	0	115.4
36	G	27.6	Very low	29	Very low	66 Å²	66	117.3 Å²	117.3	68%	0.68	80%	0.797	S	S	*	*			trans	-65.4	138.1	171.6	0	0	0	0	0	111	G34 V38	G34-G36 PolarHBondContact O-N 3.17Å; G36-V38 PolarHBondContact O-N 3.19Å
37	P	29.1	Very low	29.8	Very low	130 Å²	130	121.1 Å²	121.1	84%	0.844	80%	0.801	S	S	*	*			trans	-66.7	132.4	-175.4	25.3	-31.2	0	0	0	111	G39	P37-G39 PolarHBondContact O-N 3.34Å
38	V	28.5	Very low	31.1	Very low	139 Å²	139	120 Å²	120	84%	0.842	80%	0.8	S	S	*	*			trans	-35	115.9	167.5	175.8	0	0	0	0	110.2	G36 L40	G36-V38 PolarHBondContact O-N 3.19Å; V38-L40 PolarHBondContact O-N 2.81Å
39	G	29	Very low	32.4	Very low	66 Å²	66	116.6 Å²	116.6	68%	0.68	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-52.6	123.7	179.4	0	0	0	0	0	110.7	P37 G41	P37-G39 PolarHBondContact O-N 3.34Å; G39-G41 PolarHBondContact O-N 3.41Å
40	L	29.9	Very low	34.3	Very low	173 Å²	173	116 Å²	116	91%	0.906	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-50	116.8	163.9	-95.5	94.5	0	0	0	107.9	V38 T42	V38-L40 PolarHBondContact O-N 2.81Å; L40-T42 PolarHBondContact O-N 3.26Å
41	G	25.9	Very low	36.6	Very low	66 Å²	66	117.4 Å²	117.4	68%	0.68	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-52	126.3	171.9	0	0	0	0	0	109.7	G39 P43	G39-G41 PolarHBondContact O-N 3.41Å; G41-P43 WeakPolarHBondContact O-CD 3.26Å; G41-P43 VanDerWaalsContact O-N 3.1Å
42	T	26.8	Very low	39.4	Very low	136 Å²	136	114.3 Å²	114.3	83%	0.834	74%	0.739	S	S	*	*			trans	-52	115.3	173.3	-12.7	0	0	0	0	108.1	L40 G44	L40-T42 PolarHBondContact O-N 3.26Å; T42-G44 PolarHBondContact O-N 3.16Å
43	P	28.5	Very low	42.2	Very low	125 Å²	125	112.4 Å²	112.4	81%	0.812	71%	0.713	S	S	*	*			trans	-69	112.9	-179.7	2.7	7	0	0	0	108.2	G41	G41-P43 WeakPolarHBondContact O-CD 3.26Å; G41-P43 VanDerWaalsContact O-N 3.1Å
44	G	29.5	Very low	45.5	Very low	61 Å²	61	105 Å²	105	63%	0.629	69%	0.687	S	S	*	*			trans	45.9	100.5	161.9	0	0	0	0	0	115.3	T42 R46	T42-G44 PolarHBondContact O-N 3.16Å; G44-R46 PolarHBondContact O-N 3.43Å
45	G	29.8	Very low	48.6	Very low	82 Å²	82	102 Å²	102	85%	0.845	65%	0.653	S	S	*	*			trans	-55.1	88.5	165.5	0	0	0	0	0	110.8	L47	G45-L47 PolarHBondContact O-N 3.35Å; G45-L47 VanDerWaalsContact O-N 3.08Å
46	R	40.9	Very low	51.6	Low	210 Å²	210	96.8 Å²	96.8	79%	0.792	63%	0.628	S	S	*	*			trans	-51.2	117.1	154.7	-78.6	178.3	171.9	176.6	-3.2	103.7	G44 A48	G44-R46 PolarHBondContact O-N 3.43Å; R46-A48 PolarHBondContact O-N 2.94Å
47	L	44.3	Very low	54.6	Low	150 Å²	150	101.8 Å²	101.8	79%	0.785	63%	0.626	S	S	*	*			trans	-49.8	100.5	170.1	-79.3	158.1	0	0	0	106.1	G45 V49	G45-L47 PolarHBondContact O-N 3.35Å; G45-L47 VanDerWaalsContact O-N 3.08Å; L47-V49 PolarHBondContact O-N 3.4Å
48	A	57.9	Low	57.6	Low	90 Å²	90	100.3 Å²	100.3	74%	0.744	61%	0.608	S	S	*	*			trans	-61	113.8	173.7	0	0	0	0	0	103.9	R46 P50	R46-A48 PolarHBondContact O-N 2.94Å; A48-P50 VanDerWaalsContact O-N 3.1Å
49	V	57.9	Low	60.8	Low	92 Å²	92	98 Å²	98	56%	0.558	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-50.7	124.3	174	178.4	0	0	0	0	105.9	L47 A435	L47-V49 PolarHBondContact O-N 3.4Å; V49-A435 HydrophobicContact CG2-CB 3.18Å
50	P	67.5	Low	63.9	Low	67 Å²	67	95.1 Å²	95.1	44%	0.435	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-55.9	138.1	179	20.8	-30.1	0	0	0	108.2	A48 Y438	A48-P50 VanDerWaalsContact O-N 3.1Å; P50-Y438 HydrophobicContact CG-CE2 4.31Å
51	P	78.1	Confident	67	Low	123 Å²	123	86.9 Å²	86.9	80%	0.799	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-54.4	146.9	176.4	24.7	-33.7	0	0	0	109.4	E53	P51-E53 PolarHBondContact O-N 2.91Å
52	R	87	Confident	70.3	Confident	69 Å²	69	84.6 Å²	84.6	26%	0.26	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-51.4	136.8	177.4	-176.7	-178.4	-68.6	-75	-9.2	109	K117 S329 Y330 D431	R52-K117 PolarHBondContact NE-O 2.91Å; R52-K117 PolarHBondContact NH2-O 3.32Å; R52-S329 VanDerWaalsContact CD-O 3.28Å; R52-S329 WeakPolarHBondContact CD-O 3.29Å; R52-Y330 HydrophobicContact CG-CD1 3.88Å; R52-Y330 HydrophobicContact CG-CE1 3.91Å; R52-D431 IonicContact CZ-OD1 2.66Å; R52-D431 IonicContact CZ-OD2 2.9Å; R52-D431 IonicContact NH1-OD1 3.95Å; R52-D431 PolarHBondContact NH1-OD1 2.84Å; R52-D431 IonicContact NH2-OD1 2.76Å; R52-D431 PolarHBondContact NH2-OD1 3.23Å; R52-D431 IonicContact NH2-OD2 2.65Å; R52-D431 PolarHBondContact NH2-OD2 3.29Å
53	E	88.7	Confident	73.6	Confident	59 Å²	59	80 Å²	80	28%	0.276	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-55.7	152.6	173.3	-175.5	161.4	-126.9	0	0	110.9	P51 V254 K255 Y330	P51-E53 PolarHBondContact O-N 2.91Å; E53-V254 HydrophobicContact CB-CG2 4.49Å; E53-V254 HydrophobicContact CG-CG2 3.86Å; E53-K255 WeakPolarHBondContact OE1-CD 3.26Å; E53-K255 WeakPolarHBondContact OE1-CE 3.4Å; E53-K255 WeakPolarHBondContact OE1-CG 3.33Å; E53-K255 IonicContact OE1-NZ 2.72Å; E53-K255 PolarHBondContact OE1-NZ 3.41Å; E53-Y330 HydrophobicContact CB-CD1 4.39Å; E53-Y330 HydrophobicContact CB-CE1 4.5Å; E53-Y330 VanDerWaalsContact O-CD1 3.29Å; E53-Y330 WeakPolarHBondContact O-CD1 3.15Å
54	T	93.1	Very high	76.8	Confident	62 Å²	62	74.1 Å²	74.1	38%	0.38	42%	0.418	S	S	.	.			trans	-125.3	154.8	172.2	62.9	0	0	0	0	110.5	T56 Y330	T54-T56 PolarHBondContact O-N 3.48Å; T54-Y330 CarbonylContact C-O 3.5Å; T54-Y330 WeakPolarHBondContact CA-O 3.47Å; T54-Y330 WeakPolarHBondContact CB-O 3.41Å
55	W	93.4	Very high	79.9	Confident	7 Å²	7	71.2 Å²	71.2	3%	0.027	39%	0.388	C	S	.	.			trans	-50.4	138.7	169.5	-60.3	109	0	0	0	111.3	R57 D60 F61 S64 V254 L327 Y330 N331	W55-R57 VanDerWaalsContact C-N 3.35Å; W55-D60 HydrophobicContact CD2-CB 4.45Å; W55-D60 HydrophobicContact CE3-CB 3.66Å; W55-D60 HydrophobicContact CZ3-CB 4.3Å; W55-F61 HydrophobicContact CD2-CB 3.97Å; W55-F61 AromaticContact CE2-CD2 3.98Å; W55-F61 HydrophobicContact CG-CB 3.85Å; W55-F61 HydrophobicContact CZ2-CD2 4.3Å; W55-F61 AromaticContact NE1-CD2 3.5Å; W55-F61 AromaticContact NE1-CG 3.97Å; W55-S64 WeakPolarHBondContact CH2-OG 3.47Å; W55-V254 HydrophobicContact CD2-CB 4.32Å; W55-V254 HydrophobicContact CE3-CB 3.81Å; W55-V254 HydrophobicContact CE3-CG2 4.47Å; W55-V254 HydrophobicContact CH2-CB 3.68Å; W55-V254 HydrophobicContact CH2-CG1 3.55Å; W55-V254 HydrophobicContact CZ2-CB 4.18Å; W55-V254 HydrophobicContact CZ2-CG1 3.82Å; W55-V254 HydrophobicContact CZ3-CB 3.49Å; W55-V254 VanDerWaalsContact CZ3-CB 3.49Å; W55-V254 HydrophobicContact CZ3-CG1 3.94Å; W55-L327 HydrophobicContact CH2-CD2 3.76Å; W55-L327 HydrophobicContact CZ2-CB 4.26Å; W55-L327 HydrophobicContact CZ2-CD2 3.56Å; W55-L327 HydrophobicContact CZ2-CG 4.47Å; W55-L327 PolarHBondContact NE1-O 3.1Å; W55-Y330 PolarHBondContact N-O 2.93Å; W55-N331 PolarHBondContact NE1-OD1 3Å
56	T	90.7	Very high	83.1	Confident	60 Å²	60	67.7 Å²	67.7	37%	0.368	35%	0.35	S	S	.	.	S	Bend	trans	-70.9	-40.1	-179.6	75.5	0	0	0	0	110.1	T54 D60 K255 R332	T54-T56 PolarHBondContact O-N 3.48Å; T56-D60 WeakPolarHBondContact CB-OD2 3.34Å; T56-D60 PolarHBondContact N-OD2 3.3Å; T56-D60 VanDerWaalsContact N-OD2 3.16Å; T56-D60 PolarHBondContact OG1-OD2 3.29Å; T56-K255 HydrophobicContact CG2-CD 4.37Å; T56-K255 HydrophobicContact CG2-CG 3.86Å; T56-R332 PolarHBondContact O-NH2 3.27Å
57	R	91.2	Very high	85.6	Confident	171 Å²	171	57.8 Å²	57.8	65%	0.645	31%	0.313	S	S	*	.	S	Bend	trans	-132.3	150.5	175.3	-58.8	173.6	-179.2	178.4	-1.2	109.4	W55 M59 D60	W55-R57 VanDerWaalsContact C-N 3.35Å; R57-M59 PolarHBondContact O-N 3.45Å; R57-D60 PolarHBondContact N-OD2 3.5Å; R57-D60 VanDerWaalsContact O-CB 3.31Å; R57-D60 WeakPolarHBondContact O-CB 3.39Å; R57-D60 PolarHBondContact O-N 3.4Å
58	Q	92	Very high	87.9	Confident	99 Å²	99	51.4 Å²	51.4	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-58.7	-32.7	173.9	-174.2	-174	2.1	0	0	111.8	D60 F61 I62 D340	Q58-D60 VanDerWaalsContact C-N 3.26Å; Q58-D60 PolarHBondContact O-N 3.37Å; Q58-F61 WeakPolarHBondContact O-CB 3.39Å; Q58-F61 PolarHBondContact O-N 3.1Å; Q58-F61 VanDerWaalsContact O-N 3.16Å; Q58-I62 HydrophobicContact CG-CG1 4.5Å; Q58-I62 PolarHBondContact O-N 2.93Å; Q58-D340 PolarHBondContact NE2-OD1 3.1Å; Q58-D340 PolarHBondContact NE2-OD2 3.3Å
59	M	93.8	Very high	89.6	Confident	89 Å²	89	47.4 Å²	47.4	44%	0.438	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-26.2	177.9	-171.1	62.8	66	0	0	113	R57 F61 I62 M63 Y262	R57-M59 PolarHBondContact O-N 3.45Å; M59-F61 VanDerWaalsContact C-N 3.3Å; M59-F61 PolarHBondContact O-N 3.16Å; M59-I62 PolarHBondContact O-N 3.03Å; M59-I62 HydrophobicContact SD-CB 4.25Å; M59-I62 HydrophobicContact SD-CG2 4.32Å; M59-M63 HydrophobicContact CG-CE 4.49Å; M59-M63 HydrophobicContact CG-CG 4.13Å; M59-M63 WeakPolarHBondContact O-CB 3.39Å; M59-M63 WeakPolarHBondContact O-CG 3.24Å; M59-M63 PolarHBondContact O-N 3.39Å; M59-M63 HydrophobicContact SD-CE 3.85Å; M59-M63 HydrophobicContact SD-CG 4.11Å; M59-Y262 VanDerWaalsContact CB-OH 3.25Å; M59-Y262 WeakPolarHBondContact CB-OH 3.31Å; M59-Y262 HydrophobicContact CG-CE1 3.76Å; M59-Y262 VanDerWaalsContact CG-OH 3.27Å; M59-Y262 WeakPolarHBondContact CG-OH 3.28Å
60	D	94.2	Very high	91.3	Very high	6 Å²	6	43.2 Å²	43.2	3%	0.032	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-42	173	-52	-16.5	0	0	0	110.3	W55 T56 R57 Q58 S64 Y262	W55-D60 HydrophobicContact CD2-CB 4.45Å; W55-D60 HydrophobicContact CE3-CB 3.66Å; W55-D60 HydrophobicContact CZ3-CB 4.3Å; T56-D60 WeakPolarHBondContact CB-OD2 3.34Å; T56-D60 PolarHBondContact N-OD2 3.3Å; T56-D60 VanDerWaalsContact N-OD2 3.16Å; T56-D60 PolarHBondContact OG1-OD2 3.29Å; R57-D60 PolarHBondContact N-OD2 3.5Å; R57-D60 VanDerWaalsContact O-CB 3.31Å; R57-D60 WeakPolarHBondContact O-CB 3.39Å; R57-D60 PolarHBondContact O-N 3.4Å; Q58-D60 VanDerWaalsContact C-N 3.26Å; Q58-D60 PolarHBondContact O-N 3.37Å; D60-S64 WeakPolarHBondContact O-CB 3.44Å; D60-S64 PolarHBondContact O-N 2.95Å; D60-S64 PolarHBondContact O-OG 3.14Å; D60-Y262 WeakPolarHBondContact OD1-CE2 3.27Å; D60-Y262 PolarHBondContact OD1-OH 2.67Å
61	F	95.3	Very high	92.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-51.5	175.5	167.9	-110.1	0	0	0	111.4	W55 Q58 M59 M63 S64 C65 I110 L327 N331 D340 L344	W55-F61 HydrophobicContact CD2-CB 3.97Å; W55-F61 AromaticContact CE2-CD2 3.98Å; W55-F61 HydrophobicContact CG-CB 3.85Å; W55-F61 HydrophobicContact CZ2-CD2 4.3Å; W55-F61 AromaticContact NE1-CD2 3.5Å; W55-F61 AromaticContact NE1-CG 3.97Å; Q58-F61 WeakPolarHBondContact O-CB 3.39Å; Q58-F61 PolarHBondContact O-N 3.1Å; Q58-F61 VanDerWaalsContact O-N 3.16Å; M59-F61 VanDerWaalsContact C-N 3.3Å; M59-F61 PolarHBondContact O-N 3.16Å; F61-M63 PolarHBondContact O-N 2.85Å; F61-S64 PolarHBondContact O-N 3.39Å; F61-C65 WeakPolarHBondContact CE2-SG 3.29Å; F61-C65 PolarHBondContact O-N 2.81Å; F61-I110 HydrophobicContact CZ-CD1 4.01Å; F61-I110 HydrophobicContact CZ-CG1 4.36Å; F61-I110 HydrophobicContact CZ-CG2 3.8Å; F61-L327 HydrophobicContact CD2-CB 4.23Å; F61-L327 HydrophobicContact CE2-CB 3.95Å; F61-N331 VanDerWaalsContact CD2-OD1 3.32Å; F61-N331 WeakPolarHBondContact CD2-OD1 3.43Å; F61-N331 WeakPolarHBondContact CG-OD1 3.27Å; F61-N331 WeakPolarHBondContact CZ-ND2 3.3Å; F61-D340 HydrophobicContact CE1-CB 3.99Å; F61-L344 HydrophobicContact CE1-CD1 4.48Å
62	I	96.1	Very high	92.9	Very high	19 Å²	19	35.2 Å²	35.2	10%	0.097	17%	0.168	C	C	.	.	H	α-helix	trans	-58	-48.5	-179.5	-63.4	-62.5	0	0	0	110.8	Q58 M59 S64 C65 V66 D340 L344	Q58-I62 HydrophobicContact CG-CG1 4.5Å; Q58-I62 PolarHBondContact O-N 2.93Å; M59-I62 PolarHBondContact O-N 3.03Å; M59-I62 HydrophobicContact SD-CB 4.25Å; M59-I62 HydrophobicContact SD-CG2 4.32Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 3.43Å; I62-C65 PolarHBondContact O-N 3.45Å; I62-V66 HydrophobicContact CG2-CG2 4.35Å; I62-V66 WeakPolarHBondContact O-CG2 3.33Å; I62-V66 PolarHBondContact O-N 2.99Å; I62-D340 HydrophobicContact CD1-CB 3.74Å; I62-L344 HydrophobicContact CD1-CD1 4.23Å; I62-L344 HydrophobicContact CD1-CD2 4.5Å; I62-L344 HydrophobicContact CD1-CG 4.32Å; I62-L344 HydrophobicContact CG2-CD2 4.13Å
63	M	95.6	Very high	92.9	Very high	40 Å²	40	32.4 Å²	32.4	20%	0.197	16%	0.161	C	C	.	.	H	α-helix	trans	-64.4	-36.4	178.9	-71.2	-64.1	178.9	0	0	112.4	M59 F61 V66 G67 V261 Y262 T266	M59-M63 HydrophobicContact CG-CE 4.49Å; M59-M63 HydrophobicContact CG-CG 4.13Å; M59-M63 WeakPolarHBondContact O-CB 3.39Å; M59-M63 WeakPolarHBondContact O-CG 3.24Å; M59-M63 PolarHBondContact O-N 3.39Å; M59-M63 HydrophobicContact SD-CE 3.85Å; M59-M63 HydrophobicContact SD-CG 4.11Å; F61-M63 PolarHBondContact O-N 2.85Å; M63-V66 PolarHBondContact O-N 2.8Å; M63-G67 PolarHBondContact O-N 3.2Å; M63-V261 HydrophobicContact CB-CB 4.41Å; M63-V261 HydrophobicContact CB-CG2 3.82Å; M63-Y262 HydrophobicContact CG-CD1 4.4Å; M63-Y262 HydrophobicContact CG-CE1 4.34Å; M63-T266 HydrophobicContact CE-CG2 4.05Å; M63-T266 HydrophobicContact SD-CG2 4.13Å
64	S	95.6	Very high	93.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.3	-42.4	174.3	-58.2	0	0	0	0	111.8	W55 D60 F61 I62 F68	W55-S64 WeakPolarHBondContact CH2-OG 3.47Å; D60-S64 WeakPolarHBondContact O-CB 3.44Å; D60-S64 PolarHBondContact O-N 2.95Å; D60-S64 PolarHBondContact O-OG 3.14Å; F61-S64 PolarHBondContact O-N 3.39Å; I62-S64 VanDerWaalsContact C-N 3.32Å; I62-S64 PolarHBondContact O-N 3.43Å; S64-F68 WeakPolarHBondContact O-CB 3.45Å; S64-F68 PolarHBondContact O-N 3.49Å
65	C	95.9	Very high	93	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.5	-38	174.8	-73.6	0	0	0	0	112.5	F61 I62 F68 A69 L344	F61-C65 WeakPolarHBondContact CE2-SG 3.29Å; F61-C65 PolarHBondContact O-N 2.81Å; I62-C65 PolarHBondContact O-N 3.45Å; C65-F68 PolarHBondContact O-N 3.49Å; C65-A69 WeakPolarHBondContact O-CB 3.45Å; C65-A69 PolarHBondContact O-N 3.45Å; C65-L344 HydrophobicContact CB-CD1 3.46Å; C65-L344 VanDerWaalsContact CB-CD1 3.46Å; C65-L344 HydrophobicContact CB-CD2 3.46Å; C65-L344 VanDerWaalsContact CB-CD2 3.46Å; C65-L344 HydrophobicContact CB-CG 4.08Å
66	V	95.6	Very high	92.3	Very high	9 Å²	9	27.2 Å²	27.2	6%	0.055	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-50.4	174	170.9	0	0	0	0	110	I62 M63 F68 A69 V70 Y269 L344 I347	I62-V66 HydrophobicContact CG2-CG2 4.35Å; I62-V66 WeakPolarHBondContact O-CG2 3.33Å; I62-V66 PolarHBondContact O-N 2.99Å; M63-V66 PolarHBondContact O-N 2.8Å; V66-F68 PolarHBondContact O-N 3.08Å; V66-A69 PolarHBondContact O-N 3.49Å; V66-V70 HydrophobicContact CG1-CB 4.42Å; V66-V70 HydrophobicContact CG1-CG2 4.1Å; V66-V70 WeakPolarHBondContact O-CA 3.2Å; V66-V70 WeakPolarHBondContact O-CB 3.28Å; V66-V70 PolarHBondContact O-N 3.1Å; V66-Y269 HydrophobicContact CG1-CE2 4.23Å; V66-L344 HydrophobicContact CG2-CD2 3.64Å; V66-I347 HydrophobicContact CG1-CG2 4.04Å; V66-I347 HydrophobicContact CG2-CD1 3.91Å; V66-I347 HydrophobicContact CG2-CG2 3.91Å
67	G	93.4	Very high	92.2	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-28.7	177.9	0	0	0	0	0	113.7	M63 D416 S417	M63-G67 PolarHBondContact O-N 3.2Å; G67-D416 VanDerWaalsContact O-CB 3.26Å; G67-D416 WeakPolarHBondContact O-CB 3.03Å; G67-S417 PolarHBondContact O-N 3.16Å
68	F	94.1	Very high	92.3	Very high	16 Å²	16	20.7 Å²	20.7	7%	0.07	10%	0.101	C	C	.	.	H	α-helix	trans	-77.2	-44.9	175.5	-171.6	-130.2	0	0	0	113.4	S64 C65 V66 A318 L321 A323 L324 V420	S64-F68 WeakPolarHBondContact O-CB 3.45Å; S64-F68 PolarHBondContact O-N 3.49Å; C65-F68 PolarHBondContact O-N 3.49Å; V66-F68 PolarHBondContact O-N 3.08Å; F68-A318 HydrophobicContact CD1-CB 3.53Å; F68-A318 HydrophobicContact CE1-CB 3.11Å; F68-A318 HydrophobicContact CE2-CB 4.29Å; F68-A318 HydrophobicContact CG-CB 4.28Å; F68-A318 HydrophobicContact CZ-CB 3.55Å; F68-L321 HydrophobicContact CZ-CB 4.46Å; F68-L321 HydrophobicContact CZ-CD1 3.74Å; F68-A323 HydrophobicContact CE1-CB 3.6Å; F68-A323 HydrophobicContact CE2-CB 4.28Å; F68-A323 HydrophobicContact CZ-CB 3.46Å; F68-A323 VanDerWaalsContact CZ-CB 3.46Å; F68-L324 HydrophobicContact CD1-CD2 3.96Å; F68-L324 HydrophobicContact CD1-CG 4.41Å; F68-L324 HydrophobicContact CE1-CD2 4.33Å; F68-L324 HydrophobicContact CE1-CG 4.29Å; F68-V420 HydrophobicContact CB-CB 3.87Å; F68-V420 HydrophobicContact CB-CG1 3.76Å; F68-V420 HydrophobicContact CB-CG2 4.01Å; F68-V420 HydrophobicContact CD1-CG1 3.74Å; F68-V420 HydrophobicContact CD2-CB 3.53Å; F68-V420 HydrophobicContact CD2-CG1 3.48Å; F68-V420 VanDerWaalsContact CD2-CG1 3.48Å; F68-V420 HydrophobicContact CE1-CG1 4.14Å; F68-V420 HydrophobicContact CE2-CB 4.19Å; F68-V420 HydrophobicContact CE2-CG1 3.94Å; F68-V420 HydrophobicContact CG-CB 3.77Å; F68-V420 HydrophobicContact CG-CG1 3.38Å; F68-V420 HydrophobicContact CG-CG2 4.46Å; F68-V420 HydrophobicContact CZ-CG1 4.25Å
69	A	92.8	Very high	92.3	Very high	5 Å²	5	16 Å²	16	4%	0.041	8%	0.079	C	C	.	.	H	α-helix	trans	-79.8	-39.2	-176.8	0	0	0	0	0	112.3	C65 V66 G71 N74 S316 N348	C65-A69 WeakPolarHBondContact O-CB 3.45Å; C65-A69 PolarHBondContact O-N 3.45Å; V66-A69 PolarHBondContact O-N 3.49Å; A69-G71 PolarHBondContact O-N 2.94Å; A69-N74 PolarHBondContact O-OD1 2.97Å; A69-S316 CarbonylContact C-O 3.36Å; A69-S316 WeakPolarHBondContact CA-O 3.3Å; A69-N348 HydrophobicContact CB-CB 4.33Å; A69-N348 PolarHBondContact O-OD1 3.39Å
70	V	93.6	Very high	92.1	Very high	5 Å²	5	14 Å²	14	3%	0.03	7%	0.067	C	C	.	.	S	Bend	trans	-86.5	94.8	177.3	-179.8	0	0	0	0	109	V66 N74 I347 T351 L413	V66-V70 HydrophobicContact CG1-CB 4.42Å; V66-V70 HydrophobicContact CG1-CG2 4.1Å; V66-V70 WeakPolarHBondContact O-CA 3.2Å; V66-V70 WeakPolarHBondContact O-CB 3.28Å; V66-V70 PolarHBondContact O-N 3.1Å; V70-N74 WeakPolarHBondContact CA-OD1 3.19Å; V70-I347 HydrophobicContact CG2-CG2 4.33Å; V70-T351 HydrophobicContact CG1-CG2 3.54Å; V70-T351 HydrophobicContact CG2-CG2 4.47Å; V70-L413 HydrophobicContact CG1-CD2 4.27Å
71	G	90.9	Very high	91.9	Very high	4 Å²	4	14.1 Å²	14.1	4%	0.041	7%	0.067	C	C	.	.	S	Bend	trans	-129.4	-158.1	-179.5	0	0	0	0	0	113	A69 G73 N74 V75	A69-G71 PolarHBondContact O-N 2.94Å; G71-G73 PolarHBondContact O-N 2.79Å; G71-N74 PolarHBondContact N-OD1 3.07Å; G71-N74 PolarHBondContact O-N 3.1Å; G71-N74 VanDerWaalsContact O-N 3.11Å; G71-N74 PolarHBondContact O-OD1 2.99Å; G71-V75 PolarHBondContact O-N 3.41Å
72	L	87.7	Confident	91.8	Very high	18 Å²	18	14.1 Å²	14.1	9%	0.094	7%	0.067	C	C	.	.	H	α-helix	trans	-61.1	-29.6	178.2	-57.5	178.9	0	0	0	112.2	N74 V75 W76 Y148 V151 L410 L413	L72-N74 VanDerWaalsContact C-N 3.28Å; L72-N74 PolarHBondContact O-N 2.85Å; L72-V75 PolarHBondContact O-N 2.9Å; L72-W76 WeakPolarHBondContact O-CB 3.38Å; L72-W76 PolarHBondContact O-N 3.18Å; L72-Y148 HydrophobicContact CD1-CE2 3.94Å; L72-Y148 HydrophobicContact CG-CE2 4.43Å; L72-V151 HydrophobicContact CD1-CB 4.04Å; L72-V151 HydrophobicContact CD1-CG1 3.3Å; L72-L410 HydrophobicContact CD2-CD2 4.15Å; L72-L410 HydrophobicContact CD2-CG 3.71Å; L72-L413 HydrophobicContact CD2-CB 4.24Å
73	G	86.9	Confident	91.5	Very high	10 Å²	10	15 Å²	15	10%	0.103	7%	0.069	C	C	.	.	I	π-helix	trans	-60.1	-35	175.4	0	0	0	0	0	113.5	G71 R77 F78 Q312	G71-G73 PolarHBondContact O-N 2.79Å; G73-R77 WeakPolarHBondContact O-CB 3.08Å; G73-R77 PolarHBondContact O-N 3.06Å; G73-F78 PolarHBondContact O-N 3.25Å; G73-Q312 PolarHBondContact O-NE2 2.81Å
74	N	93	Very high	91.2	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	8%	0.077	C	C	.	.	I	π-helix	trans	-77	-39.7	-179.3	-55.4	70.8	0	0	0	111.6	A69 V70 G71 L72 P79 S316 N348 S352	A69-N74 PolarHBondContact O-OD1 2.97Å; V70-N74 WeakPolarHBondContact CA-OD1 3.19Å; G71-N74 PolarHBondContact N-OD1 3.07Å; G71-N74 PolarHBondContact O-N 3.1Å; G71-N74 VanDerWaalsContact O-N 3.11Å; G71-N74 PolarHBondContact O-OD1 2.99Å; L72-N74 VanDerWaalsContact C-N 3.28Å; L72-N74 PolarHBondContact O-N 2.85Å; N74-P79 WeakPolarHBondContact O-CD 3.41Å; N74-S316 PolarHBondContact ND2-OG 3.29Å; N74-S316 VanDerWaalsContact ND2-OG 3.11Å; N74-S316 PolarHBondContact OD1-OG 3.48Å; N74-N348 PolarHBondContact ND2-O 3.23Å; N74-N348 PolarHBondContact ND2-OD1 3.27Å; N74-S352 WeakPolarHBondContact CB-OG 3.21Å; N74-S352 PolarHBondContact ND2-OG 3.37Å
75	V	90.6	Very high	91.1	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.012	8%	0.078	C	C	.	.	I	π-helix	trans	-82.4	-36.1	-174.2	-175.4	0	0	0	0	112	G71 L72 P79 L272 A355 V359 M409 L413	G71-V75 PolarHBondContact O-N 3.41Å; L72-V75 PolarHBondContact O-N 2.9Å; V75-P79 WeakPolarHBondContact O-CG 3.28Å; V75-L272 HydrophobicContact CG1-CD2 4.14Å; V75-L272 HydrophobicContact CG2-CD2 4.38Å; V75-A355 HydrophobicContact CB-CB 4.36Å; V75-A355 HydrophobicContact CG1-CB 4.38Å; V75-A355 HydrophobicContact CG2-CB 4.25Å; V75-V359 WeakPolarHBondContact O-CG2 3.35Å; V75-M409 HydrophobicContact CG1-CE 4.4Å; V75-L413 HydrophobicContact CG2-CD1 3.72Å
76	W	79.6	Confident	90.9	Very high	16 Å²	16	17.5 Å²	17.5	6%	0.061	8%	0.081	C	C	.	.	I	π-helix	trans	-110.5	-52.2	-170.4	-57.6	94.3	0	0	0	112.8	L72 L384 A385 Y389 F406	L72-W76 WeakPolarHBondContact O-CB 3.38Å; L72-W76 PolarHBondContact O-N 3.18Å; W76-L384 HydrophobicContact CB-CD2 4.28Å; W76-L384 HydrophobicContact CE3-CB 4.34Å; W76-L384 HydrophobicContact CE3-CD2 3.87Å; W76-L384 HydrophobicContact CE3-CG 3.78Å; W76-L384 HydrophobicContact CZ3-CG 4.23Å; W76-L384 VanDerWaalsContact O-CD2 3.28Å; W76-L384 WeakPolarHBondContact O-CD2 3.21Å; W76-A385 HydrophobicContact CD2-CB 3.83Å; W76-A385 HydrophobicContact CE3-CB 3.85Å; W76-A385 HydrophobicContact CG-CB 4.33Å; W76-A385 HydrophobicContact CZ3-CB 4.42Å; W76-Y389 AromaticContact CH2-CD2 3.62Å; W76-Y389 HydrophobicContact CH2-CD2 3.62Å; W76-Y389 HydrophobicContact CH2-CE2 4.24Å; W76-Y389 AromaticContact CH2-CG 3.91Å; W76-Y389 HydrophobicContact CH2-CG 3.91Å; W76-Y389 HydrophobicContact CZ3-CD2 4.05Å; W76-Y389 HydrophobicContact CZ3-CG 4.22Å; W76-F406 AromaticContact CE2-CZ 3.95Å; W76-F406 HydrophobicContact CH2-CD2 4.32Å; W76-F406 HydrophobicContact CH2-CE1 4.44Å; W76-F406 AromaticContact CH2-CE2 3.02Å; W76-F406 HydrophobicContact CH2-CE2 3.02Å; W76-F406 AromaticContact CH2-CZ 3.09Å; W76-F406 HydrophobicContact CH2-CZ 3.09Å; W76-F406 HydrophobicContact CZ2-CD2 4.23Å; W76-F406 HydrophobicContact CZ2-CE1 4.44Å; W76-F406 AromaticContact CZ2-CE2 2.97Å; W76-F406 HydrophobicContact CZ2-CE2 2.97Å; W76-F406 AromaticContact CZ2-CZ 3.09Å; W76-F406 HydrophobicContact CZ2-CZ 3.09Å; W76-F406 HydrophobicContact CZ3-CE2 4.21Å; W76-F406 AromaticContact CZ3-CZ 3.93Å; W76-F406 HydrophobicContact CZ3-CZ 3.93Å
77	R	87.9	Confident	90.7	Very high	94 Å²	94	17.1 Å²	17.1	36%	0.355	8%	0.08	S	C	.	.	I	π-helix	trans	-75	-44.8	-171.6	-173.5	-180	175.9	171.2	0.9	111.6	G73 Y80 L81 Q312	G73-R77 WeakPolarHBondContact O-CB 3.08Å; G73-R77 PolarHBondContact O-N 3.06Å; R77-Y80 WeakPolarHBondContact O-CB 3.29Å; R77-Y80 PolarHBondContact O-N 3.23Å; R77-L81 HydrophobicContact CG-CD1 3.99Å; R77-L81 HydrophobicContact CG-CG 4.27Å; R77-L81 WeakPolarHBondContact O-CG 2.88Å; R77-L81 PolarHBondContact O-N 3.21Å; R77-Q312 VanDerWaalsContact CD-OE1 3.28Å
78	F	93.4	Very high	90.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.7	-50	-178.4	172.5	-87.8	0	0	0	113.2	G73 Y80 L81 C82 F90 L91 Y94 Y292 Q312 S352	G73-F78 PolarHBondContact O-N 3.25Å; F78-Y80 PolarHBondContact O-N 3.17Å; F78-L81 PolarHBondContact O-N 3.45Å; F78-L81 VanDerWaalsContact O-N 3.14Å; F78-C82 WeakPolarHBondContact O-CB 3.45Å; F78-C82 PolarHBondContact O-N 2.71Å; F78-F90 HydrophobicContact CD2-CE1 4.28Å; F78-F90 HydrophobicContact CE2-CD1 4.43Å; F78-F90 HydrophobicContact CE2-CE1 4.05Å; F78-L91 HydrophobicContact CZ-CD2 3.71Å; F78-Y94 HydrophobicContact CD2-CD2 4.09Å; F78-Y94 AromaticContact CD2-CE2 3.63Å; F78-Y94 HydrophobicContact CD2-CE2 3.63Å; F78-Y94 HydrophobicContact CE2-CD1 4.1Å; F78-Y94 AromaticContact CE2-CD2 3.66Å; F78-Y94 HydrophobicContact CE2-CD2 3.66Å; F78-Y94 AromaticContact CE2-CE1 3.95Å; F78-Y94 HydrophobicContact CE2-CE1 3.95Å; F78-Y94 AromaticContact CE2-CE2 3.47Å; F78-Y94 HydrophobicContact CE2-CE2 3.47Å; F78-Y94 VanDerWaalsContact CE2-CE2 3.47Å; F78-Y94 AromaticContact CE2-CG 3.97Å; F78-Y94 HydrophobicContact CE2-CG 3.97Å; F78-Y94 AromaticContact CE2-CZ 3.64Å; F78-Y292 WeakPolarHBondContact CE1-OH 3.04Å; F78-Q312 HydrophobicContact CD2-CG 4.18Å; F78-S352 WeakPolarHBondContact CD1-O 3.44Å; F78-S352 WeakPolarHBondContact CE1-O 3.39Å
79	P	92.7	Very high	90.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.1	-40.4	178.3	-27.9	38.8	0	0	0	111.7	N74 V75 C82 Y83 V359 F360	N74-P79 WeakPolarHBondContact O-CD 3.41Å; V75-P79 WeakPolarHBondContact O-CG 3.28Å; P79-C82 WeakPolarHBondContact O-CB 3.16Å; P79-C82 PolarHBondContact O-N 3.05Å; P79-Y83 PolarHBondContact O-N 3.1Å; P79-V359 HydrophobicContact CB-CB 4.28Å; P79-V359 HydrophobicContact CB-CG1 4.37Å; P79-V359 HydrophobicContact CG-CB 4.41Å; P79-V359 HydrophobicContact CG-CG2 4.32Å; P79-F360 HydrophobicContact CB-CD2 4.04Å; P79-F360 HydrophobicContact CB-CE2 3.68Å; P79-F360 WeakPolarHBondContact O-CE2 3.22Å
80	Y	88.7	Confident	91	Very high	47 Å²	47	16.9 Å²	16.9	18%	0.184	8%	0.082	C	C	.	.	H	α-helix	trans	-59.5	-50.1	175.2	169.5	-89.6	0	0	0	112.2	R77 F78 C82 Y83 K84 E379	R77-Y80 WeakPolarHBondContact O-CB 3.29Å; R77-Y80 PolarHBondContact O-N 3.23Å; F78-Y80 PolarHBondContact O-N 3.17Å; Y80-C82 VanDerWaalsContact C-N 3.28Å; Y80-C82 PolarHBondContact O-N 3.09Å; Y80-Y83 VanDerWaalsContact CA-CE1 3.49Å; Y80-Y83 AromaticContact CD2-CE1 3.37Å; Y80-Y83 HydrophobicContact CD2-CE1 3.37Å; Y80-Y83 AromaticContact CD2-CZ 3.74Å; Y80-Y83 VanDerWaalsContact CD2-OH 3.27Å; Y80-Y83 WeakPolarHBondContact CD2-OH 3.49Å; Y80-Y83 AromaticContact CE2-CE1 3.91Å; Y80-Y83 HydrophobicContact CE2-CE1 3.91Å; Y80-Y83 AromaticContact CE2-CZ 3.79Å; Y80-Y83 WeakPolarHBondContact CE2-OH 3.34Å; Y80-Y83 AromaticContact CG-CE1 3.92Å; Y80-Y83 HydrophobicContact CG-CE1 3.92Å; Y80-Y83 WeakPolarHBondContact O-CD1 3.5Å; Y80-Y83 WeakPolarHBondContact O-CE1 3.27Å; Y80-Y83 PolarHBondContact O-N 3.25Å; Y80-K84 HydrophobicContact CE1-CB 4.4Å; Y80-K84 HydrophobicContact CE1-CD 3.73Å; Y80-K84 VanDerWaalsContact O-CB 3.32Å; Y80-K84 WeakPolarHBondContact O-CB 3.38Å; Y80-K84 PolarHBondContact O-N 3.33Å; Y80-E379 VanDerWaalsContact CD2-O 3.31Å; Y80-E379 WeakPolarHBondContact CD2-O 3.39Å
81	L	91.3	Very high	91.2	Very high	9 Å²	9	18.6 Å²	18.6	5%	0.047	9%	0.091	C	C	.	.	H	α-helix	trans	-64	-34.9	179.2	-68.6	179.1	0	0	0	112.3	R77 F78 K84 N85 F90 D308 Q312	R77-L81 HydrophobicContact CG-CD1 3.99Å; R77-L81 HydrophobicContact CG-CG 4.27Å; R77-L81 WeakPolarHBondContact O-CG 2.88Å; R77-L81 PolarHBondContact O-N 3.21Å; F78-L81 PolarHBondContact O-N 3.45Å; F78-L81 VanDerWaalsContact O-N 3.14Å; L81-K84 HydrophobicContact CD2-CD 4.45Å; L81-N85 VanDerWaalsContact O-CB 3.22Å; L81-N85 WeakPolarHBondContact O-CB 3.26Å; L81-N85 PolarHBondContact O-N 3.38Å; L81-N85 VanDerWaalsContact O-N 3.17Å; L81-N85 PolarHBondContact O-ND2 3.27Å; L81-F90 HydrophobicContact CB-CE1 4.1Å; L81-F90 HydrophobicContact CB-CE2 4.43Å; L81-F90 HydrophobicContact CB-CZ 3.82Å; L81-D308 HydrophobicContact CD2-CB 4.18Å; L81-Q312 HydrophobicContact CD1-CB 3.8Å; L81-Q312 HydrophobicContact CD1-CG 4.11Å
82	C	93.5	Very high	91.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.4	-54.7	177.8	-168.9	0	0	0	0	111.2	F78 P79 Y80 N85 G86 G87 F90 Y292	F78-C82 WeakPolarHBondContact O-CB 3.45Å; F78-C82 PolarHBondContact O-N 2.71Å; P79-C82 WeakPolarHBondContact O-CB 3.16Å; P79-C82 PolarHBondContact O-N 3.05Å; Y80-C82 VanDerWaalsContact C-N 3.28Å; Y80-C82 PolarHBondContact O-N 3.09Å; C82-N85 PolarHBondContact O-N 3.41Å; C82-G86 PolarHBondContact O-N 3.39Å; C82-G87 VanDerWaalsContact O-CA 3.26Å; C82-G87 WeakPolarHBondContact O-CA 3.2Å; C82-G87 PolarHBondContact O-N 3.06Å; C82-G87 PolarHBondContact SG-O 3.45Å; C82-F90 HydrophobicContact CB-CD1 4.06Å; C82-Y292 HydrophobicContact CB-CD2 4.1Å; C82-Y292 HydrophobicContact CB-CE2 3.64Å; C82-Y292 WeakPolarHBondContact SG-CE2 3.28Å
83	Y	88.5	Confident	91.9	Very high	36 Å²	36	20.8 Å²	20.8	14%	0.141	10%	0.101	C	C	.	.	H	α-helix	trans	-71.2	-42.4	-178.4	89.6	-88.5	0	0	0	112.5	P79 Y80 N85 G86 Y291 F360 A378	P79-Y83 PolarHBondContact O-N 3.1Å; Y80-Y83 VanDerWaalsContact CA-CE1 3.49Å; Y80-Y83 AromaticContact CD2-CE1 3.37Å; Y80-Y83 HydrophobicContact CD2-CE1 3.37Å; Y80-Y83 AromaticContact CD2-CZ 3.74Å; Y80-Y83 VanDerWaalsContact CD2-OH 3.27Å; Y80-Y83 WeakPolarHBondContact CD2-OH 3.49Å; Y80-Y83 AromaticContact CE2-CE1 3.91Å; Y80-Y83 HydrophobicContact CE2-CE1 3.91Å; Y80-Y83 AromaticContact CE2-CZ 3.79Å; Y80-Y83 WeakPolarHBondContact CE2-OH 3.34Å; Y80-Y83 AromaticContact CG-CE1 3.92Å; Y80-Y83 HydrophobicContact CG-CE1 3.92Å; Y80-Y83 WeakPolarHBondContact O-CD1 3.5Å; Y80-Y83 WeakPolarHBondContact O-CE1 3.27Å; Y80-Y83 PolarHBondContact O-N 3.25Å; Y83-N85 PolarHBondContact O-N 2.87Å; Y83-N85 VanDerWaalsContact O-N 3.07Å; Y83-G86 PolarHBondContact O-N 2.93Å; Y83-Y291 HydrophobicContact CD2-CD1 4.45Å; Y83-Y291 AromaticContact CD2-CE1 3.48Å; Y83-Y291 HydrophobicContact CD2-CE1 3.48Å; Y83-Y291 VanDerWaalsContact CD2-CE1 3.48Å; Y83-Y291 HydrophobicContact CE2-CE1 4.17Å; Y83-Y291 AromaticContact CG-CE1 3.99Å; Y83-Y291 HydrophobicContact CG-CE1 3.99Å; Y83-F360 HydrophobicContact CD1-CE1 4.29Å; Y83-F360 HydrophobicContact CD1-CE2 4.27Å; Y83-F360 AromaticContact CD1-CZ 3.42Å; Y83-F360 HydrophobicContact CD1-CZ 3.42Å; Y83-F360 VanDerWaalsContact CD1-CZ 3.42Å; Y83-F360 HydrophobicContact CE1-CZ 4.2Å; Y83-F360 HydrophobicContact CG-CE1 4.33Å; Y83-F360 AromaticContact CG-CZ 3.79Å; Y83-F360 HydrophobicContact CG-CZ 3.79Å; Y83-A378 HydrophobicContact CE1-CB 3.78Å; Y83-A378 HydrophobicContact CE2-CB 4.15Å; Y83-A378 WeakPolarHBondContact OH-CB 3.44Å; Y83-A378 PolarHBondContact OH-O 3.4Å
84	K	89.5	Confident	92.3	Very high	80 Å²	80	20.6 Å²	20.6	35%	0.348	10%	0.097	S	C	.	.	H	α-helix	trans	-52.2	-36.4	178.9	178.6	-163.9	172.4	-158.6	0	110.9	Y80 L81 D308	Y80-K84 HydrophobicContact CE1-CB 4.4Å; Y80-K84 HydrophobicContact CE1-CD 3.73Å; Y80-K84 VanDerWaalsContact O-CB 3.32Å; Y80-K84 WeakPolarHBondContact O-CB 3.38Å; Y80-K84 PolarHBondContact O-N 3.33Å; L81-K84 HydrophobicContact CD2-CD 4.45Å; K84-D308 IonicContact NZ-OD2 3.37Å; K84-D308 PolarHBondContact NZ-OD2 3.41Å
85	N	92.8	Very high	92.5	Very high	7 Å²	7	24.1 Å²	24.1	4%	0.037	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	23.6	-175.3	-66.8	-54.5	0	0	0	114.1	L81 C82 Y83 F90 K299 V305 D308	L81-N85 VanDerWaalsContact O-CB 3.22Å; L81-N85 WeakPolarHBondContact O-CB 3.26Å; L81-N85 PolarHBondContact O-N 3.38Å; L81-N85 VanDerWaalsContact O-N 3.17Å; L81-N85 PolarHBondContact O-ND2 3.27Å; C82-N85 PolarHBondContact O-N 3.41Å; Y83-N85 PolarHBondContact O-N 2.87Å; Y83-N85 VanDerWaalsContact O-N 3.07Å; N85-F90 HydrophobicContact CB-CB 4.13Å; N85-F90 HydrophobicContact CB-CD2 3.42Å; N85-F90 VanDerWaalsContact CB-CD2 3.42Å; N85-F90 HydrophobicContact CB-CE2 4.11Å; N85-F90 HydrophobicContact CB-CG 4.06Å; N85-K299 WeakPolarHBondContact O-CB 3.26Å; N85-V305 HydrophobicContact CB-CB 4.33Å; N85-V305 HydrophobicContact CB-CG1 4.07Å; N85-V305 HydrophobicContact CB-CG2 3.9Å; N85-D308 WeakPolarHBondContact ND2-CB 3.49Å; N85-D308 PolarHBondContact ND2-OD2 2.87Å; N85-D308 PolarHBondContact OD1-OD2 2.83Å
86	G	91.6	Very high	92.8	Very high	6 Å²	6	27.8 Å²	27.8	6%	0.062	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.7	25.2	170.4	0	0	0	0	0	115.4	C82 Y83 G88 V89 P295 D296	C82-G86 PolarHBondContact O-N 3.39Å; Y83-G86 PolarHBondContact O-N 2.93Å; G86-G88 PolarHBondContact O-N 2.93Å; G86-V89 PolarHBondContact O-N 3.24Å; G86-P295 WeakPolarHBondContact O-CA 3.21Å; G86-D296 PolarHBondContact O-N 3.2Å
87	G	92.8	Very high	93.5	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.021	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	63.5	-129.2	177.5	0	0	0	0	0	111.6	C82 V89 F90 Y292	C82-G87 VanDerWaalsContact O-CA 3.26Å; C82-G87 WeakPolarHBondContact O-CA 3.2Å; C82-G87 PolarHBondContact O-N 3.06Å; C82-G87 PolarHBondContact SG-O 3.45Å; G87-V89 PolarHBondContact O-N 3.22Å; G87-F90 WeakPolarHBondContact O-CB 3.34Å; G87-F90 PolarHBondContact O-N 2.97Å; G87-Y292 CarbonylContact C-O 3.53Å; G87-Y292 WeakPolarHBondContact CA-O 3.33Å
88	G	93.8	Very high	94	Very high	17 Å²	17	23.4 Å²	23.4	18%	0.175	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-57.6	-20.6	-176.4	0	0	0	0	0	114.9	G86 F90 L91 L293	G86-G88 PolarHBondContact O-N 2.93Å; G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.3Å; G88-L91 WeakPolarHBondContact O-CB 3.32Å; G88-L91 WeakPolarHBondContact O-CG 3.34Å; G88-L91 PolarHBondContact O-N 2.95Å; G88-L293 WeakPolarHBondContact CA-O 3.27Å; G88-L293 PolarHBondContact N-O 3.35Å; G88-L293 VanDerWaalsContact N-O 3.08Å
89	V	96.5	Very high	94.1	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-63.1	-35	175	170.3	0	0	0	0	112.2	G86 G87 L91 I92 P93 P295 W297 L300	G86-V89 PolarHBondContact O-N 3.24Å; G87-V89 PolarHBondContact O-N 3.22Å; V89-L91 PolarHBondContact O-N 3.5Å; V89-L91 VanDerWaalsContact O-N 3.14Å; V89-I92 WeakPolarHBondContact O-CB 3.49Å; V89-I92 PolarHBondContact O-N 2.9Å; V89-P93 VanDerWaalsContact O-CD 3.24Å; V89-P93 WeakPolarHBondContact O-CD 3.41Å; V89-P295 HydrophobicContact CG2-CB 3.43Å; V89-P295 VanDerWaalsContact CG2-CB 3.43Å; V89-W297 HydrophobicContact CG2-CD2 4.04Å; V89-W297 HydrophobicContact CG2-CE3 4.08Å; V89-W297 HydrophobicContact CG2-CG 4.4Å; V89-W297 HydrophobicContact CG2-CZ3 4.49Å; V89-L300 HydrophobicContact CG1-CD1 4.02Å; V89-L300 HydrophobicContact CG1-CD2 3.41Å; V89-L300 VanDerWaalsContact CG1-CD2 3.41Å; V89-L300 HydrophobicContact CG1-CG 3.33Å
90	F	96.5	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-59.7	-24.9	178.5	179.7	-106	0	0	0	112.8	F78 L81 C82 N85 G87 G88 I92 P93 Y94 V305 D308 A309	F78-F90 HydrophobicContact CD2-CE1 4.28Å; F78-F90 HydrophobicContact CE2-CD1 4.43Å; F78-F90 HydrophobicContact CE2-CE1 4.05Å; L81-F90 HydrophobicContact CB-CE1 4.1Å; L81-F90 HydrophobicContact CB-CE2 4.43Å; L81-F90 HydrophobicContact CB-CZ 3.82Å; C82-F90 HydrophobicContact CB-CD1 4.06Å; N85-F90 HydrophobicContact CB-CB 4.13Å; N85-F90 HydrophobicContact CB-CD2 3.42Å; N85-F90 VanDerWaalsContact CB-CD2 3.42Å; N85-F90 HydrophobicContact CB-CE2 4.11Å; N85-F90 HydrophobicContact CB-CG 4.06Å; G87-F90 WeakPolarHBondContact O-CB 3.34Å; G87-F90 PolarHBondContact O-N 2.97Å; G88-F90 VanDerWaalsContact C-N 3.3Å; G88-F90 PolarHBondContact O-N 3.3Å; F90-I92 PolarHBondContact O-N 3.01Å; F90-P93 VanDerWaalsContact O-CD 3.24Å; F90-P93 WeakPolarHBondContact O-CD 3.43Å; F90-P93 WeakPolarHBondContact O-CG 3.38Å; F90-Y94 HydrophobicContact CE1-CD2 4.13Å; F90-Y94 WeakPolarHBondContact O-CB 3.36Å; F90-Y94 PolarHBondContact O-N 3.32Å; F90-Y94 VanDerWaalsContact O-N 3.1Å; F90-V305 HydrophobicContact CD2-CG1 4.15Å; F90-D308 HydrophobicContact CE2-CB 4.04Å; F90-A309 HydrophobicContact CD2-CB 4.35Å; F90-A309 HydrophobicContact CE2-CB 3.66Å; F90-A309 HydrophobicContact CZ-CB 3.95Å
91	L	96.3	Very high	94.6	Very high	41 Å²	41	26.5 Å²	26.5	22%	0.215	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-26.1	177.7	-57.7	176.8	0	0	0	112.5	F78 G88 V89 V95 F353	F78-L91 HydrophobicContact CZ-CD2 3.71Å; G88-L91 WeakPolarHBondContact O-CB 3.32Å; G88-L91 WeakPolarHBondContact O-CG 3.34Å; G88-L91 PolarHBondContact O-N 2.95Å; V89-L91 PolarHBondContact O-N 3.5Å; V89-L91 VanDerWaalsContact O-N 3.14Å; L91-V95 WeakPolarHBondContact O-CB 3.4Å; L91-V95 WeakPolarHBondContact O-CG2 3.41Å; L91-V95 PolarHBondContact O-N 3.14Å; L91-F353 HydrophobicContact CD1-CD2 4.13Å; L91-F353 HydrophobicContact CD1-CE2 3.77Å; L91-F353 HydrophobicContact CD2-CD2 4.22Å
92	I	97.1	Very high	94.8	Very high	67 Å²	67	26.1 Å²	26.1	34%	0.344	14%	0.141	S	C	.	.	H	α-helix	trans	-65	-62.5	177.8	-60.8	170.3	0	0	0	110.9	V89 F90 Y94 V95 L96 W297 L300	V89-I92 WeakPolarHBondContact O-CB 3.49Å; V89-I92 PolarHBondContact O-N 2.9Å; F90-I92 PolarHBondContact O-N 3.01Å; I92-Y94 VanDerWaalsContact C-N 3.26Å; I92-Y94 PolarHBondContact O-N 3.25Å; I92-V95 PolarHBondContact O-N 3.07Å; I92-L96 HydrophobicContact CG2-CD1 4.03Å; I92-L96 VanDerWaalsContact O-CG 3.31Å; I92-L96 WeakPolarHBondContact O-CG 3.31Å; I92-L96 PolarHBondContact O-N 3.5Å; I92-W297 HydrophobicContact CD1-CH2 4.28Å; I92-W297 HydrophobicContact CD1-CZ3 3.82Å; I92-L300 HydrophobicContact CD1-CD1 4.34Å
93	P	96.2	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-35.1	176.9	24.1	-32.8	0	0	0	112	V89 F90 L96 I97 V305 W306 A309	V89-P93 VanDerWaalsContact O-CD 3.24Å; V89-P93 WeakPolarHBondContact O-CD 3.41Å; F90-P93 VanDerWaalsContact O-CD 3.24Å; F90-P93 WeakPolarHBondContact O-CD 3.43Å; F90-P93 WeakPolarHBondContact O-CG 3.38Å; P93-L96 PolarHBondContact O-N 3.18Å; P93-I97 WeakPolarHBondContact O-CB 3.24Å; P93-I97 VanDerWaalsContact O-CG1 3.25Å; P93-I97 WeakPolarHBondContact O-CG1 3.24Å; P93-I97 PolarHBondContact O-N 3.35Å; P93-V305 HydrophobicContact CG-CG1 3.76Å; P93-W306 HydrophobicContact CB-CD2 3.74Å; P93-W306 HydrophobicContact CB-CE3 3.43Å; P93-W306 VanDerWaalsContact CB-CE3 3.43Å; P93-W306 HydrophobicContact CB-CG 4.37Å; P93-W306 HydrophobicContact CB-CH2 4.16Å; P93-W306 HydrophobicContact CB-CZ2 4.43Å; P93-W306 HydrophobicContact CB-CZ3 3.66Å; P93-A309 HydrophobicContact CB-CB 3.88Å; P93-A309 HydrophobicContact CG-CB 4.16Å
94	Y	96.3	Very high	95.3	Very high	6 Å²	6	25.3 Å²	25.3	2%	0.024	14%	0.139	C	C	.	.	H	α-helix	trans	-59.1	-50.6	176.2	-179.2	-92.2	0	0	0	112.6	F78 F90 I92 I97 A98 Q312 I313 S349	F78-Y94 HydrophobicContact CD2-CD2 4.09Å; F78-Y94 AromaticContact CD2-CE2 3.63Å; F78-Y94 HydrophobicContact CD2-CE2 3.63Å; F78-Y94 HydrophobicContact CE2-CD1 4.1Å; F78-Y94 AromaticContact CE2-CD2 3.66Å; F78-Y94 HydrophobicContact CE2-CD2 3.66Å; F78-Y94 AromaticContact CE2-CE1 3.95Å; F78-Y94 HydrophobicContact CE2-CE1 3.95Å; F78-Y94 AromaticContact CE2-CE2 3.47Å; F78-Y94 HydrophobicContact CE2-CE2 3.47Å; F78-Y94 VanDerWaalsContact CE2-CE2 3.47Å; F78-Y94 AromaticContact CE2-CG 3.97Å; F78-Y94 HydrophobicContact CE2-CG 3.97Å; F78-Y94 AromaticContact CE2-CZ 3.64Å; F90-Y94 HydrophobicContact CE1-CD2 4.13Å; F90-Y94 WeakPolarHBondContact O-CB 3.36Å; F90-Y94 PolarHBondContact O-N 3.32Å; F90-Y94 VanDerWaalsContact O-N 3.1Å; I92-Y94 VanDerWaalsContact C-N 3.26Å; I92-Y94 PolarHBondContact O-N 3.25Å; Y94-I97 PolarHBondContact O-N 2.93Å; Y94-A98 WeakPolarHBondContact O-CB 3.44Å; Y94-A98 PolarHBondContact O-N 3.27Å; Y94-Q312 HydrophobicContact CD2-CG 4.47Å; Y94-Q312 HydrophobicContact CE2-CG 3.98Å; Y94-I313 HydrophobicContact CD1-CD1 4.21Å; Y94-I313 HydrophobicContact CD2-CD1 3.73Å; Y94-I313 HydrophobicContact CD2-CG1 3.84Å; Y94-I313 HydrophobicContact CE1-CD1 3.82Å; Y94-I313 HydrophobicContact CE2-CD1 3.29Å; Y94-I313 HydrophobicContact CE2-CG1 3.79Å; Y94-I313 HydrophobicContact CG-CD1 4.17Å; Y94-I313 HydrophobicContact CG-CG1 4.42Å; Y94-S349 WeakPolarHBondContact CE1-OG 3.2Å; Y94-S349 PolarHBondContact OH-OG 3.09Å; Y94-S349 VanDerWaalsContact OH-OG 3.13Å
95	V	97.1	Very high	95.7	Very high	75 Å²	75	21.5 Å²	21.5	46%	0.455	12%	0.123	S	C	.	.	H	α-helix	trans	-67.1	-40.9	178.7	170.4	0	0	0	0	111.3	L91 I92 I97 A98 L99	L91-V95 WeakPolarHBondContact O-CB 3.4Å; L91-V95 WeakPolarHBondContact O-CG2 3.41Å; L91-V95 PolarHBondContact O-N 3.14Å; I92-V95 PolarHBondContact O-N 3.07Å; V95-I97 PolarHBondContact O-N 3.38Å; V95-A98 WeakPolarHBondContact O-CB 3.42Å; V95-A98 PolarHBondContact O-N 3.39Å; V95-L99 HydrophobicContact CG1-CD1 4.04Å; V95-L99 HydrophobicContact CG1-CG 4.44Å; V95-L99 WeakPolarHBondContact O-CG 3.27Å; V95-L99 PolarHBondContact O-N 2.82Å
96	L	96.7	Very high	95.8	Very high	80 Å²	80	21.2 Å²	21.2	42%	0.419	12%	0.121	S	C	.	.	H	α-helix	trans	-61.9	-45.2	177.8	-70.4	175.2	0	0	0	111.7	I92 P93 A98 L99 V100 W306	I92-L96 HydrophobicContact CG2-CD1 4.03Å; I92-L96 VanDerWaalsContact O-CG 3.31Å; I92-L96 WeakPolarHBondContact O-CG 3.31Å; I92-L96 PolarHBondContact O-N 3.5Å; P93-L96 PolarHBondContact O-N 3.18Å; L96-A98 VanDerWaalsContact C-N 3.34Å; L96-L99 PolarHBondContact O-N 3.37Å; L96-V100 VanDerWaalsContact O-CB 3.31Å; L96-V100 WeakPolarHBondContact O-CB 3.4Å; L96-V100 VanDerWaalsContact O-CG2 3.24Å; L96-V100 WeakPolarHBondContact O-CG2 3.24Å; L96-V100 PolarHBondContact O-N 3.06Å; L96-W306 HydrophobicContact CD1-CH2 3.99Å; L96-W306 HydrophobicContact CD1-CZ3 4.03Å
97	I	95.5	Very high	96.1	Very high	11 Å²	11	21 Å²	21	6%	0.056	12%	0.118	C	C	.	.	H	α-helix	trans	-70.6	-32	178.5	-62.4	167.5	0	0	0	111.3	P93 Y94 V95 L99 G101 G102 W306 A309 I313 F314 V530	P93-I97 WeakPolarHBondContact O-CB 3.24Å; P93-I97 VanDerWaalsContact O-CG1 3.25Å; P93-I97 WeakPolarHBondContact O-CG1 3.24Å; P93-I97 PolarHBondContact O-N 3.35Å; Y94-I97 PolarHBondContact O-N 2.93Å; V95-I97 PolarHBondContact O-N 3.38Å; I97-L99 VanDerWaalsContact C-N 3.35Å; I97-L99 PolarHBondContact O-N 2.85Å; I97-G101 WeakPolarHBondContact O-CA 3.34Å; I97-G101 PolarHBondContact O-N 2.79Å; I97-G102 PolarHBondContact O-N 3.49Å; I97-W306 WeakPolarHBondContact CD1-O 3.35Å; I97-A309 HydrophobicContact CD1-CB 3.92Å; I97-I313 HydrophobicContact CG2-CB 4.24Å; I97-I313 HydrophobicContact CG2-CG1 4.43Å; I97-I313 HydrophobicContact CG2-CG2 4.28Å; I97-F314 HydrophobicContact CG2-CD2 4.44Å; I97-F314 HydrophobicContact CG2-CE2 3.93Å; I97-V530 HydrophobicContact CG2-CG1 4.44Å
98	A	96.6	Very high	96.4	Very high	6 Å²	6	20.9 Å²	20.9	5%	0.05	12%	0.117	C	C	.	.	I	π-helix	trans	-58.7	-45.8	169.9	0	0	0	0	0	111.8	Y94 V95 L96 G102 I103 I313	Y94-A98 WeakPolarHBondContact O-CB 3.44Å; Y94-A98 PolarHBondContact O-N 3.27Å; V95-A98 WeakPolarHBondContact O-CB 3.42Å; V95-A98 PolarHBondContact O-N 3.39Å; L96-A98 VanDerWaalsContact C-N 3.34Å; A98-G102 PolarHBondContact O-N 2.93Å; A98-I103 WeakPolarHBondContact O-CG1 3.43Å; A98-I103 PolarHBondContact O-N 3.46Å; A98-I313 HydrophobicContact CB-CD1 3.67Å; A98-I313 HydrophobicContact CB-CG1 4.38Å
99	L	96.8	Very high	96.6	Very high	84 Å²	84	20.1 Å²	20.1	44%	0.44	11%	0.109	S	C	.	.	I	π-helix	trans	-72.8	-33.7	-178.6	-67.5	172.8	0	0	0	113.5	V95 L96 I97 I103 W518	V95-L99 HydrophobicContact CG1-CD1 4.04Å; V95-L99 HydrophobicContact CG1-CG 4.44Å; V95-L99 WeakPolarHBondContact O-CG 3.27Å; V95-L99 PolarHBondContact O-N 2.82Å; L96-L99 PolarHBondContact O-N 3.37Å; I97-L99 VanDerWaalsContact C-N 3.35Å; I97-L99 PolarHBondContact O-N 2.85Å; L99-I103 HydrophobicContact CD2-CD1 4.14Å; L99-W518 PolarHBondContact O-NE1 2.98Å
100	V	96.4	Very high	96.6	Very high	29 Å²	29	20 Å²	20	18%	0.176	11%	0.109	C	C	.	.	I	π-helix	trans	-93.8	-30.4	-173	174.9	0	0	0	0	112.8	L96 W518 C522 F526 T527 V530	L96-V100 VanDerWaalsContact O-CB 3.31Å; L96-V100 WeakPolarHBondContact O-CB 3.4Å; L96-V100 VanDerWaalsContact O-CG2 3.24Å; L96-V100 WeakPolarHBondContact O-CG2 3.24Å; L96-V100 PolarHBondContact O-N 3.06Å; V100-W518 HydrophobicContact CG2-CH2 4.46Å; V100-W518 HydrophobicContact CG2-CZ2 3.94Å; V100-C522 PolarHBondContact O-SG 2.49Å; V100-C522 VanDerWaalsContact O-SG 3.39Å; V100-F526 HydrophobicContact CG1-CB 3.39Å; V100-F526 HydrophobicContact CG1-CG 4.33Å; V100-T527 PolarHBondContact O-OG1 3.02Å; V100-V530 HydrophobicContact CG1-CG2 4.2Å
101	G	94.4	Very high	96.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	I	π-helix	trans	-125.2	-53.1	-175.5	0	0	0	0	0	113.5	I97 P104 I105	I97-G101 WeakPolarHBondContact O-CA 3.34Å; I97-G101 PolarHBondContact O-N 2.79Å; G101-P104 WeakPolarHBondContact O-CD 3.3Å; G101-I105 WeakPolarHBondContact O-CG1 3.47Å; G101-I105 PolarHBondContact O-N 2.96Å; G101-I105 VanDerWaalsContact O-N 3.13Å
102	G	95.2	Very high	96.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	I	π-helix	trans	-58.7	-64.3	-174	0	0	0	0	0	113.8	I97 A98 I105 F106 I319	I97-G102 PolarHBondContact O-N 3.49Å; A98-G102 PolarHBondContact O-N 2.93Å; G102-I105 PolarHBondContact O-N 3.35Å; G102-F106 VanDerWaalsContact O-CB 3.24Å; G102-F106 WeakPolarHBondContact O-CB 3.48Å; G102-F106 PolarHBondContact O-N 3.5Å; G102-I319 WeakPolarHBondContact O-CD1 3.21Å
103	I	96.9	Very high	96.8	Very high	20 Å²	20	15 Å²	15	10%	0.103	8%	0.083	C	C	.	.	H	α-helix	trans	-59	-47.5	-178.4	-63.3	172.2	0	0	0	111.7	A98 L99 I105 F106 F107 Y317 I342 A345 M519	A98-I103 WeakPolarHBondContact O-CG1 3.43Å; A98-I103 PolarHBondContact O-N 3.46Å; L99-I103 HydrophobicContact CD2-CD1 4.14Å; I103-I105 PolarHBondContact O-N 2.79Å; I103-F106 PolarHBondContact O-N 3.48Å; I103-F107 WeakPolarHBondContact O-CB 3.36Å; I103-F107 PolarHBondContact O-N 3.48Å; I103-Y317 HydrophobicContact CG1-CE2 4.14Å; I103-I342 HydrophobicContact CG2-CG1 4.37Å; I103-A345 HydrophobicContact CD1-CB 3.96Å; I103-A345 HydrophobicContact CG1-CB 3.47Å; I103-A345 VanDerWaalsContact CG1-CB 3.47Å; I103-M519 HydrophobicContact CG2-CE 3.87Å
104	P	97.4	Very high	96.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.3	-47.8	178.5	-27.4	36.3	0	0	0	113.5	G101 F107 L108 M519 C522 W523	G101-P104 WeakPolarHBondContact O-CD 3.3Å; P104-F107 PolarHBondContact O-N 3.36Å; P104-L108 WeakPolarHBondContact O-CB 2.94Å; P104-L108 PolarHBondContact O-N 3.08Å; P104-M519 HydrophobicContact CB-SD 4.13Å; P104-M519 HydrophobicContact CG-SD 4.05Å; P104-C522 HydrophobicContact CB-CB 3.59Å; P104-C522 HydrophobicContact CG-CB 3.48Å; P104-C522 VanDerWaalsContact CG-CB 3.48Å; P104-W523 VanDerWaalsContact C-NE1 3.27Å; P104-W523 PolarHBondContact O-NE1 3.18Å
105	I	96.4	Very high	96.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-72.3	-40.5	-178.5	-56.4	178.8	0	0	0	111.4	G101 G102 I103 F107 L108 E109 F314 I319 A487 T527	G101-I105 WeakPolarHBondContact O-CG1 3.47Å; G101-I105 PolarHBondContact O-N 2.96Å; G101-I105 VanDerWaalsContact O-N 3.13Å; G102-I105 PolarHBondContact O-N 3.35Å; I103-I105 PolarHBondContact O-N 2.79Å; I105-F107 PolarHBondContact O-N 2.88Å; I105-L108 CarbonylContact O-C 3.53Å; I105-L108 WeakPolarHBondContact O-CA 3.38Å; I105-L108 WeakPolarHBondContact O-CB 3.33Å; I105-L108 PolarHBondContact O-N 3.31Å; I105-E109 HydrophobicContact CG2-CG 4.33Å; I105-E109 PolarHBondContact O-N 3.47Å; I105-F314 HydrophobicContact CD1-CD1 4.37Å; I105-F314 HydrophobicContact CD1-CE1 3.49Å; I105-F314 VanDerWaalsContact CD1-CE1 3.49Å; I105-F314 HydrophobicContact CD1-CZ 4.01Å; I105-I319 HydrophobicContact CB-CD1 4.13Å; I105-I319 HydrophobicContact CB-CG1 4.4Å; I105-I319 HydrophobicContact CB-CG2 4.01Å; I105-I319 HydrophobicContact CD1-CG2 4.12Å; I105-I319 HydrophobicContact CG2-CB 4.46Å; I105-I319 HydrophobicContact CG2-CG1 4.32Å; I105-I319 HydrophobicContact CG2-CG2 3.38Å; I105-A487 HydrophobicContact CD1-CB 3.48Å; I105-A487 VanDerWaalsContact CD1-CB 3.48Å; I105-T527 HydrophobicContact CD1-CG2 3.38Å; I105-T527 HydrophobicContact CG1-CG2 3.48Å; I105-T527 VanDerWaalsContact CG1-CG2 3.48Å
106	F	96.5	Very high	96.7	Very high	1 Å²	1	11.9 Å²	11.9	0%	0.004	6%	0.063	C	C	.	.	H	α-helix	trans	-55	-43	175.4	-167.9	-79.3	0	0	0	111.1	G102 I103 I110 Y317 L324 A341 L344	G102-F106 VanDerWaalsContact O-CB 3.24Å; G102-F106 WeakPolarHBondContact O-CB 3.48Å; G102-F106 PolarHBondContact O-N 3.5Å; I103-F106 PolarHBondContact O-N 3.48Å; F106-I110 HydrophobicContact CD1-CD1 3.47Å; F106-I110 VanDerWaalsContact CD1-CD1 3.47Å; F106-I110 HydrophobicContact CD1-CG1 4.45Å; F106-I110 HydrophobicContact CE1-CD1 3.13Å; F106-I110 HydrophobicContact CE1-CG1 4.34Å; F106-I110 HydrophobicContact CZ-CD1 4.01Å; F106-I110 WeakPolarHBondContact O-CG1 3.49Å; F106-I110 PolarHBondContact O-N 2.93Å; F106-Y317 HydrophobicContact CB-CD2 4.14Å; F106-Y317 AromaticContact CD2-CD2 3.93Å; F106-Y317 HydrophobicContact CD2-CD2 3.93Å; F106-Y317 HydrophobicContact CD2-CG 4.27Å; F106-Y317 WeakPolarHBondContact CD2-O 3.44Å; F106-Y317 WeakPolarHBondContact CE2-O 3.36Å; F106-Y317 HydrophobicContact CG-CD2 4.3Å; F106-L324 HydrophobicContact CD2-CD1 3.44Å; F106-L324 VanDerWaalsContact CD2-CD1 3.44Å; F106-L324 HydrophobicContact CD2-CD2 4.38Å; F106-L324 HydrophobicContact CE2-CD1 3.6Å; F106-L324 HydrophobicContact CE2-CD2 3.67Å; F106-L324 HydrophobicContact CE2-CG 4.29Å; F106-L324 HydrophobicContact CG-CD1 4.03Å; F106-L324 HydrophobicContact CZ-CD1 4.29Å; F106-L324 HydrophobicContact CZ-CD2 3.77Å; F106-A341 HydrophobicContact CD1-CB 3.9Å; F106-A341 HydrophobicContact CE1-CB 4.45Å; F106-L344 HydrophobicContact CE1-CB 3.78Å; F106-L344 HydrophobicContact CE1-CD1 3.65Å; F106-L344 HydrophobicContact CE1-CG 4.36Å; F106-L344 HydrophobicContact CZ-CB 3.81Å; F106-L344 HydrophobicContact CZ-CD1 3.88Å; F106-L344 HydrophobicContact CZ-CG 4.42Å
107	F	98	Very high	96.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.5	-41.7	173.3	176.8	-132.8	0	0	0	112.7	I103 P104 I105 S111 Y338 A341 I507 P515 M519 W523	I103-F107 WeakPolarHBondContact O-CB 3.36Å; I103-F107 PolarHBondContact O-N 3.48Å; P104-F107 PolarHBondContact O-N 3.36Å; I105-F107 PolarHBondContact O-N 2.88Å; F107-S111 VanDerWaalsContact O-CB 3.22Å; F107-S111 WeakPolarHBondContact O-CB 3.13Å; F107-S111 PolarHBondContact O-N 3.33Å; F107-S111 PolarHBondContact O-OG 2.94Å; F107-Y338 AromaticContact CD1-CD2 3.87Å; F107-Y338 HydrophobicContact CD1-CD2 3.87Å; F107-Y338 HydrophobicContact CD1-CE2 4.39Å; F107-Y338 HydrophobicContact CD2-CD2 4.22Å; F107-Y338 AromaticContact CE1-CD2 3.56Å; F107-Y338 HydrophobicContact CE1-CD2 3.56Å; F107-Y338 HydrophobicContact CE1-CE2 4.23Å; F107-Y338 AromaticContact CE2-CD2 3.95Å; F107-Y338 HydrophobicContact CE2-CD2 3.95Å; F107-Y338 HydrophobicContact CE2-CG 4.3Å; F107-Y338 HydrophobicContact CG-CD2 4.19Å; F107-Y338 AromaticContact CZ-CD2 3.58Å; F107-Y338 HydrophobicContact CZ-CD2 3.58Å; F107-Y338 HydrophobicContact CZ-CG 4.11Å; F107-A341 HydrophobicContact CB-CB 3.77Å; F107-A341 HydrophobicContact CD2-CB 4.14Å; F107-A341 HydrophobicContact CG-CB 4.34Å; F107-I507 HydrophobicContact CE1-CD1 4.09Å; F107-I507 HydrophobicContact CZ-CD1 3.92Å; F107-I507 HydrophobicContact CZ-CG2 3.92Å; F107-P515 HydrophobicContact CE1-CB 4.14Å; F107-P515 HydrophobicContact CE1-CG 4.1Å; F107-P515 HydrophobicContact CZ-CB 4.32Å; F107-P515 HydrophobicContact CZ-CG 3.92Å; F107-M519 HydrophobicContact CD1-CB 4.42Å; F107-M519 HydrophobicContact CD1-CG 4.02Å; F107-M519 HydrophobicContact CD1-SD 4.29Å; F107-M519 HydrophobicContact CE1-CG 4.28Å; F107-W523 AromaticContact CD1-CH2 3.84Å; F107-W523 HydrophobicContact CD1-CH2 3.84Å; F107-W523 AromaticContact CD1-CZ2 3.51Å; F107-W523 HydrophobicContact CD1-CZ2 3.51Å; F107-W523 AromaticContact CE1-CH2 3.75Å; F107-W523 HydrophobicContact CE1-CH2 3.75Å; F107-W523 AromaticContact CE1-CZ2 3.94Å; F107-W523 HydrophobicContact CE1-CZ2 3.94Å; F107-W523 HydrophobicContact CG-CZ2 4.41Å
108	L	98	Very high	96.6	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-56.2	-51.1	175.9	-176.6	157.3	0	0	0	110.9	P104 I105 I110 S111 L112 E490 V494 F503 W523	P104-L108 WeakPolarHBondContact O-CB 2.94Å; P104-L108 PolarHBondContact O-N 3.08Å; I105-L108 CarbonylContact O-C 3.53Å; I105-L108 WeakPolarHBondContact O-CA 3.38Å; I105-L108 WeakPolarHBondContact O-CB 3.33Å; I105-L108 PolarHBondContact O-N 3.31Å; L108-I110 PolarHBondContact O-N 3.44Å; L108-S111 PolarHBondContact O-N 3Å; L108-S111 PolarHBondContact O-OG 2.9Å; L108-S111 VanDerWaalsContact O-OG 3.04Å; L108-L112 HydrophobicContact CD2-CD2 4.43Å; L108-L112 WeakPolarHBondContact O-CB 3.45Å; L108-L112 PolarHBondContact O-N 2.86Å; L108-E490 HydrophobicContact CD2-CB 4.38Å; L108-V494 HydrophobicContact CD1-CB 4.04Å; L108-V494 HydrophobicContact CD1-CG1 4.15Å; L108-V494 HydrophobicContact CD1-CG2 4.14Å; L108-V494 HydrophobicContact CD2-CG2 4.15Å; L108-V494 HydrophobicContact CG-CG1 4.49Å; L108-V494 HydrophobicContact CG-CG2 4.31Å; L108-F503 HydrophobicContact CG-CE1 4.45Å; L108-W523 HydrophobicContact CB-CZ2 4.05Å; L108-W523 HydrophobicContact CD1-CD2 4.26Å; L108-W523 HydrophobicContact CD1-CG 4.04Å
109	E	97.7	Very high	96.5	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-63.4	-45.4	-177.6	-76.6	-173.1	-133.7	0	0	112.8	I105 G113 I319 G320 L324 T325	I105-E109 HydrophobicContact CG2-CG 4.33Å; I105-E109 PolarHBondContact O-N 3.47Å; E109-G113 PolarHBondContact O-N 3.02Å; E109-I319 WeakPolarHBondContact OE1-CA 3.34Å; E109-G320 PolarHBondContact OE1-N 3.18Å; E109-L324 HydrophobicContact CB-CB 4.02Å; E109-L324 WeakPolarHBondContact OE2-CB 3.16Å; E109-T325 WeakPolarHBondContact O-CA 3.28Å
110	I	97.8	Very high	96.5	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-65.5	-47.9	179.4	-67	170.7	0	0	0	110.4	F61 F106 L108 L112 G113 Q114 L324 C337 L344	F61-I110 HydrophobicContact CZ-CD1 4.01Å; F61-I110 HydrophobicContact CZ-CG1 4.36Å; F61-I110 HydrophobicContact CZ-CG2 3.8Å; F106-I110 HydrophobicContact CD1-CD1 3.47Å; F106-I110 VanDerWaalsContact CD1-CD1 3.47Å; F106-I110 HydrophobicContact CD1-CG1 4.45Å; F106-I110 HydrophobicContact CE1-CD1 3.13Å; F106-I110 HydrophobicContact CE1-CG1 4.34Å; F106-I110 HydrophobicContact CZ-CD1 4.01Å; F106-I110 WeakPolarHBondContact O-CG1 3.49Å; F106-I110 PolarHBondContact O-N 2.93Å; L108-I110 PolarHBondContact O-N 3.44Å; I110-L112 VanDerWaalsContact C-N 3.34Å; I110-G113 PolarHBondContact O-N 2.99Å; I110-Q114 VanDerWaalsContact O-CB 3.24Å; I110-Q114 WeakPolarHBondContact O-CB 3.27Å; I110-Q114 PolarHBondContact O-N 3.44Å; I110-L324 HydrophobicContact CG1-CB 4.29Å; I110-C337 HydrophobicContact CG2-CB 3.57Å; I110-L344 HydrophobicContact CD1-CD1 4.39Å
111	S	98	Very high	96.5	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-65.2	-39.8	-178.6	59.8	0	0	0	0	111.4	F107 L108 Q114 F115 F503	F107-S111 VanDerWaalsContact O-CB 3.22Å; F107-S111 WeakPolarHBondContact O-CB 3.13Å; F107-S111 PolarHBondContact O-N 3.33Å; F107-S111 PolarHBondContact O-OG 2.94Å; L108-S111 PolarHBondContact O-N 3Å; L108-S111 PolarHBondContact O-OG 2.9Å; L108-S111 VanDerWaalsContact O-OG 3.04Å; S111-Q114 PolarHBondContact O-N 3.41Å; S111-F115 VanDerWaalsContact O-CB 3.22Å; S111-F115 WeakPolarHBondContact O-CB 3.14Å; S111-F115 PolarHBondContact O-N 2.88Å; S111-F503 WeakPolarHBondContact OG-CZ 3.37Å
112	L	97.8	Very high	96.6	Very high	1 Å²	1	6 Å²	6	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-63.9	-46.1	176.7	-176.1	67.2	0	0	0	111.2	L108 I110 F115 M116 V123 W124 I126 F503	L108-L112 HydrophobicContact CD2-CD2 4.43Å; L108-L112 WeakPolarHBondContact O-CB 3.45Å; L108-L112 PolarHBondContact O-N 2.86Å; I110-L112 VanDerWaalsContact C-N 3.34Å; L112-F115 PolarHBondContact O-N 3.48Å; L112-M116 HydrophobicContact CD1-CG 4.17Å; L112-M116 WeakPolarHBondContact O-CB 3.49Å; L112-M116 WeakPolarHBondContact O-CG 3.38Å; L112-M116 PolarHBondContact O-N 3.05Å; L112-V123 HydrophobicContact CB-CG2 4.4Å; L112-V123 HydrophobicContact CD1-CG2 4.26Å; L112-V123 HydrophobicContact CD2-CG1 4.35Å; L112-V123 HydrophobicContact CD2-CG2 3.83Å; L112-V123 HydrophobicContact CG-CG2 3.48Å; L112-V123 VanDerWaalsContact CG-CG2 3.48Å; L112-W124 HydrophobicContact CD2-CH2 3.91Å; L112-W124 HydrophobicContact CD2-CZ2 4.17Å; L112-W124 HydrophobicContact CD2-CZ3 4.19Å; L112-I126 HydrophobicContact CD1-CB 4.46Å; L112-I126 HydrophobicContact CD1-CD1 3.67Å; L112-I126 HydrophobicContact CD1-CG2 4.04Å; L112-F503 HydrophobicContact CB-CE2 4.45Å; L112-F503 HydrophobicContact CB-CZ 3.98Å; L112-F503 HydrophobicContact CD1-CE2 3.9Å; L112-F503 HydrophobicContact CD1-CZ 4.21Å
113	G	97.4	Very high	96.7	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-60.6	-46	173.9	0	0	0	0	0	112.4	E109 I110 F115 K117 T325 S329	E109-G113 PolarHBondContact O-N 3.02Å; I110-G113 PolarHBondContact O-N 2.99Å; G113-F115 PolarHBondContact O-N 3.2Å; G113-K117 WeakPolarHBondContact O-CA 3.47Å; G113-K117 PolarHBondContact O-N 3.22Å; G113-T325 WeakPolarHBondContact CA-O 3.34Å; G113-S329 VanDerWaalsContact O-CA 3.27Å; G113-S329 WeakPolarHBondContact O-CA 3.42Å
114	Q	96.9	Very high	96.7	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-63.9	-40	179.8	-177.1	174.4	-58.5	0	0	112.7	I110 S111 K117 G328 N331 F333 N335 M510	I110-Q114 VanDerWaalsContact O-CB 3.24Å; I110-Q114 WeakPolarHBondContact O-CB 3.27Å; I110-Q114 PolarHBondContact O-N 3.44Å; S111-Q114 PolarHBondContact O-N 3.41Å; Q114-K117 WeakPolarHBondContact O-CD 3.4Å; Q114-K117 VanDerWaalsContact O-CE 3.26Å; Q114-K117 WeakPolarHBondContact O-CE 3.07Å; Q114-K117 PolarHBondContact O-NZ 3.35Å; Q114-G328 WeakPolarHBondContact CA-O 3.48Å; Q114-G328 WeakPolarHBondContact CB-O 3.38Å; Q114-G328 PolarHBondContact N-O 3.18Å; Q114-N331 HydrophobicContact CB-CB 4.47Å; Q114-N331 HydrophobicContact CG-CB 3.95Å; Q114-N331 VanDerWaalsContact OE1-CB 3.28Å; Q114-N331 PolarHBondContact OE1-ND2 3.18Å; Q114-N331 VanDerWaalsContact OE1-ND2 3.15Å; Q114-F333 PolarHBondContact NE2-O 2.82Å; Q114-N335 PolarHBondContact NE2-O 3.49Å; Q114-M510 HydrophobicContact CB-SD 4.33Å; Q114-M510 HydrophobicContact CG-SD 4.02Å
115	F	96.3	Very high	96.7	Very high	7 Å²	7	6.6 Å²	6.6	3%	0.031	3%	0.034	C	C	.	.	H	α-helix	trans	-68.9	-53.2	178.8	-175.4	-117	0	0	0	111.2	S111 L112 G113 K117 I126 F333 D506 M510 W599 H602 H603	S111-F115 VanDerWaalsContact O-CB 3.22Å; S111-F115 WeakPolarHBondContact O-CB 3.14Å; S111-F115 PolarHBondContact O-N 2.88Å; L112-F115 PolarHBondContact O-N 3.48Å; G113-F115 PolarHBondContact O-N 3.2Å; F115-K117 VanDerWaalsContact C-N 3.29Å; F115-K117 PolarHBondContact O-N 3Å; F115-I126 HydrophobicContact CD1-CD1 4.4Å; F115-I126 HydrophobicContact CE1-CD1 4.46Å; F115-F333 HydrophobicContact CD2-CE2 4.05Å; F115-F333 HydrophobicContact CD2-CZ 4.21Å; F115-F333 HydrophobicContact CE2-CZ 4.4Å; F115-D506 HydrophobicContact CD2-CB 4.11Å; F115-D506 HydrophobicContact CE1-CB 4.1Å; F115-D506 HydrophobicContact CE2-CB 3.59Å; F115-D506 HydrophobicContact CZ-CB 3.58Å; F115-D506 WeakPolarHBondContact CZ-OD1 3.4Å; F115-M510 WeakPolarHBondContact CA-SD 3.25Å; F115-M510 HydrophobicContact CB-CE 3.73Å; F115-M510 HydrophobicContact CB-SD 3.55Å; F115-M510 VanDerWaalsContact CB-SD 3.55Å; F115-M510 HydrophobicContact CD2-CE 4.16Å; F115-M510 HydrophobicContact CD2-CG 3.99Å; F115-M510 HydrophobicContact CD2-SD 3.81Å; F115-M510 HydrophobicContact CG-CE 4.32Å; F115-M510 HydrophobicContact CG-SD 4.17Å; F115-W599 HydrophobicContact CE1-CH2 4.19Å; F115-W599 AromaticContact CE1-CZ3 3.74Å; F115-W599 HydrophobicContact CE1-CZ3 3.74Å; F115-W599 HydrophobicContact CZ-CZ3 4.15Å; F115-H602 PolarHBondContact O-NE2 2.91Å; F115-H602 VanDerWaalsContact O-NE2 3.1Å; F115-H603 PolarHBondContact O-NE2 2.94Å
116	M	95.2	Very high	96.6	Very high	9 Å²	9	6.6 Å²	6.6	4%	0.044	3%	0.034	C	C	.	.	H	α-helix	trans	-77.5	-14.8	-174.9	-63.2	-59	-60.6	0	0	113.4	L112 A118 V123 N125 I126 W599 H602	L112-M116 HydrophobicContact CD1-CG 4.17Å; L112-M116 WeakPolarHBondContact O-CB 3.49Å; L112-M116 WeakPolarHBondContact O-CG 3.38Å; L112-M116 PolarHBondContact O-N 3.05Å; M116-A118 HydrophobicContact CB-CB 4.37Å; M116-A118 PolarHBondContact O-N 2.92Å; M116-V123 HydrophobicContact CB-CG2 3.82Å; M116-V123 HydrophobicContact CG-CG2 3.96Å; M116-N125 HydrophobicContact CE-CB 3.84Å; M116-I126 HydrophobicContact CE-CB 4.22Å; M116-I126 HydrophobicContact CG-CB 4.45Å; M116-I126 HydrophobicContact SD-CB 3.92Å; M116-I126 HydrophobicContact SD-CD1 4.28Å; M116-I126 HydrophobicContact SD-CG1 4.22Å; M116-W599 HydrophobicContact SD-CZ3 4.21Å; M116-H602 PolarHBondContact O-CE1 3.23Å; M116-H602 VanDerWaalsContact O-CE1 3.25Å; M116-H602 PolarHBondContact O-NE2 2.69Å
117	K	94.8	Very high	96.7	Very high	38 Å²	38	6.6 Å²	6.6	17%	0.165	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	42.3	-174.5	-63	-65.4	-177.8	-139.2	0	112.2	R52 G113 Q114 F115 S329 N331	R52-K117 PolarHBondContact NE-O 2.91Å; R52-K117 PolarHBondContact NH2-O 3.32Å; G113-K117 WeakPolarHBondContact O-CA 3.47Å; G113-K117 PolarHBondContact O-N 3.22Å; Q114-K117 WeakPolarHBondContact O-CD 3.4Å; Q114-K117 VanDerWaalsContact O-CE 3.26Å; Q114-K117 WeakPolarHBondContact O-CE 3.07Å; Q114-K117 PolarHBondContact O-NZ 3.35Å; F115-K117 VanDerWaalsContact C-N 3.29Å; F115-K117 PolarHBondContact O-N 3Å; K117-S329 WeakPolarHBondContact CD-O 3.49Å; K117-N331 PolarHBondContact NZ-O 3.42Å
118	A	94.8	Very high	96.6	Very high	7 Å²	7	7.5 Å²	7.5	6%	0.058	4%	0.039	C	C	.	.			trans	-141.9	151	-175.7	0	0	0	0	0	111.6	M116 N122 V123 S329 D431	M116-A118 HydrophobicContact CB-CB 4.37Å; M116-A118 PolarHBondContact O-N 2.92Å; A118-N122 HydrophobicContact CB-CB 3.78Å; A118-V123 HydrophobicContact CB-CB 4.42Å; A118-S329 WeakPolarHBondContact O-CB 3.46Å; A118-D431 WeakPolarHBondContact CA-OD2 3.5Å
119	G	94.8	Very high	96.6	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.039	C	C	.	.			trans	-76.4	-173	169.3	0	0	0	0	0	112.6	I121 N122 V123 D431	G119-I121 VanDerWaalsContact C-N 3.28Å; G119-I121 PolarHBondContact O-N 3.35Å; G119-N122 PolarHBondContact O-N 2.7Å; G119-V123 VanDerWaalsContact O-CB 3.3Å; G119-V123 WeakPolarHBondContact O-CB 3.42Å; G119-V123 PolarHBondContact O-N 3.17Å; G119-D431 PolarHBondContact N-OD2 2.87Å
120	S	95.6	Very high	96.6	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.007	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.1	-158.4	-37.2	0	0	0	0	115.3	V123 W124 G134 G322	S120-V123 VanDerWaalsContact O-CG1 3.26Å; S120-V123 WeakPolarHBondContact O-CG1 3.41Å; S120-W124 PolarHBondContact O-NE1 2.7Å; S120-G134 WeakPolarHBondContact O-CA 3.42Å; S120-G322 WeakPolarHBondContact OG-CA 3.19Å; S120-G322 PolarHBondContact OG-O 3.13Å
121	I	96.8	Very high	96.6	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-54.8	179.1	-56.9	170.3	0	0	0	112.4	G119 V123 W124 Y135 M138 L432	G119-I121 VanDerWaalsContact C-N 3.28Å; G119-I121 PolarHBondContact O-N 3.35Å; I121-V123 PolarHBondContact O-N 2.68Å; I121-W124 PolarHBondContact O-N 2.83Å; I121-Y135 HydrophobicContact CD1-CD1 3.77Å; I121-Y135 HydrophobicContact CD1-CE1 3.72Å; I121-Y135 HydrophobicContact CG1-CD1 4.31Å; I121-Y135 HydrophobicContact CG1-CE1 4.46Å; I121-Y135 HydrophobicContact CG2-CE1 4.27Å; I121-Y135 HydrophobicContact CG2-CE2 4.23Å; I121-M138 HydrophobicContact CD1-CG 3.82Å; I121-M138 HydrophobicContact CG1-CG 3.76Å; I121-L432 HydrophobicContact CB-CD2 4.27Å; I121-L432 HydrophobicContact CD1-CD1 3.52Å; I121-L432 HydrophobicContact CD1-CD2 4.12Å; I121-L432 HydrophobicContact CD1-CG 3.91Å; I121-L432 HydrophobicContact CG2-CD2 3.89Å
122	N	95.8	Very high	96.6	Very high	36 Å²	36	9.6 Å²	9.6	19%	0.193	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-72.1	-17.3	-174.3	-81.4	-7.2	0	0	0	113.1	A118 G119 W124 N125 D431	A118-N122 HydrophobicContact CB-CB 3.78Å; G119-N122 PolarHBondContact O-N 2.7Å; N122-W124 PolarHBondContact O-N 2.92Å; N122-N125 WeakPolarHBondContact O-CB 3.29Å; N122-N125 PolarHBondContact O-N 2.65Å; N122-N125 PolarHBondContact O-ND2 3.48Å; N122-D431 HydrophobicContact CB-CB 4.39Å; N122-D431 PolarHBondContact ND2-O 3.46Å
123	V	97.1	Very high	96.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.048	C	C	.	.	G	3₁₀ helix	trans	-56.6	-35.1	171.7	79.1	0	0	0	0	111.9	L112 M116 A118 G119 S120 I121 N125 I126 T325	L112-V123 HydrophobicContact CB-CG2 4.4Å; L112-V123 HydrophobicContact CD1-CG2 4.26Å; L112-V123 HydrophobicContact CD2-CG1 4.35Å; L112-V123 HydrophobicContact CD2-CG2 3.83Å; L112-V123 HydrophobicContact CG-CG2 3.48Å; L112-V123 VanDerWaalsContact CG-CG2 3.48Å; M116-V123 HydrophobicContact CB-CG2 3.82Å; M116-V123 HydrophobicContact CG-CG2 3.96Å; A118-V123 HydrophobicContact CB-CB 4.42Å; G119-V123 VanDerWaalsContact O-CB 3.3Å; G119-V123 WeakPolarHBondContact O-CB 3.42Å; G119-V123 PolarHBondContact O-N 3.17Å; S120-V123 VanDerWaalsContact O-CG1 3.26Å; S120-V123 WeakPolarHBondContact O-CG1 3.41Å; I121-V123 PolarHBondContact O-N 2.68Å; V123-N125 PolarHBondContact O-N 3.47Å; V123-N125 VanDerWaalsContact O-N 3.09Å; V123-I126 PolarHBondContact O-N 3.05Å; V123-T325 HydrophobicContact CB-CG2 3.88Å; V123-T325 HydrophobicContact CG1-CG2 3.96Å; V123-T325 HydrophobicContact CG2-CG2 3.54Å
124	W	97.7	Very high	96.6	Very high	4 Å²	4	9.6 Å²	9.6	2%	0.015	5%	0.048	C	C	.	.	G	3₁₀ helix	trans	-76.4	7.7	178.1	-60.8	104.7	0	0	0	113.4	L112 S120 I121 N122 I126 C127 K131 L133 G134 E490 V493 V494	L112-W124 HydrophobicContact CD2-CH2 3.91Å; L112-W124 HydrophobicContact CD2-CZ2 4.17Å; L112-W124 HydrophobicContact CD2-CZ3 4.19Å; S120-W124 PolarHBondContact O-NE1 2.7Å; I121-W124 PolarHBondContact O-N 2.83Å; N122-W124 PolarHBondContact O-N 2.92Å; W124-I126 HydrophobicContact CE3-CG2 4.36Å; W124-I126 PolarHBondContact O-N 3.08Å; W124-C127 CarbonylContact O-C 3.6Å; W124-C127 PolarHBondContact O-N 2.67Å; W124-C127 VanDerWaalsContact O-O 3.12Å; W124-K131 HydrophobicContact CB-CB 4.44Å; W124-K131 HydrophobicContact CB-CG 3.9Å; W124-L133 HydrophobicContact CD2-CB 3.85Å; W124-L133 HydrophobicContact CD2-CD1 3.96Å; W124-L133 VanDerWaalsContact CE2-CB 3.42Å; W124-L133 HydrophobicContact CE3-CD1 3.76Å; W124-L133 HydrophobicContact CG-CB 4.21Å; W124-L133 HydrophobicContact CH2-CB 4.5Å; W124-L133 HydrophobicContact CH2-CD1 3.52Å; W124-L133 HydrophobicContact CZ2-CB 3.8Å; W124-L133 HydrophobicContact CZ2-CD1 3.69Å; W124-L133 HydrophobicContact CZ2-CG 4.27Å; W124-L133 HydrophobicContact CZ3-CD1 3.53Å; W124-G134 VanDerWaalsContact CD1-CA 3.48Å; W124-E490 HydrophobicContact CH2-CB 3.95Å; W124-E490 HydrophobicContact CH2-CG 3.68Å; W124-E490 HydrophobicContact CZ2-CB 4.46Å; W124-E490 HydrophobicContact CZ2-CG 3.69Å; W124-V493 HydrophobicContact CE3-CG1 4.07Å; W124-V493 HydrophobicContact CZ3-CB 4.13Å; W124-V493 HydrophobicContact CZ3-CG1 3.82Å; W124-V494 HydrophobicContact CZ3-CG2 4.3Å
125	N	96.5	Very high	96.7	Very high	30 Å²	30	14 Å²	14	16%	0.16	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-57.5	-19.3	159.8	-77.8	-30.1	0	0	0	111.9	M116 N122 V123 C127 K131 P597 I598	M116-N125 HydrophobicContact CE-CB 3.84Å; N122-N125 WeakPolarHBondContact O-CB 3.29Å; N122-N125 PolarHBondContact O-N 2.65Å; N122-N125 PolarHBondContact O-ND2 3.48Å; V123-N125 PolarHBondContact O-N 3.47Å; V123-N125 VanDerWaalsContact O-N 3.09Å; N125-C127 PolarHBondContact O-N 3.31Å; N125-K131 WeakPolarHBondContact OD1-CE 2.97Å; N125-K131 PolarHBondContact OD1-NZ 2.75Å; N125-P597 CarbonylContact O-C 3.58Å; N125-P597 VanDerWaalsContact O-CA 3.27Å; N125-P597 WeakPolarHBondContact O-CA 3.38Å; N125-I598 HydrophobicContact CB-CB 4.11Å; N125-I598 PolarHBondContact O-N 3.29Å
126	I	96.2	Very high	96.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-60.2	-28.8	169.8	-157.7	168	0	0	0	112.5	L112 F115 M116 V123 W124 Y498 F503 P597	L112-I126 HydrophobicContact CD1-CB 4.46Å; L112-I126 HydrophobicContact CD1-CD1 3.67Å; L112-I126 HydrophobicContact CD1-CG2 4.04Å; F115-I126 HydrophobicContact CD1-CD1 4.4Å; F115-I126 HydrophobicContact CE1-CD1 4.46Å; M116-I126 HydrophobicContact CE-CB 4.22Å; M116-I126 HydrophobicContact CG-CB 4.45Å; M116-I126 HydrophobicContact SD-CB 3.92Å; M116-I126 HydrophobicContact SD-CD1 4.28Å; M116-I126 HydrophobicContact SD-CG1 4.22Å; V123-I126 PolarHBondContact O-N 3.05Å; W124-I126 HydrophobicContact CE3-CG2 4.36Å; W124-I126 PolarHBondContact O-N 3.08Å; I126-Y498 HydrophobicContact CD1-CD1 3.89Å; I126-Y498 HydrophobicContact CD1-CD2 4.14Å; I126-Y498 HydrophobicContact CD1-CE1 3.73Å; I126-Y498 HydrophobicContact CD1-CE2 3.99Å; I126-Y498 HydrophobicContact CD1-CG 4.08Å; I126-Y498 HydrophobicContact CG1-CD1 4.24Å; I126-Y498 HydrophobicContact CG1-CD2 3.55Å; I126-Y498 HydrophobicContact CG1-CE1 4.18Å; I126-Y498 HydrophobicContact CG1-CE2 3.49Å; I126-Y498 VanDerWaalsContact CG1-CE2 3.49Å; I126-Y498 HydrophobicContact CG1-CG 3.93Å; I126-F503 HydrophobicContact CD1-CD2 4.16Å; I126-F503 HydrophobicContact CD1-CE2 4.26Å; I126-P597 WeakPolarHBondContact O-CA 3.48Å; I126-P597 WeakPolarHBondContact O-CB 3.4Å; I126-P597 VanDerWaalsContact O-CG 3.29Å; I126-P597 WeakPolarHBondContact O-CG 3.44Å
127	C	97	Very high	96.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	-151.2	83	175.3	-172.8	0	0	0	0	110	W124 N125 L129 F130 V493 V497	W124-C127 CarbonylContact O-C 3.6Å; W124-C127 PolarHBondContact O-N 2.67Å; W124-C127 VanDerWaalsContact O-O 3.12Å; N125-C127 PolarHBondContact O-N 3.31Å; C127-L129 PolarHBondContact O-N 2.99Å; C127-F130 PolarHBondContact O-N 3Å; C127-F130 VanDerWaalsContact SG-CD2 3.57Å; C127-V493 HydrophobicContact CB-CG1 3.71Å; C127-V497 WeakPolarHBondContact SG-CG1 3.29Å
128	P	96.8	Very high	97	Very high	19 Å²	19	12.2 Å²	12.2	12%	0.123	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-56.3	-31.4	-167	-28.2	35.3	0	0	0	115.5	F130 K131 L594 Q596 I598	P128-F130 PolarHBondContact O-N 2.72Å; P128-F130 VanDerWaalsContact O-N 3.1Å; P128-K131 WeakPolarHBondContact O-CG 3.37Å; P128-K131 PolarHBondContact O-N 2.87Å; P128-L594 WeakPolarHBondContact CD-O 3.3Å; P128-Q596 WeakPolarHBondContact CD-O 3.16Å; P128-Q596 VanDerWaalsContact CG-O 3.28Å; P128-Q596 WeakPolarHBondContact CG-O 3.2Å; P128-I598 HydrophobicContact CB-CD1 4.12Å; P128-I598 HydrophobicContact CG-CD1 3.54Å; P128-I598 HydrophobicContact CG-CG1 3.69Å
129	L	97.6	Very high	97.1	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-53.1	-29	174.6	-176.7	57.7	0	0	0	113.3	C127 H575 L576 C579 L580 W591 L594 T595	C127-L129 PolarHBondContact O-N 2.99Å; L129-H575 PolarHBondContact O-CD2 2.8Å; L129-L576 HydrophobicContact CD1-CG 4.04Å; L129-L576 HydrophobicContact CD2-CG 4.48Å; L129-L576 HydrophobicContact CG-CD1 4.37Å; L129-L576 HydrophobicContact CG-CG 4.11Å; L129-C579 HydrophobicContact CD1-CB 3.88Å; L129-L580 HydrophobicContact CD1-CD2 4.31Å; L129-L580 HydrophobicContact CD1-CG 4.1Å; L129-W591 HydrophobicContact CD2-CE3 3.81Å; L129-W591 HydrophobicContact CD2-CH2 4.39Å; L129-W591 HydrophobicContact CD2-CZ3 3.73Å; L129-L594 HydrophobicContact CB-CB 3.96Å; L129-L594 WeakPolarHBondContact CB-O 3.26Å; L129-L594 HydrophobicContact CD1-CB 4.13Å; L129-L594 HydrophobicContact CD1-CD1 3.99Å; L129-L594 HydrophobicContact CG-CB 4.45Å; L129-L594 PolarHBondContact N-O 3.22Å; L129-T595 HydrophobicContact CB-CG2 4.39Å; L129-T595 HydrophobicContact CD2-CG2 3.94Å
130	F	97.7	Very high	97.2	Very high	4 Å²	4	13.7 Å²	13.7	2%	0.018	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-108	19.8	-174.7	-68.6	-92.4	0	0	0	113.3	C127 P128 G132 L133 W489 V493 V497 V572 L576 W591	C127-F130 PolarHBondContact O-N 3Å; C127-F130 VanDerWaalsContact SG-CD2 3.57Å; P128-F130 PolarHBondContact O-N 2.72Å; P128-F130 VanDerWaalsContact O-N 3.1Å; F130-G132 PolarHBondContact O-N 3.01Å; F130-L133 HydrophobicContact CB-CD1 4.22Å; F130-L133 WeakPolarHBondContact O-CB 3.32Å; F130-L133 PolarHBondContact O-N 3.3Å; F130-W489 HydrophobicContact CD1-CE3 4.44Å; F130-W489 AromaticContact CE1-CE3 3.97Å; F130-W489 HydrophobicContact CE1-CE3 3.97Å; F130-W489 AromaticContact CE1-CZ3 3.81Å; F130-W489 HydrophobicContact CE1-CZ3 3.81Å; F130-V493 HydrophobicContact CB-CG1 4.1Å; F130-V493 HydrophobicContact CB-CG2 3.69Å; F130-V493 HydrophobicContact CD1-CG2 3.32Å; F130-V493 HydrophobicContact CD2-CG1 4.29Å; F130-V493 HydrophobicContact CD2-CG2 3.81Å; F130-V493 HydrophobicContact CE1-CG2 3.78Å; F130-V493 HydrophobicContact CE2-CG2 4.23Å; F130-V493 HydrophobicContact CG-CB 4.46Å; F130-V493 HydrophobicContact CG-CG1 4.25Å; F130-V493 HydrophobicContact CG-CG2 3.33Å; F130-V493 HydrophobicContact CZ-CG2 4.2Å; F130-V497 HydrophobicContact CE2-CG1 4.11Å; F130-V497 HydrophobicContact CE2-CG2 3.96Å; F130-V497 HydrophobicContact CZ-CG2 4.2Å; F130-V572 HydrophobicContact CD1-CG1 4.39Å; F130-L576 HydrophobicContact CD1-CD1 4.08Å; F130-L576 HydrophobicContact CE1-CD1 3.43Å; F130-L576 VanDerWaalsContact CE1-CD1 3.43Å; F130-L576 HydrophobicContact CE2-CD1 4.36Å; F130-L576 HydrophobicContact CZ-CD1 3.6Å; F130-W591 HydrophobicContact CE2-CH2 4.39Å; F130-W591 HydrophobicContact CZ-CH2 4.33Å
131	K	97.5	Very high	97.2	Very high	42 Å²	42	13.7 Å²	13.7	18%	0.183	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.1	171.5	-80.5	-177.8	176.7	-168.6	0	114.3	W124 N125 P128 L133 G134 Y135	W124-K131 HydrophobicContact CB-CB 4.44Å; W124-K131 HydrophobicContact CB-CG 3.9Å; N125-K131 WeakPolarHBondContact OD1-CE 2.97Å; N125-K131 PolarHBondContact OD1-NZ 2.75Å; P128-K131 WeakPolarHBondContact O-CG 3.37Å; P128-K131 PolarHBondContact O-N 2.87Å; K131-L133 PolarHBondContact O-N 3.01Å; K131-G134 PolarHBondContact O-N 3.12Å; K131-Y135 HydrophobicContact CB-CE2 4.43Å; K131-Y135 VanDerWaalsContact O-CD2 3.26Å; K131-Y135 WeakPolarHBondContact O-CD2 3.21Å; K131-Y135 PolarHBondContact O-N 3.19Å
132	G	98	Very high	97.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-50.8	-32.3	167.8	0	0	0	0	0	113.9	F130 G134 Y135 A136 C571 H575	F130-G132 PolarHBondContact O-N 3.01Å; G132-G134 PolarHBondContact O-N 3.25Å; G132-Y135 PolarHBondContact O-N 3.33Å; G132-A136 WeakPolarHBondContact O-CB 3.26Å; G132-A136 PolarHBondContact O-N 3.23Å; G132-C571 WeakPolarHBondContact CA-O 3.3Å; G132-C571 WeakPolarHBondContact O-CB 3.29Å; G132-H575 PolarHBondContact N-CD2 3.21Å
133	L	98	Very high	97.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-58.4	-47	172.8	-81	168.4	0	0	0	111.4	W124 F130 K131 Y135 A136 S137 Q486 W489 E490 V493 V572	W124-L133 HydrophobicContact CD2-CB 3.85Å; W124-L133 HydrophobicContact CD2-CD1 3.96Å; W124-L133 VanDerWaalsContact CE2-CB 3.42Å; W124-L133 HydrophobicContact CE3-CD1 3.76Å; W124-L133 HydrophobicContact CG-CB 4.21Å; W124-L133 HydrophobicContact CH2-CB 4.5Å; W124-L133 HydrophobicContact CH2-CD1 3.52Å; W124-L133 HydrophobicContact CZ2-CB 3.8Å; W124-L133 HydrophobicContact CZ2-CD1 3.69Å; W124-L133 HydrophobicContact CZ2-CG 4.27Å; W124-L133 HydrophobicContact CZ3-CD1 3.53Å; F130-L133 HydrophobicContact CB-CD1 4.22Å; F130-L133 WeakPolarHBondContact O-CB 3.32Å; F130-L133 PolarHBondContact O-N 3.3Å; K131-L133 PolarHBondContact O-N 3.01Å; L133-Y135 VanDerWaalsContact C-N 3.35Å; L133-Y135 PolarHBondContact O-N 3.27Å; L133-A136 WeakPolarHBondContact O-CB 3.43Å; L133-A136 PolarHBondContact O-N 3.25Å; L133-A136 VanDerWaalsContact O-N 3.15Å; L133-S137 PolarHBondContact O-N 3.45Å; L133-Q486 HydrophobicContact CD2-CG 4.48Å; L133-Q486 VanDerWaalsContact CD2-OE1 3.26Å; L133-Q486 PolarHBondContact O-NE2 2.98Å; L133-W489 HydrophobicContact CD1-CB 4.35Å; L133-W489 HydrophobicContact CD2-CB 3.5Å; L133-W489 HydrophobicContact CG-CB 4.29Å; L133-E490 HydrophobicContact CD2-CG 4.11Å; L133-V493 HydrophobicContact CD1-CB 4.24Å; L133-V493 HydrophobicContact CD1-CG2 3.82Å; L133-V572 HydrophobicContact CD2-CG2 3.87Å; L133-V572 HydrophobicContact CG-CG2 4.07Å
134	G	98	Very high	97.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.2	-38.5	179.5	0	0	0	0	0	113.5	S120 W124 K131 G132 M138	S120-G134 WeakPolarHBondContact O-CA 3.42Å; W124-G134 VanDerWaalsContact CD1-CA 3.48Å; K131-G134 PolarHBondContact O-N 3.12Å; G132-G134 PolarHBondContact O-N 3.25Å; G134-M138 VanDerWaalsContact O-CG 3.23Å; G134-M138 WeakPolarHBondContact O-CG 3.5Å; G134-M138 PolarHBondContact O-N 3Å; G134-M138 VanDerWaalsContact O-N 3.08Å
135	Y	98	Very high	97.1	Very high	92 Å²	92	16.2 Å²	16.2	36%	0.361	8%	0.077	S	C	.	.	H	α-helix	trans	-64.7	-39.8	172.3	-66.9	-69	0	0	0	111.7	I121 K131 G132 L133 M138 V139 H575	I121-Y135 HydrophobicContact CD1-CD1 3.77Å; I121-Y135 HydrophobicContact CD1-CE1 3.72Å; I121-Y135 HydrophobicContact CG1-CD1 4.31Å; I121-Y135 HydrophobicContact CG1-CE1 4.46Å; I121-Y135 HydrophobicContact CG2-CE1 4.27Å; I121-Y135 HydrophobicContact CG2-CE2 4.23Å; K131-Y135 HydrophobicContact CB-CE2 4.43Å; K131-Y135 VanDerWaalsContact O-CD2 3.26Å; K131-Y135 WeakPolarHBondContact O-CD2 3.21Å; K131-Y135 PolarHBondContact O-N 3.19Å; G132-Y135 PolarHBondContact O-N 3.33Å; L133-Y135 VanDerWaalsContact C-N 3.35Å; L133-Y135 PolarHBondContact O-N 3.27Å; Y135-M138 WeakPolarHBondContact O-CB 3.39Å; Y135-M138 PolarHBondContact O-N 3.47Å; Y135-V139 WeakPolarHBondContact O-CG2 3.38Å; Y135-V139 PolarHBondContact O-N 3.1Å; Y135-H575 AromaticContact CE2-ND1 3.99Å
136	A	98	Very high	97	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.008	7%	0.07	C	C	.	.	H	α-helix	trans	-59.1	-51	175.3	0	0	0	0	0	111.2	G132 L133 M138 V139 I140 S568 C571 V572	G132-A136 WeakPolarHBondContact O-CB 3.26Å; G132-A136 PolarHBondContact O-N 3.23Å; L133-A136 WeakPolarHBondContact O-CB 3.43Å; L133-A136 PolarHBondContact O-N 3.25Å; L133-A136 VanDerWaalsContact O-N 3.15Å; A136-M138 VanDerWaalsContact C-N 3.27Å; A136-M138 PolarHBondContact O-N 3.26Å; A136-V139 PolarHBondContact O-N 3.45Å; A136-V139 VanDerWaalsContact O-N 3.14Å; A136-I140 VanDerWaalsContact O-CG1 3.25Å; A136-I140 WeakPolarHBondContact O-CG1 3.46Å; A136-I140 PolarHBondContact O-N 3.43Å; A136-S568 VanDerWaalsContact CB-O 3.32Å; A136-S568 WeakPolarHBondContact CB-O 3.35Å; A136-C571 HydrophobicContact CB-CB 3.96Å; A136-V572 HydrophobicContact CB-CG2 4.41Å
137	S	97	Very high	97	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.007	7%	0.07	C	C	.	.	H	α-helix	trans	-56.7	-40.9	176	-68.6	0	0	0	0	112.2	L133 V139 I140 V141 G320 Q486	L133-S137 PolarHBondContact O-N 3.45Å; S137-V139 PolarHBondContact O-N 3.37Å; S137-I140 PolarHBondContact O-N 3.01Å; S137-V141 WeakPolarHBondContact O-CB 3.46Å; S137-V141 VanDerWaalsContact O-CG1 3.3Å; S137-V141 WeakPolarHBondContact O-CG1 3.38Å; S137-V141 PolarHBondContact O-N 3.04Å; S137-G320 PolarHBondContact OG-O 3.28Å; S137-Q486 PolarHBondContact OG-NE2 3.44Å
138	M	97.4	Very high	96.8	Very high	15 Å²	15	16.2 Å²	16.2	7%	0.074	8%	0.075	C	C	.	.	H	α-helix	trans	-63.9	-39.1	177.8	-73.9	-67	-68.8	0	0	113.2	I121 G134 Y135 A136 V141 F142 F425 L429	I121-M138 HydrophobicContact CD1-CG 3.82Å; I121-M138 HydrophobicContact CG1-CG 3.76Å; G134-M138 VanDerWaalsContact O-CG 3.23Å; G134-M138 WeakPolarHBondContact O-CG 3.5Å; G134-M138 PolarHBondContact O-N 3Å; G134-M138 VanDerWaalsContact O-N 3.08Å; Y135-M138 WeakPolarHBondContact O-CB 3.39Å; Y135-M138 PolarHBondContact O-N 3.47Å; A136-M138 VanDerWaalsContact C-N 3.27Å; A136-M138 PolarHBondContact O-N 3.26Å; M138-V141 WeakPolarHBondContact O-CG1 3.25Å; M138-F142 VanDerWaalsContact O-CB 3.24Å; M138-F142 WeakPolarHBondContact O-CB 3.36Å; M138-F142 PolarHBondContact O-N 3.34Å; M138-F142 VanDerWaalsContact O-N 3.14Å; M138-F425 HydrophobicContact CE-CD2 3.33Å; M138-F425 HydrophobicContact CE-CE2 3.44Å; M138-F425 VanDerWaalsContact CE-CE2 3.44Å; M138-F425 HydrophobicContact CE-CG 3.93Å; M138-F425 HydrophobicContact CE-CZ 4.13Å; M138-F425 VanDerWaalsContact CE-O 3.23Å; M138-F425 WeakPolarHBondContact CE-O 3.47Å; M138-F425 HydrophobicContact SD-CD2 3.97Å; M138-L429 HydrophobicContact CE-CB 4.31Å
139	V	97.5	Very high	96.9	Very high	38 Å²	38	15.3 Å²	15.3	23%	0.23	7%	0.07	C	C	.	.	H	α-helix	trans	-67.3	-46.5	174.5	172.9	0	0	0	0	110.4	Y135 A136 S137 F142 Y143	Y135-V139 WeakPolarHBondContact O-CG2 3.38Å; Y135-V139 PolarHBondContact O-N 3.1Å; A136-V139 PolarHBondContact O-N 3.45Å; A136-V139 VanDerWaalsContact O-N 3.14Å; S137-V139 PolarHBondContact O-N 3.37Å; V139-F142 PolarHBondContact O-N 2.9Å; V139-Y143 HydrophobicContact CG1-CD2 3.88Å; V139-Y143 HydrophobicContact CG1-CE2 3.36Å; V139-Y143 WeakPolarHBondContact O-CD2 3.45Å; V139-Y143 PolarHBondContact O-N 2.94Å; V139-Y143 VanDerWaalsContact O-N 3.09Å
140	I	96	Very high	96.8	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-62.8	-49.1	-178.6	-61.7	165.4	0	0	0	110.8	A136 S137 F142 Y143 C144 L321 A478 L483 S568	A136-I140 VanDerWaalsContact O-CG1 3.25Å; A136-I140 WeakPolarHBondContact O-CG1 3.46Å; A136-I140 PolarHBondContact O-N 3.43Å; S137-I140 PolarHBondContact O-N 3.01Å; I140-F142 VanDerWaalsContact C-N 3.3Å; I140-F142 PolarHBondContact O-N 2.92Å; I140-Y143 PolarHBondContact O-N 3.32Å; I140-C144 WeakPolarHBondContact O-CB 3.26Å; I140-C144 PolarHBondContact O-N 2.67Å; I140-L321 HydrophobicContact CB-CD2 4.42Å; I140-L321 HydrophobicContact CG2-CD2 3.47Å; I140-L321 VanDerWaalsContact CG2-CD2 3.47Å; I140-A478 HydrophobicContact CG2-CB 3.74Å; I140-L483 HydrophobicContact CG2-CD2 3.86Å; I140-S568 VanDerWaalsContact CG1-CB 3.48Å
141	V	96.2	Very high	96.7	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-66.5	-33.5	-179	75.5	0	0	0	0	111.7	S137 M138 C144 N145 G421 F425	S137-V141 WeakPolarHBondContact O-CB 3.46Å; S137-V141 VanDerWaalsContact O-CG1 3.3Å; S137-V141 WeakPolarHBondContact O-CG1 3.38Å; S137-V141 PolarHBondContact O-N 3.04Å; M138-V141 WeakPolarHBondContact O-CG1 3.25Å; V141-C144 PolarHBondContact O-N 3.3Å; V141-N145 WeakPolarHBondContact O-CB 3.47Å; V141-N145 PolarHBondContact O-N 3.38Å; V141-N145 PolarHBondContact O-ND2 3.38Å; V141-G421 WeakPolarHBondContact CG2-O 2.9Å; V141-F425 HydrophobicContact CG1-CB 3.95Å; V141-F425 HydrophobicContact CG1-CD2 3.86Å; V141-F425 HydrophobicContact CG1-CG 4.4Å
142	F	97.4	Very high	96.6	Very high	34 Å²	34	13.9 Å²	13.9	15%	0.149	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-48.2	174.1	177.2	-101.4	0	0	0	111.7	M138 V139 I140 N145 T146 F425 L453 C454 I457	M138-F142 VanDerWaalsContact O-CB 3.24Å; M138-F142 WeakPolarHBondContact O-CB 3.36Å; M138-F142 PolarHBondContact O-N 3.34Å; M138-F142 VanDerWaalsContact O-N 3.14Å; V139-F142 PolarHBondContact O-N 2.9Å; I140-F142 VanDerWaalsContact C-N 3.3Å; I140-F142 PolarHBondContact O-N 2.92Å; F142-N145 PolarHBondContact O-N 3.06Å; F142-T146 PolarHBondContact O-N 2.96Å; F142-T146 VanDerWaalsContact O-N 3.12Å; F142-T146 PolarHBondContact O-OG1 2.76Å; F142-F425 HydrophobicContact CB-CD2 4.08Å; F142-F425 HydrophobicContact CB-CE2 3.79Å; F142-F425 HydrophobicContact CD2-CE1 4.41Å; F142-F425 HydrophobicContact CD2-CE2 4.02Å; F142-F425 AromaticContact CD2-CZ 3.9Å; F142-F425 HydrophobicContact CD2-CZ 3.9Å; F142-F425 HydrophobicContact CG-CE2 4.27Å; F142-L453 HydrophobicContact CE2-CD2 4.03Å; F142-L453 HydrophobicContact CE2-CG 4.47Å; F142-L453 HydrophobicContact CZ-CD2 3.92Å; F142-L453 HydrophobicContact CZ-CG 4.2Å; F142-C454 VanDerWaalsContact CE2-SG 3.59Å; F142-I457 HydrophobicContact CE1-CD1 3.93Å; F142-I457 HydrophobicContact CZ-CD1 3.67Å
143	Y	96.5	Very high	96.6	Very high	39 Å²	39	13.9 Å²	13.9	15%	0.153	7%	0.065	C	C	.	.	H	α-helix	trans	-62.1	-46	175	-65.6	-35.6	0	0	0	111.9	V139 I140 N145 T146 Y147 F473 S477 F564 S567	V139-Y143 HydrophobicContact CG1-CD2 3.88Å; V139-Y143 HydrophobicContact CG1-CE2 3.36Å; V139-Y143 WeakPolarHBondContact O-CD2 3.45Å; V139-Y143 PolarHBondContact O-N 2.94Å; V139-Y143 VanDerWaalsContact O-N 3.09Å; I140-Y143 PolarHBondContact O-N 3.32Å; Y143-N145 PolarHBondContact O-N 3.19Å; Y143-T146 WeakPolarHBondContact O-CB 3.5Å; Y143-T146 PolarHBondContact O-N 2.96Å; Y143-T146 VanDerWaalsContact O-N 3.14Å; Y143-Y147 WeakPolarHBondContact O-CD1 3.39Å; Y143-Y147 PolarHBondContact O-N 3.25Å; Y143-F473 HydrophobicContact CD1-CD1 4.28Å; Y143-F473 AromaticContact CD1-CE1 3.73Å; Y143-F473 HydrophobicContact CD1-CE1 3.73Å; Y143-F473 HydrophobicContact CE1-CE1 4.32Å; Y143-F473 HydrophobicContact CG-CD1 4.45Å; Y143-F473 HydrophobicContact CG-CE1 4.35Å; Y143-S477 WeakPolarHBondContact CB-OG 3.33Å; Y143-F564 HydrophobicContact CE1-CD1 4.46Å; Y143-F564 HydrophobicContact CE2-CB 4.47Å; Y143-S567 VanDerWaalsContact CE2-OG 3.26Å; Y143-S567 WeakPolarHBondContact CE2-OG 3.3Å; Y143-S567 PolarHBondContact OH-OG 3.18Å
144	C	94.9	Very high	96.6	Very high	19 Å²	19	14.1 Å²	14.1	13%	0.128	7%	0.066	C	C	.	.	H	α-helix	trans	-55.5	-50.3	177.3	-169.6	0	0	0	0	111.7	I140 V141 T146 Y147 Y148 A478	I140-C144 WeakPolarHBondContact O-CB 3.26Å; I140-C144 PolarHBondContact O-N 2.67Å; V141-C144 PolarHBondContact O-N 3.3Å; C144-T146 VanDerWaalsContact C-N 3.26Å; C144-T146 PolarHBondContact O-N 3.43Å; C144-Y147 HydrophobicContact CB-CE1 4.49Å; C144-Y148 WeakPolarHBondContact O-CB 3.26Å; C144-Y148 PolarHBondContact O-N 3.02Å; C144-A478 HydrophobicContact CB-CB 3.79Å
145	N	96.5	Very high	96.6	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.021	7%	0.066	C	C	.	.	H	α-helix	trans	-58	-39.7	178.2	-70.6	-21.7	0	0	0	112.2	V141 F142 Y143 Q418 G421 V422	V141-N145 WeakPolarHBondContact O-CB 3.47Å; V141-N145 PolarHBondContact O-N 3.38Å; V141-N145 PolarHBondContact O-ND2 3.38Å; F142-N145 PolarHBondContact O-N 3.06Å; Y143-N145 PolarHBondContact O-N 3.19Å; N145-Q418 PolarHBondContact O-NE2 3.22Å; N145-Q418 PolarHBondContact O-OE1 3.32Å; N145-G421 PolarHBondContact ND2-O 3.49Å; N145-G421 VanDerWaalsContact ND2-O 3.09Å; N145-G421 VanDerWaalsContact OD1-CA 3.25Å; N145-G421 WeakPolarHBondContact OD1-CA 3.39Å; N145-V422 HydrophobicContact CB-CG2 4.35Å; N145-V422 PolarHBondContact ND2-N 3.27Å; N145-V422 PolarHBondContact OD1-N 3.15Å
146	T	95.3	Very high	96.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.4	-66.7	179.3	-53.8	0	0	0	0	110.1	F142 Y143 C144 Y148 I149 I457 D458 M461	F142-T146 PolarHBondContact O-N 2.96Å; F142-T146 VanDerWaalsContact O-N 3.12Å; F142-T146 PolarHBondContact O-OG1 2.76Å; Y143-T146 WeakPolarHBondContact O-CB 3.5Å; Y143-T146 PolarHBondContact O-N 2.96Å; Y143-T146 VanDerWaalsContact O-N 3.14Å; C144-T146 VanDerWaalsContact C-N 3.26Å; C144-T146 PolarHBondContact O-N 3.43Å; T146-Y148 PolarHBondContact O-N 3.08Å; T146-I149 VanDerWaalsContact O-CG2 3.31Å; T146-I149 WeakPolarHBondContact O-CG2 3.49Å; T146-I457 HydrophobicContact CG2-CB 3.81Å; T146-I457 HydrophobicContact CG2-CG2 3.54Å; T146-D458 VanDerWaalsContact C-OD1 3.3Å; T146-D458 WeakPolarHBondContact CG2-OD1 3.49Å; T146-M461 HydrophobicContact CG2-CE 4.24Å
147	Y	94.8	Very high	96.6	Very high	3 Å²	3	12.2 Å²	12.2	1%	0.012	6%	0.059	C	C	.	.	H	α-helix	trans	-74.1	-33.4	-172.1	85.9	-94.5	0	0	0	113.7	Y143 C144 I149 M150 F470 F473 D474 A478	Y143-Y147 WeakPolarHBondContact O-CD1 3.39Å; Y143-Y147 PolarHBondContact O-N 3.25Å; C144-Y147 HydrophobicContact CB-CE1 4.49Å; Y147-I149 PolarHBondContact O-N 3.26Å; Y147-I149 VanDerWaalsContact O-N 3.15Å; Y147-M150 VanDerWaalsContact O-CB 3.3Å; Y147-M150 WeakPolarHBondContact O-CB 3.39Å; Y147-M150 PolarHBondContact O-N 3.14Å; Y147-M150 VanDerWaalsContact O-N 3.12Å; Y147-F470 HydrophobicContact CD2-CD2 4.16Å; Y147-F470 AromaticContact CD2-CE2 3.67Å; Y147-F470 HydrophobicContact CD2-CE2 3.67Å; Y147-F470 HydrophobicContact CD2-CZ 4.04Å; Y147-F470 HydrophobicContact CE2-CE2 4.47Å; Y147-F470 HydrophobicContact CE2-CZ 4.44Å; Y147-F470 VanDerWaalsContact O-CE2 3.3Å; Y147-F470 WeakPolarHBondContact O-CE2 3.18Å; Y147-F473 HydrophobicContact CD1-CB 3.83Å; Y147-F473 HydrophobicContact CG-CB 3.78Å; Y147-D474 HydrophobicContact CD2-CB 3.96Å; Y147-D474 HydrophobicContact CE2-CB 3.57Å; Y147-D474 WeakPolarHBondContact CE2-OD1 3.28Å; Y147-D474 VanDerWaalsContact CZ-OD1 3.29Å; Y147-D474 PolarHBondContact OH-OD1 3.03Å; Y147-A478 HydrophobicContact CE1-CB 4.1Å
148	Y	94.6	Very high	96.7	Very high	27 Å²	27	12.1 Å²	12.1	11%	0.106	6%	0.059	C	C	.	.	H	α-helix	trans	-62.7	-27.3	-175.6	-178.4	-108.2	0	0	0	111.7	L72 C144 T146 M150 V151 L152 G414 S417 Q418	L72-Y148 HydrophobicContact CD1-CE2 3.94Å; L72-Y148 HydrophobicContact CG-CE2 4.43Å; C144-Y148 WeakPolarHBondContact O-CB 3.26Å; C144-Y148 PolarHBondContact O-N 3.02Å; T146-Y148 PolarHBondContact O-N 3.08Å; Y148-M150 PolarHBondContact O-N 2.95Å; Y148-V151 PolarHBondContact O-N 2.88Å; Y148-L152 HydrophobicContact CD1-CD1 4.23Å; Y148-L152 HydrophobicContact CE1-CD1 4Å; Y148-G414 WeakPolarHBondContact CE1-O 3.48Å; Y148-S417 PolarHBondContact OH-OG 3.25Å; Y148-Q418 HydrophobicContact CD1-CG 3.74Å; Y148-Q418 VanDerWaalsContact CD1-NE2 3.27Å; Y148-Q418 HydrophobicContact CE1-CG 4.1Å
149	I	97.3	Very high	96.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-69.2	-22.1	-178.1	-149.7	172.8	0	0	0	112.2	T146 Y147 V151 L152 A153 L239 C242 W243 V246 Q418 D458	T146-I149 VanDerWaalsContact O-CG2 3.31Å; T146-I149 WeakPolarHBondContact O-CG2 3.49Å; Y147-I149 PolarHBondContact O-N 3.26Å; Y147-I149 VanDerWaalsContact O-N 3.15Å; I149-V151 PolarHBondContact O-N 3.44Å; I149-L152 HydrophobicContact CG1-CB 4.47Å; I149-L152 HydrophobicContact CG1-CD2 4.19Å; I149-L152 WeakPolarHBondContact O-CA 3.33Å; I149-L152 WeakPolarHBondContact O-CB 3.3Å; I149-L152 PolarHBondContact O-N 2.92Å; I149-A153 PolarHBondContact O-N 3.16Å; I149-L239 HydrophobicContact CG2-CD1 3.58Å; I149-C242 HydrophobicContact CD1-CB 4.02Å; I149-C242 HydrophobicContact CG1-CB 4.07Å; I149-W243 HydrophobicContact CB-CZ2 4.25Å; I149-W243 HydrophobicContact CD1-CD2 3.41Å; I149-W243 VanDerWaalsContact CD1-CD2 3.41Å; I149-W243 HydrophobicContact CD1-CE3 3.81Å; I149-W243 HydrophobicContact CD1-CG 3.75Å; I149-W243 HydrophobicContact CD1-CH2 4.08Å; I149-W243 HydrophobicContact CD1-CZ2 3.69Å; I149-W243 HydrophobicContact CD1-CZ3 4.14Å; I149-W243 HydrophobicContact CG2-CZ2 3.88Å; I149-V246 HydrophobicContact CD1-CG2 4.19Å; I149-Q418 VanDerWaalsContact CA-NE2 3.33Å; I149-Q418 HydrophobicContact CG1-CG 4.31Å; I149-D458 WeakPolarHBondContact CG2-OD2 3.47Å
150	M	96.6	Very high	96.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.1	-35.3	174.5	-70.2	-60.1	-54.5	0	0	112	Y147 Y148 L152 A153 W154 L239 D458 M461 V462 F470	Y147-M150 VanDerWaalsContact O-CB 3.3Å; Y147-M150 WeakPolarHBondContact O-CB 3.39Å; Y147-M150 PolarHBondContact O-N 3.14Å; Y147-M150 VanDerWaalsContact O-N 3.12Å; Y148-M150 PolarHBondContact O-N 2.95Å; M150-L152 VanDerWaalsContact C-N 3.28Å; M150-L152 PolarHBondContact O-N 2.91Å; M150-A153 WeakPolarHBondContact O-CB 3.46Å; M150-A153 PolarHBondContact O-N 3.22Å; M150-A153 VanDerWaalsContact O-N 3.14Å; M150-W154 HydrophobicContact CB-CH2 4.2Å; M150-W154 HydrophobicContact CB-CZ2 4.25Å; M150-W154 HydrophobicContact CB-CZ3 4.43Å; M150-W154 HydrophobicContact CE-CZ2 3.92Å; M150-W154 VanDerWaalsContact O-CD2 3.27Å; M150-W154 PolarHBondContact O-N 3.36Å; M150-L239 HydrophobicContact SD-CD1 4.16Å; M150-L239 HydrophobicContact SD-CD2 4.44Å; M150-D458 HydrophobicContact SD-CB 4.31Å; M150-M461 HydrophobicContact CE-CB 3.95Å; M150-M461 WeakPolarHBondContact CE-O 3.26Å; M150-M461 HydrophobicContact CG-CB 3.8Å; M150-M461 HydrophobicContact CG-CG 4.46Å; M150-M461 HydrophobicContact CG-SD 3.81Å; M150-M461 HydrophobicContact SD-CB 3.8Å; M150-V462 HydrophobicContact CE-CG1 3.53Å; M150-V462 HydrophobicContact SD-CG1 3.86Å; M150-F470 HydrophobicContact CB-CD2 3.77Å; M150-F470 HydrophobicContact CB-CE2 3.91Å; M150-F470 HydrophobicContact CG-CD2 4.17Å
151	V	94.7	Very high	96.8	Very high	17 Å²	17	16.7 Å²	16.7	10%	0.103	8%	0.082	C	C	.	.	H	α-helix	trans	-65.4	-35.6	176.2	-172.2	0	0	0	0	111.3	L72 Y148 I149 W154 G155 F386 L410 F470	L72-V151 HydrophobicContact CD1-CB 4.04Å; L72-V151 HydrophobicContact CD1-CG1 3.3Å; Y148-V151 PolarHBondContact O-N 2.88Å; I149-V151 PolarHBondContact O-N 3.44Å; V151-W154 HydrophobicContact CG2-CE3 4.4Å; V151-W154 HydrophobicContact CG2-CZ3 4.23Å; V151-G155 PolarHBondContact O-N 3.29Å; V151-F386 HydrophobicContact CG1-CE2 3.94Å; V151-F386 HydrophobicContact CG1-CZ 3.97Å; V151-L410 HydrophobicContact CG1-CD2 4.37Å; V151-F470 HydrophobicContact CG2-CE2 3.98Å; V151-F470 HydrophobicContact CG2-CZ 3.86Å
152	L	96.9	Very high	96.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-69.2	-40.5	172.2	-72.8	62.7	0	0	0	111	Y148 I149 M150 G155 F156 L411 G414 L415 Q418	Y148-L152 HydrophobicContact CD1-CD1 4.23Å; Y148-L152 HydrophobicContact CE1-CD1 4Å; I149-L152 HydrophobicContact CG1-CB 4.47Å; I149-L152 HydrophobicContact CG1-CD2 4.19Å; I149-L152 WeakPolarHBondContact O-CA 3.33Å; I149-L152 WeakPolarHBondContact O-CB 3.3Å; I149-L152 PolarHBondContact O-N 2.92Å; M150-L152 VanDerWaalsContact C-N 3.28Å; M150-L152 PolarHBondContact O-N 2.91Å; L152-G155 CarbonylContact O-C 3.58Å; L152-G155 PolarHBondContact O-N 3.36Å; L152-F156 VanDerWaalsContact O-CB 3.31Å; L152-F156 WeakPolarHBondContact O-CB 3.35Å; L152-F156 PolarHBondContact O-N 3.06Å; L152-L411 HydrophobicContact CB-CD1 3.95Å; L152-L411 HydrophobicContact CG-CD1 4.24Å; L152-G414 VanDerWaalsContact CD1-CA 3.45Å; L152-L415 HydrophobicContact CD2-CB 4.38Å; L152-L415 HydrophobicContact CD2-CD2 3.67Å; L152-L415 HydrophobicContact CD2-CG 3.81Å; L152-Q418 HydrophobicContact CD1-CG 4.23Å; L152-Q418 HydrophobicContact CD2-CB 4.43Å; L152-Q418 HydrophobicContact CD2-CG 3.82Å
153	A	98.1	Very high	96.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.6	-44.7	178.9	0	0	0	0	0	111.4	I149 M150 F156 Y157 V235 C238 L239	I149-A153 PolarHBondContact O-N 3.16Å; M150-A153 WeakPolarHBondContact O-CB 3.46Å; M150-A153 PolarHBondContact O-N 3.22Å; M150-A153 VanDerWaalsContact O-N 3.14Å; A153-F156 PolarHBondContact O-N 3.12Å; A153-Y157 WeakPolarHBondContact O-CB 3.28Å; A153-Y157 PolarHBondContact O-N 3.36Å; A153-V235 HydrophobicContact CB-CG1 4.33Å; A153-C238 HydrophobicContact CB-CB 4.43Å; A153-C238 WeakPolarHBondContact O-CB 3.46Å; A153-L239 HydrophobicContact CB-CB 4.02Å; A153-L239 HydrophobicContact CB-CD1 4.46Å
154	W	97.7	Very high	96.8	Very high	4 Å²	4	23.3 Å²	23.3	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-44.3	172.4	-59.8	-37.8	0	0	0	111.7	M150 V151 F156 Y157 Y158 W214 V218 L219 F386 M467 F470	M150-W154 HydrophobicContact CB-CH2 4.2Å; M150-W154 HydrophobicContact CB-CZ2 4.25Å; M150-W154 HydrophobicContact CB-CZ3 4.43Å; M150-W154 HydrophobicContact CE-CZ2 3.92Å; M150-W154 VanDerWaalsContact O-CD2 3.27Å; M150-W154 PolarHBondContact O-N 3.36Å; V151-W154 HydrophobicContact CG2-CE3 4.4Å; V151-W154 HydrophobicContact CG2-CZ3 4.23Å; W154-F156 VanDerWaalsContact C-N 3.33Å; W154-F156 PolarHBondContact O-N 3.28Å; W154-Y157 WeakPolarHBondContact O-CB 3.43Å; W154-Y157 PolarHBondContact O-N 2.94Å; W154-Y158 WeakPolarHBondContact O-CD2 3.49Å; W154-Y158 PolarHBondContact O-N 3.21Å; W154-W214 HydrophobicContact CB-CH2 4.35Å; W154-W214 HydrophobicContact CB-CZ3 4.11Å; W154-W214 AromaticContact CD2-CH2 3.64Å; W154-W214 HydrophobicContact CD2-CH2 3.64Å; W154-W214 HydrophobicContact CD2-CZ3 4.2Å; W154-W214 AromaticContact CE3-CH2 3.65Å; W154-W214 HydrophobicContact CE3-CH2 3.65Å; W154-W214 AromaticContact CG-CH2 3.96Å; W154-W214 HydrophobicContact CG-CH2 3.96Å; W154-W214 HydrophobicContact CG-CZ3 4.01Å; W154-W214 HydrophobicContact CZ3-CH2 4.18Å; W154-V218 HydrophobicContact CG-CG1 4.39Å; W154-L219 HydrophobicContact CZ2-CD2 3.8Å; W154-F386 HydrophobicContact CB-CD1 4.41Å; W154-F386 HydrophobicContact CB-CE1 3.78Å; W154-F386 HydrophobicContact CB-CE2 4.33Å; W154-F386 HydrophobicContact CB-CZ 3.73Å; W154-F386 HydrophobicContact CE3-CE2 4.11Å; W154-M467 HydrophobicContact CH2-CE 4.45Å; W154-M467 HydrophobicContact CH2-SD 3.69Å; W154-M467 HydrophobicContact CZ2-SD 4.08Å; W154-F470 HydrophobicContact CH2-CB 4.48Å; W154-F470 HydrophobicContact CH2-CD1 4.01Å; W154-F470 AromaticContact CH2-CD2 3.77Å; W154-F470 HydrophobicContact CH2-CD2 3.77Å; W154-F470 HydrophobicContact CH2-CE1 4.2Å; W154-F470 AromaticContact CH2-CE2 3.92Å; W154-F470 HydrophobicContact CH2-CE2 3.92Å; W154-F470 AromaticContact CH2-CG 3.82Å; W154-F470 HydrophobicContact CH2-CG 3.82Å; W154-F470 HydrophobicContact CH2-CZ 4.15Å; W154-F470 HydrophobicContact CZ3-CD2 4.29Å; W154-F470 HydrophobicContact CZ3-CE1 4.26Å; W154-F470 AromaticContact CZ3-CE2 3.95Å; W154-F470 HydrophobicContact CZ3-CE2 3.95Å; W154-F470 AromaticContact CZ3-CZ 3.96Å; W154-F470 HydrophobicContact CZ3-CZ 3.96Å
155	G	97	Very high	96.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-44.8	174.6	0	0	0	0	0	113.1	V151 L152 Y158 L159	V151-G155 PolarHBondContact O-N 3.29Å; L152-G155 CarbonylContact O-C 3.58Å; L152-G155 PolarHBondContact O-N 3.36Å; G155-Y158 PolarHBondContact O-N 3.27Å; G155-L159 WeakPolarHBondContact O-CB 3.36Å; G155-L159 PolarHBondContact O-N 3.5Å
156	F	98.3	Very high	96.6	Very high	48 Å²	48	32.7 Å²	32.7	21%	0.211	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.2	-158.7	-53.7	0	0	0	110.3	L152 A153 W154 Y158 L159 V160 C238 A241 L245 L411	L152-F156 VanDerWaalsContact O-CB 3.31Å; L152-F156 WeakPolarHBondContact O-CB 3.35Å; L152-F156 PolarHBondContact O-N 3.06Å; A153-F156 PolarHBondContact O-N 3.12Å; W154-F156 VanDerWaalsContact C-N 3.33Å; W154-F156 PolarHBondContact O-N 3.28Å; F156-Y158 PolarHBondContact O-N 3.31Å; F156-L159 WeakPolarHBondContact O-CB 3.2Å; F156-L159 PolarHBondContact O-N 3.06Å; F156-V160 HydrophobicContact CD1-CG2 3.72Å; F156-V160 HydrophobicContact CE1-CG2 3.67Å; F156-V160 WeakPolarHBondContact O-CG2 3.45Å; F156-V160 PolarHBondContact O-N 2.98Å; F156-C238 HydrophobicContact CB-CB 4.17Å; F156-C238 HydrophobicContact CG-CB 4.5Å; F156-A241 HydrophobicContact CE2-CB 4.03Å; F156-A241 HydrophobicContact CZ-CB 4.26Å; F156-L245 HydrophobicContact CE2-CD1 4.1Å; F156-L411 HydrophobicContact CB-CD1 4.32Å; F156-L411 HydrophobicContact CD2-CD1 4.12Å; F156-L411 HydrophobicContact CD2-CD2 3.79Å; F156-L411 HydrophobicContact CE2-CD2 4.23Å; F156-L411 HydrophobicContact CG-CD2 4.35Å
157	Y	98.3	Very high	96.7	Very high	5 Å²	5	32.8 Å²	32.8	2%	0.02	17%	0.174	C	C	.	.	H	α-helix	trans	-57.8	-48.4	177.4	179.2	-91.8	0	0	0	111.7	A153 W154 L159 V160 K161 F213 K217 V218 E234 V235	A153-Y157 WeakPolarHBondContact O-CB 3.28Å; A153-Y157 PolarHBondContact O-N 3.36Å; W154-Y157 WeakPolarHBondContact O-CB 3.43Å; W154-Y157 PolarHBondContact O-N 2.94Å; Y157-L159 VanDerWaalsContact C-N 3.34Å; Y157-L159 PolarHBondContact O-N 3.02Å; Y157-V160 PolarHBondContact O-N 3.34Å; Y157-K161 HydrophobicContact CD1-CG 4.27Å; Y157-K161 HydrophobicContact CE1-CG 3.91Å; Y157-K161 WeakPolarHBondContact O-CG 3.5Å; Y157-K161 PolarHBondContact O-N 3.35Å; Y157-K161 WeakPolarHBondContact OH-CE 3.41Å; Y157-F213 HydrophobicContact CD1-CZ 4.42Å; Y157-F213 HydrophobicContact CE1-CE1 4.14Å; Y157-F213 HydrophobicContact CE1-CE2 4.34Å; Y157-F213 AromaticContact CE1-CZ 3.57Å; Y157-F213 HydrophobicContact CE1-CZ 3.57Å; Y157-K217 WeakPolarHBondContact OH-CE 3.36Å; Y157-V218 HydrophobicContact CD1-CG1 4.45Å; Y157-V218 HydrophobicContact CD1-CG2 3.88Å; Y157-V218 HydrophobicContact CE1-CG2 3.57Å; Y157-E234 HydrophobicContact CD2-CB 4.24Å; Y157-E234 HydrophobicContact CE2-CB 3.76Å; Y157-E234 VanDerWaalsContact CE2-OE2 3.32Å; Y157-E234 WeakPolarHBondContact CE2-OE2 3.19Å; Y157-E234 PolarHBondContact OH-OE2 3.04Å; Y157-V235 HydrophobicContact CD2-CG2 4.34Å
158	Y	98.2	Very high	96.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-37	175.7	-87.7	-103.1	0	0	0	112.7	W154 G155 F156 K161 S162 W169 F213 W214 V218 F386 P390 F407	W154-Y158 WeakPolarHBondContact O-CD2 3.49Å; W154-Y158 PolarHBondContact O-N 3.21Å; G155-Y158 PolarHBondContact O-N 3.27Å; F156-Y158 PolarHBondContact O-N 3.31Å; Y158-K161 CarbonylContact O-C 3.49Å; Y158-K161 PolarHBondContact O-N 3.4Å; Y158-S162 PolarHBondContact O-N 3.07Å; Y158-S162 PolarHBondContact O-OG 3.16Å; Y158-W169 HydrophobicContact CD1-CD2 4.3Å; Y158-W169 AromaticContact CD1-CE3 3.86Å; Y158-W169 HydrophobicContact CD1-CE3 3.86Å; Y158-W169 AromaticContact CD1-CH2 3.67Å; Y158-W169 HydrophobicContact CD1-CH2 3.67Å; Y158-W169 HydrophobicContact CD1-CZ2 4.13Å; Y158-W169 AromaticContact CD1-CZ3 3.52Å; Y158-W169 HydrophobicContact CD1-CZ3 3.52Å; Y158-W169 HydrophobicContact CE1-CD2 4.16Å; Y158-W169 AromaticContact CE1-CE3 3.94Å; Y158-W169 HydrophobicContact CE1-CE3 3.94Å; Y158-W169 HydrophobicContact CE1-CH2 4.46Å; Y158-W169 HydrophobicContact CE1-CZ3 4.1Å; Y158-W169 HydrophobicContact CG-CH2 4.49Å; Y158-W169 HydrophobicContact CG-CZ3 4.3Å; Y158-F213 HydrophobicContact CD1-CE1 4.03Å; Y158-F213 HydrophobicContact CD2-CE1 4.37Å; Y158-F213 AromaticContact CE1-CD1 3.84Å; Y158-F213 HydrophobicContact CE1-CD1 3.84Å; Y158-F213 AromaticContact CE1-CE1 3.58Å; Y158-F213 HydrophobicContact CE1-CE1 3.58Å; Y158-F213 HydrophobicContact CE2-CD1 4.39Å; Y158-F213 AromaticContact CE2-CE1 3.92Å; Y158-F213 HydrophobicContact CE2-CE1 3.92Å; Y158-F213 HydrophobicContact CG-CE1 4.44Å; Y158-F213 AromaticContact CZ-CD1 3.67Å; Y158-F213 AromaticContact CZ-CE1 3.52Å; Y158-W214 AromaticContact CE2-CE3 3.85Å; Y158-W214 HydrophobicContact CE2-CE3 3.85Å; Y158-W214 HydrophobicContact CE2-CZ3 4.02Å; Y158-V218 HydrophobicContact CD2-CG2 4.49Å; Y158-V218 HydrophobicContact CE2-CG1 4.37Å; Y158-V218 HydrophobicContact CE2-CG2 3.71Å; Y158-F386 AromaticContact CD2-CD1 3.79Å; Y158-F386 HydrophobicContact CD2-CD1 3.79Å; Y158-F386 HydrophobicContact CD2-CE1 4.22Å; Y158-F386 HydrophobicContact CE2-CB 4.33Å; Y158-F386 AromaticContact CE2-CD1 3.68Å; Y158-F386 HydrophobicContact CE2-CD1 3.68Å; Y158-F386 HydrophobicContact CE2-CE1 4.49Å; Y158-F386 HydrophobicContact CE2-CG 4.38Å; Y158-F386 HydrophobicContact CG-CD1 4.34Å; Y158-F386 PolarHBondContact OH-O 2.82Å; Y158-P390 HydrophobicContact CE1-CB 4.32Å; Y158-P390 HydrophobicContact CE1-CG 4.1Å; Y158-F407 VanDerWaalsContact CB-CE1 3.47Å; Y158-F407 VanDerWaalsContact CB-CZ 3.45Å; Y158-F407 HydrophobicContact CD1-CD2 4.41Å; Y158-F407 AromaticContact CD1-CE1 3.86Å; Y158-F407 HydrophobicContact CD1-CE1 3.86Å; Y158-F407 AromaticContact CD1-CE2 3.49Å; Y158-F407 HydrophobicContact CD1-CE2 3.49Å; Y158-F407 VanDerWaalsContact CD1-CE2 3.49Å; Y158-F407 AromaticContact CD1-CZ 3.12Å; Y158-F407 HydrophobicContact CD1-CZ 3.12Å; Y158-F407 HydrophobicContact CD2-CE1 4.42Å; Y158-F407 HydrophobicContact CD2-CZ 4.45Å; Y158-F407 HydrophobicContact CE1-CE2 4.47Å; Y158-F407 AromaticContact CE1-CZ 3.88Å; Y158-F407 HydrophobicContact CE1-CZ 3.88Å; Y158-F407 HydrophobicContact CG-CD1 4.29Å; Y158-F407 HydrophobicContact CG-CD2 4.47Å; Y158-F407 AromaticContact CG-CE1 3.69Å; Y158-F407 HydrophobicContact CG-CE1 3.69Å; Y158-F407 AromaticContact CG-CE2 3.91Å; Y158-F407 HydrophobicContact CG-CE2 3.91Å; Y158-F407 AromaticContact CG-CZ 3.45Å; Y158-F407 HydrophobicContact CG-CZ 3.45Å; Y158-F407 VanDerWaalsContact CG-CZ 3.45Å
159	L	98.1	Very high	96.9	Very high	19 Å²	19	32.1 Å²	32.1	10%	0.099	17%	0.174	C	C	.	.	H	α-helix	trans	-59.1	-48	174.1	176.6	59.5	0	0	0	111	G155 F156 Y157 K161 S162 F163 A404 F407 F408 L411	G155-L159 WeakPolarHBondContact O-CB 3.36Å; G155-L159 PolarHBondContact O-N 3.5Å; F156-L159 WeakPolarHBondContact O-CB 3.2Å; F156-L159 PolarHBondContact O-N 3.06Å; Y157-L159 VanDerWaalsContact C-N 3.34Å; Y157-L159 PolarHBondContact O-N 3.02Å; L159-K161 VanDerWaalsContact C-N 3.31Å; L159-K161 PolarHBondContact O-N 3.38Å; L159-S162 VanDerWaalsContact O-CB 3.31Å; L159-S162 WeakPolarHBondContact O-CB 3.32Å; L159-S162 PolarHBondContact O-N 2.87Å; L159-S162 VanDerWaalsContact O-N 3.08Å; L159-F163 HydrophobicContact CD1-CE2 3.92Å; L159-F163 HydrophobicContact CD1-CZ 4.32Å; L159-F163 HydrophobicContact CG-CE2 4.2Å; L159-F163 WeakPolarHBondContact O-CD2 3.32Å; L159-F163 WeakPolarHBondContact O-CE2 3.4Å; L159-A404 HydrophobicContact CD1-CB 4.34Å; L159-A404 WeakPolarHBondContact CD1-O 3.37Å; L159-F407 HydrophobicContact CB-CB 3.88Å; L159-F407 HydrophobicContact CD1-CB 4.45Å; L159-F408 HydrophobicContact CD1-CB 4Å; L159-F408 HydrophobicContact CD2-CB 4.24Å; L159-F408 HydrophobicContact CD2-CD2 3.93Å; L159-L411 HydrophobicContact CD2-CD2 4.08Å
160	V	98.1	Very high	96.7	Very high	76 Å²	76	33.2 Å²	33.2	46%	0.461	18%	0.182	S	C	.	.	H	α-helix	trans	-59.4	-44.2	176.7	171.1	0	0	0	0	110.8	F156 Y157 S162 F163	F156-V160 HydrophobicContact CD1-CG2 3.72Å; F156-V160 HydrophobicContact CE1-CG2 3.67Å; F156-V160 WeakPolarHBondContact O-CG2 3.45Å; F156-V160 PolarHBondContact O-N 2.98Å; Y157-V160 PolarHBondContact O-N 3.34Å; V160-S162 PolarHBondContact O-N 2.93Å; V160-F163 PolarHBondContact O-N 2.94Å
161	K	97.6	Very high	96.6	Very high	54 Å²	54	35.1 Å²	35.1	24%	0.235	19%	0.194	C	C	.	.	H	α-helix	trans	-74	-7.7	178.6	-62.8	-61.7	-175.1	-174.5	0	113.9	Y157 Y158 L159 F163 T164 P168 W169 F213 E234	Y157-K161 HydrophobicContact CD1-CG 4.27Å; Y157-K161 HydrophobicContact CE1-CG 3.91Å; Y157-K161 WeakPolarHBondContact O-CG 3.5Å; Y157-K161 PolarHBondContact O-N 3.35Å; Y157-K161 WeakPolarHBondContact OH-CE 3.41Å; Y158-K161 CarbonylContact O-C 3.49Å; Y158-K161 PolarHBondContact O-N 3.4Å; L159-K161 VanDerWaalsContact C-N 3.31Å; L159-K161 PolarHBondContact O-N 3.38Å; K161-F163 VanDerWaalsContact C-N 3.32Å; K161-T164 PolarHBondContact O-OG1 2.95Å; K161-P168 HydrophobicContact CB-CG 4.16Å; K161-P168 WeakPolarHBondContact O-CD 3.23Å; K161-W169 HydrophobicContact CB-CZ3 3.86Å; K161-F213 HydrophobicContact CG-CZ 4.29Å; K161-E234 IonicContact NZ-OE2 2.9Å; K161-E234 PolarHBondContact NZ-OE2 2.87Å
162	S	98	Very high	96.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.007	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.9	174.6	-59.8	0	0	0	0	112.5	Y158 L159 V160 T164 P400 A403	Y158-S162 PolarHBondContact O-N 3.07Å; Y158-S162 PolarHBondContact O-OG 3.16Å; L159-S162 VanDerWaalsContact O-CB 3.31Å; L159-S162 WeakPolarHBondContact O-CB 3.32Å; L159-S162 PolarHBondContact O-N 2.87Å; L159-S162 VanDerWaalsContact O-N 3.08Å; V160-S162 PolarHBondContact O-N 2.93Å; S162-T164 PolarHBondContact O-N 2.92Å; S162-P400 WeakPolarHBondContact O-CB 3.34Å; S162-A403 WeakPolarHBondContact OG-CB 3.42Å
163	F	97.2	Very high	96.2	Very high	157 Å²	157	39.4 Å²	39.4	69%	0.689	24%	0.236	S	C	*	.	S	Bend	trans	-85.1	52.1	177.2	-63.1	-80	0	0	0	112.2	L159 V160 K161 A404	L159-F163 HydrophobicContact CD1-CE2 3.92Å; L159-F163 HydrophobicContact CD1-CZ 4.32Å; L159-F163 HydrophobicContact CG-CE2 4.2Å; L159-F163 WeakPolarHBondContact O-CD2 3.32Å; L159-F163 WeakPolarHBondContact O-CE2 3.4Å; V160-F163 PolarHBondContact O-N 2.94Å; K161-F163 VanDerWaalsContact C-N 3.32Å; F163-A404 HydrophobicContact CZ-CB 4.38Å
164	T	94.9	Very high	96.1	Very high	55 Å²	55	42.3 Å²	42.3	34%	0.337	25%	0.25	S	C	.	.	S	Bend	trans	-126.4	163.8	175.1	60.7	0	0	0	0	110.4	K161 S162 T166 P168 P400	K161-T164 PolarHBondContact O-OG1 2.95Å; S162-T164 PolarHBondContact O-N 2.92Å; T164-T166 WeakPolarHBondContact CB-O 3.24Å; T164-T166 PolarHBondContact OG1-O 3.36Å; T164-P168 HydrophobicContact CG2-CG 4.49Å; T164-P400 WeakPolarHBondContact O-CB 3.31Å; T164-P400 WeakPolarHBondContact O-CG 3.39Å
165	T	92.9	Very high	96	Very high	140 Å²	140	49 Å²	49	86%	0.859	29%	0.292	S	S	*	.	S	Bend	trans	-69.3	-47.9	175	48.4	0	0	0	0	111.3
166	T	94.7	Very high	95.9	Very high	80 Å²	80	51.4 Å²	51.4	49%	0.491	30%	0.301	S	S	.	.	S	Bend	trans	-113.5	129.7	172	-56	0	0	0	0	108	T164 A170 T171	T164-T166 WeakPolarHBondContact CB-O 3.24Å; T164-T166 PolarHBondContact OG1-O 3.36Å; T166-A170 HydrophobicContact CG2-CB 4.13Å; T166-T171 HydrophobicContact CG2-CG2 4.03Å
167	L	97	Very high	95.8	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	30%	0.297	C	S	.	.			trans	-63.4	135.2	179.2	-67.2	173.2	0	0	0	110	W169 A170 V393 T394 A399 P400 A403	L167-W169 HydrophobicContact CB-CD2 4.18Å; L167-W169 HydrophobicContact CB-CZ2 4.13Å; L167-W169 HydrophobicContact CD1-CZ2 3.82Å; L167-W169 HydrophobicContact CD2-CH2 3.9Å; L167-W169 HydrophobicContact CD2-CZ2 3.66Å; L167-W169 HydrophobicContact CG-CZ2 4.08Å; L167-W169 PolarHBondContact O-N 3.26Å; L167-W169 VanDerWaalsContact O-N 3.09Å; L167-A170 HydrophobicContact CB-CB 4.2Å; L167-A170 WeakPolarHBondContact O-CB 3.48Å; L167-A170 PolarHBondContact O-N 3.22Å; L167-V393 HydrophobicContact CD1-CG1 3.99Å; L167-T394 HydrophobicContact CD1-CG2 4.22Å; L167-A399 HydrophobicContact CD1-CB 3.68Å; L167-A399 HydrophobicContact CG-CB 4.41Å; L167-P400 HydrophobicContact CD2-CG 4.42Å; L167-P400 HydrophobicContact CG-CG 4.46Å; L167-A403 HydrophobicContact CD1-CB 4.03Å; L167-A403 HydrophobicContact CD2-CB 3.99Å
168	P	96.7	Very high	95.6	Very high	16 Å²	16	52.5 Å²	52.5	10%	0.104	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.7	-175.8	-27.2	37.3	0	0	0	115	K161 T164 H174 W176 F213	K161-P168 HydrophobicContact CB-CG 4.16Å; K161-P168 WeakPolarHBondContact O-CD 3.23Å; T164-P168 HydrophobicContact CG2-CG 4.49Å; P168-H174 PolarHBondContact O-NE2 2.87Å; P168-W176 HydrophobicContact CB-CH2 4.34Å; P168-W176 HydrophobicContact CB-CZ2 4.19Å; P168-F213 HydrophobicContact CB-CD2 4.21Å; P168-F213 HydrophobicContact CB-CE2 3.75Å; P168-F213 HydrophobicContact CB-CZ 4.37Å
169	W	95.8	Very high	95.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	2.9	175.8	55.9	85.9	0	0	0	113.6	Y158 K161 L167 V210 F213 P390 T394 A403 F407	Y158-W169 HydrophobicContact CD1-CD2 4.3Å; Y158-W169 AromaticContact CD1-CE3 3.86Å; Y158-W169 HydrophobicContact CD1-CE3 3.86Å; Y158-W169 AromaticContact CD1-CH2 3.67Å; Y158-W169 HydrophobicContact CD1-CH2 3.67Å; Y158-W169 HydrophobicContact CD1-CZ2 4.13Å; Y158-W169 AromaticContact CD1-CZ3 3.52Å; Y158-W169 HydrophobicContact CD1-CZ3 3.52Å; Y158-W169 HydrophobicContact CE1-CD2 4.16Å; Y158-W169 AromaticContact CE1-CE3 3.94Å; Y158-W169 HydrophobicContact CE1-CE3 3.94Å; Y158-W169 HydrophobicContact CE1-CH2 4.46Å; Y158-W169 HydrophobicContact CE1-CZ3 4.1Å; Y158-W169 HydrophobicContact CG-CH2 4.49Å; Y158-W169 HydrophobicContact CG-CZ3 4.3Å; K161-W169 HydrophobicContact CB-CZ3 3.86Å; L167-W169 HydrophobicContact CB-CD2 4.18Å; L167-W169 HydrophobicContact CB-CZ2 4.13Å; L167-W169 HydrophobicContact CD1-CZ2 3.82Å; L167-W169 HydrophobicContact CD2-CH2 3.9Å; L167-W169 HydrophobicContact CD2-CZ2 3.66Å; L167-W169 HydrophobicContact CG-CZ2 4.08Å; L167-W169 PolarHBondContact O-N 3.26Å; L167-W169 VanDerWaalsContact O-N 3.09Å; W169-V210 HydrophobicContact CB-CB 4.47Å; W169-V210 HydrophobicContact CB-CG1 4.39Å; W169-V210 HydrophobicContact CB-CG2 4.27Å; W169-V210 VanDerWaalsContact O-CG2 3.23Å; W169-V210 WeakPolarHBondContact O-CG2 3.3Å; W169-F213 HydrophobicContact CB-CB 3.76Å; W169-F213 HydrophobicContact CB-CD1 3.86Å; W169-F213 HydrophobicContact CB-CG 3.8Å; W169-F213 HydrophobicContact CD2-CD1 4.44Å; W169-F213 HydrophobicContact CD2-CE1 4.38Å; W169-F213 AromaticContact CE3-CD1 3.89Å; W169-F213 HydrophobicContact CE3-CD1 3.89Å; W169-F213 AromaticContact CE3-CE1 3.45Å; W169-F213 HydrophobicContact CE3-CE1 3.45Å; W169-F213 VanDerWaalsContact CE3-CE1 3.45Å; W169-F213 HydrophobicContact CE3-CE2 4.42Å; W169-F213 AromaticContact CE3-CZ 3.73Å; W169-F213 HydrophobicContact CE3-CZ 3.73Å; W169-F213 HydrophobicContact CG-CD1 4.49Å; W169-F213 HydrophobicContact CZ3-CE1 4Å; W169-F213 HydrophobicContact CZ3-CZ 4.13Å; W169-P390 HydrophobicContact CG-CB 4.43Å; W169-P390 PolarHBondContact NE1-O 3.24Å; W169-T394 VanDerWaalsContact CD1-CG2 3.47Å; W169-A403 HydrophobicContact CZ2-CB 3.96Å; W169-F407 HydrophobicContact CH2-CE2 4.06Å; W169-F407 AromaticContact CZ2-CE2 3.97Å; W169-F407 HydrophobicContact CZ2-CE2 3.97Å
170	A	93.9	Very high	94.6	Very high	22 Å²	22	61 Å²	61	18%	0.182	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-33.2	180	0	0	0	0	0	113.2	T166 L167 T394	T166-A170 HydrophobicContact CG2-CB 4.13Å; L167-A170 HydrophobicContact CB-CB 4.2Å; L167-A170 WeakPolarHBondContact O-CB 3.48Å; L167-A170 PolarHBondContact O-N 3.22Å; A170-T394 HydrophobicContact CB-CG2 3.73Å
171	T	93.6	Very high	94.3	Very high	41 Å²	41	58.2 Å²	58.2	25%	0.252	35%	0.346	S	S	.	.			trans	-127.3	156.8	-169.8	64.1	0	0	0	0	112	T166 H174 E183 P209	T166-T171 HydrophobicContact CG2-CG2 4.03Å; T171-H174 PolarHBondContact O-CD2 2.86Å; T171-H174 VanDerWaalsContact O-CD2 3.23Å; T171-H174 PolarHBondContact O-NE2 3.24Å; T171-H174 PolarHBondContact OG1-NE2 3.39Å; T171-E183 WeakPolarHBondContact CA-OE1 3.41Å; T171-E183 WeakPolarHBondContact CB-OE1 3.27Å; T171-P209 WeakPolarHBondContact O-CB 3.33Å
172	C	92.3	Very high	93.7	Very high	30 Å²	30	56.8 Å²	56.8	20%	0.203	34%	0.342	C	S	.	.	S	Bend	trans	-85	177.2	168.9	-63.9	0	0	0	0	110.9	C181 V182 E183	C172-C181 HydrophobicContact CB-CB 3.81Å; C172-C181 WeakPolarHBondContact CB-SG 3.29Å; C172-C181 WeakPolarHBondContact SG-CB 3.39Å; C172-C181 CovalentContact SG-SG 2.04Å; C172-C181 PolarHBondContact SG-SG 3.44Å; C172-V182 PolarHBondContact SG-N 3.05Å; C172-V182 VanDerWaalsContact SG-N 3.42Å; C172-E183 HydrophobicContact CB-CG 4.28Å; C172-E183 PolarHBondContact N-OE1 3.12Å
173	G	92.3	Very high	93	Very high	76 Å²	76	61 Å²	61	78%	0.784	36%	0.362	S	S	*	.			trans	93.7	7.2	175.8	0	0	0	0	0	115.3	N177	G173-N177 PolarHBondContact N-OD1 2.9Å
174	H	95.6	Very high	91.7	Very high	61 Å²	61	58.4 Å²	58.4	28%	0.282	35%	0.354	S	S	.	.	S	Bend	trans	-82.3	166	171.9	-57.1	-81.9	0	0	0	111.6	P168 T171 W176 N177	P168-H174 PolarHBondContact O-NE2 2.87Å; T171-H174 PolarHBondContact O-CD2 2.86Å; T171-H174 VanDerWaalsContact O-CD2 3.23Å; T171-H174 PolarHBondContact O-NE2 3.24Å; T171-H174 PolarHBondContact OG1-NE2 3.39Å; H174-W176 HydrophobicContact CB-CD2 3.64Å; H174-W176 VanDerWaalsContact CB-CE2 3.4Å; H174-W176 HydrophobicContact CB-CE3 3.78Å; H174-W176 HydrophobicContact CB-CG 4.4Å; H174-W176 HydrophobicContact CB-CH2 3.54Å; H174-W176 HydrophobicContact CB-CZ2 3.37Å; H174-W176 HydrophobicContact CB-CZ3 3.74Å; H174-W176 AromaticContact CD2-CZ2 3.66Å; H174-W176 AromaticContact CG-CE2 3.84Å; H174-W176 AromaticContact CG-CH2 3.52Å; H174-W176 AromaticContact CG-CZ2 3.31Å; H174-W176 AromaticContact ND1-CH2 3.56Å; H174-W176 AromaticContact ND1-CZ2 3.79Å; H174-W176 PolarHBondContact O-N 3.42Å; H174-W176 VanDerWaalsContact O-N 3.16Å; H174-N177 VanDerWaalsContact CB-OD1 3.29Å; H174-N177 WeakPolarHBondContact CB-OD1 3.33Å; H174-N177 PolarHBondContact CD2-OD1 2.89Å; H174-N177 VanDerWaalsContact CD2-OD1 3.3Å; H174-N177 PolarHBondContact N-OD1 3.47Å; H174-N177 WeakPolarHBondContact O-CB 3.37Å; H174-N177 PolarHBondContact O-N 2.93Å
175	T	95.9	Very high	90.3	Very high	146 Å²	146	58.3 Å²	58.3	90%	0.896	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.3	-176.5	55.1	0	0	0	0	114.8
176	W	95.4	Very high	88.8	Confident	49 Å²	49	55.5 Å²	55.5	19%	0.186	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.4	175.2	59.5	83.7	0	0	0	113	P168 H174 F213 N216 K217	P168-W176 HydrophobicContact CB-CH2 4.34Å; P168-W176 HydrophobicContact CB-CZ2 4.19Å; H174-W176 HydrophobicContact CB-CD2 3.64Å; H174-W176 VanDerWaalsContact CB-CE2 3.4Å; H174-W176 HydrophobicContact CB-CE3 3.78Å; H174-W176 HydrophobicContact CB-CG 4.4Å; H174-W176 HydrophobicContact CB-CH2 3.54Å; H174-W176 HydrophobicContact CB-CZ2 3.37Å; H174-W176 HydrophobicContact CB-CZ3 3.74Å; H174-W176 AromaticContact CD2-CZ2 3.66Å; H174-W176 AromaticContact CG-CE2 3.84Å; H174-W176 AromaticContact CG-CH2 3.52Å; H174-W176 AromaticContact CG-CZ2 3.31Å; H174-W176 AromaticContact ND1-CH2 3.56Å; H174-W176 AromaticContact ND1-CZ2 3.79Å; H174-W176 PolarHBondContact O-N 3.42Å; H174-W176 VanDerWaalsContact O-N 3.16Å; W176-F213 AromaticContact CE2-CD2 3.92Å; W176-F213 AromaticContact CZ2-CD2 3.8Å; W176-F213 HydrophobicContact CZ2-CD2 3.8Å; W176-F213 HydrophobicContact CZ2-CE2 4.21Å; W176-F213 AromaticContact NE1-CD2 3.94Å; W176-N216 HydrophobicContact CB-CB 4.21Å; W176-N216 WeakPolarHBondContact O-CB 3.36Å; W176-N216 PolarHBondContact O-ND2 3.34Å; W176-N216 VanDerWaalsContact O-ND2 3.12Å; W176-K217 HydrophobicContact CB-CB 3.98Å; W176-K217 HydrophobicContact CD2-CB 3.77Å; W176-K217 HydrophobicContact CD2-CD 4.07Å; W176-K217 HydrophobicContact CD2-CG 3.9Å; W176-K217 HydrophobicContact CE3-CB 4.33Å; W176-K217 HydrophobicContact CE3-CD 3.72Å; W176-K217 HydrophobicContact CE3-CG 4Å; W176-K217 HydrophobicContact CG-CB 3.6Å; W176-K217 HydrophobicContact CG-CD 4.48Å; W176-K217 HydrophobicContact CG-CG 4.26Å; W176-K217 HydrophobicContact CZ3-CD 4.22Å; W176-K217 HydrophobicContact CZ3-CG 4.42Å
177	N	96.2	Very high	87	Confident	26 Å²	26	57.7 Å²	57.7	14%	0.139	33%	0.327	C	S	.	.			trans	-79.5	141.5	-179.4	-70	128.7	0	0	0	111.4	G173 H174 C181 E212	G173-N177 PolarHBondContact N-OD1 2.9Å; H174-N177 VanDerWaalsContact CB-OD1 3.29Å; H174-N177 WeakPolarHBondContact CB-OD1 3.33Å; H174-N177 PolarHBondContact CD2-OD1 2.89Å; H174-N177 VanDerWaalsContact CD2-OD1 3.3Å; H174-N177 PolarHBondContact N-OD1 3.47Å; H174-N177 WeakPolarHBondContact O-CB 3.37Å; H174-N177 PolarHBondContact O-N 2.93Å; N177-C181 HydrophobicContact CB-CB 4.16Å; N177-C181 PolarHBondContact ND2-SG 3Å; N177-E212 WeakPolarHBondContact CA-OE2 3.44Å; N177-E212 WeakPolarHBondContact CB-OE2 3.26Å; N177-E212 PolarHBondContact ND2-OE2 2.91Å
178	T	93.4	Very high	85.1	Confident	51 Å²	51	64.1 Å²	64.1	31%	0.313	36%	0.357	S	S	.	.			trans	-86.4	165.1	173.7	79.3	0	0	0	0	110.5	D180 C181 E212	T178-D180 PolarHBondContact O-N 3.48Å; T178-D180 VanDerWaalsContact O-N 3.12Å; T178-D180 PolarHBondContact OG1-N 3.19Å; T178-D180 VanDerWaalsContact OG1-N 3.11Å; T178-C181 WeakPolarHBondContact O-CB 3.39Å; T178-C181 PolarHBondContact O-N 3.12Å; T178-C181 VanDerWaalsContact O-N 3.17Å; T178-E212 WeakPolarHBondContact CB-OE1 3.43Å; T178-E212 PolarHBondContact N-OE2 3.49Å; T178-E212 PolarHBondContact OG1-OE1 3.33Å
179	P	89.3	Confident	83.1	Confident	119 Å²	119	67.3 Å²	67.3	77%	0.773	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.2	169.5	-23	35.2	0	0	0	114.2	R206	P179-R206 PolarHBondContact O-NH1 2.96Å
180	D	87.1	Confident	81.3	Confident	79 Å²	79	68.1 Å²	68.1	42%	0.422	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.3	179.7	-59.5	-43.2	0	0	0	113.4	T178 V182 R206 R207	T178-D180 PolarHBondContact O-N 3.48Å; T178-D180 VanDerWaalsContact O-N 3.12Å; T178-D180 PolarHBondContact OG1-N 3.19Å; T178-D180 VanDerWaalsContact OG1-N 3.11Å; D180-V182 PolarHBondContact O-N 3.26Å; D180-R206 WeakPolarHBondContact O-CD 3.43Å; D180-R206 IonicContact OD1-CZ 3.84Å; D180-R206 IonicContact OD1-NH1 3.85Å; D180-R207 PolarHBondContact O-N 3.39Å
181	C	90.1	Very high	79.4	Confident	16 Å²	16	70.9 Å²	70.9	11%	0.108	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-67.1	126.4	175.9	-169.4	0	0	0	0	111.4	C172 N177 T178 R207 E212	C172-C181 HydrophobicContact CB-CB 3.81Å; C172-C181 WeakPolarHBondContact CB-SG 3.29Å; C172-C181 WeakPolarHBondContact SG-CB 3.39Å; C172-C181 CovalentContact SG-SG 2.04Å; C172-C181 PolarHBondContact SG-SG 3.44Å; N177-C181 HydrophobicContact CB-CB 4.16Å; N177-C181 PolarHBondContact ND2-SG 3Å; T178-C181 WeakPolarHBondContact O-CB 3.39Å; T178-C181 PolarHBondContact O-N 3.12Å; T178-C181 VanDerWaalsContact O-N 3.17Å; C181-R207 WeakPolarHBondContact CA-O 3.34Å; C181-E212 WeakPolarHBondContact CB-OE2 3.22Å
182	V	86.3	Confident	77.6	Confident	25 Å²	25	74.9 Å²	74.9	15%	0.152	42%	0.422	C	S	.	.			trans	-132.7	145.2	173.2	-60.4	0	0	0	0	111	C172 D180 F185 L203 R206 R207 P209	C172-V182 PolarHBondContact SG-N 3.05Å; C172-V182 VanDerWaalsContact SG-N 3.42Å; D180-V182 PolarHBondContact O-N 3.26Å; V182-F185 HydrophobicContact CG2-CE1 3.86Å; V182-F185 HydrophobicContact CG2-CE2 4.19Å; V182-F185 HydrophobicContact CG2-CZ 3.56Å; V182-F185 WeakPolarHBondContact O-CE2 3.5Å; V182-F185 WeakPolarHBondContact O-CZ 3.46Å; V182-L203 HydrophobicContact CG2-CD1 4.1Å; V182-R206 HydrophobicContact CB-CB 4.4Å; V182-R206 HydrophobicContact CG1-CB 3.96Å; V182-R206 HydrophobicContact CG1-CG 3.9Å; V182-R206 HydrophobicContact CG2-CB 3.54Å; V182-R206 HydrophobicContact CG2-CG 4.33Å; V182-R207 PolarHBondContact N-O 3.11Å; V182-P209 WeakPolarHBondContact O-CD 3.3Å
183	E	82.8	Confident	75.5	Confident	88 Å²	88	76.3 Å²	76.3	41%	0.411	44%	0.436	S	S	.	.	S	Bend	trans	-92.2	-27.8	-179.7	-62.2	-179.6	-172.7	0	0	112.7	T171 C172 R391	T171-E183 WeakPolarHBondContact CA-OE1 3.41Å; T171-E183 WeakPolarHBondContact CB-OE1 3.27Å; C172-E183 HydrophobicContact CB-CG 4.28Å; C172-E183 PolarHBondContact N-OE1 3.12Å; E183-R391 PolarHBondContact O-NH2 3.48Å
184	I	69.9	Low	73.5	Confident	104 Å²	104	77.7 Å²	77.7	53%	0.533	43%	0.434	S	S	.	.			trans	-95.4	121.4	-174	-55.3	173.8	0	0	0	109.8	D189	I184-D189 HydrophobicContact CG2-CB 4.01Å
185	F	65.8	Low	71.4	Confident	52 Å²	52	83 Å²	83	23%	0.228	46%	0.463	C	S	.	.			trans	-122.6	5.4	177.6	-68.8	-85.4	0	0	0	113.6	V182 H187 S208	V182-F185 HydrophobicContact CG2-CE1 3.86Å; V182-F185 HydrophobicContact CG2-CE2 4.19Å; V182-F185 HydrophobicContact CG2-CZ 3.56Å; V182-F185 WeakPolarHBondContact O-CE2 3.5Å; V182-F185 WeakPolarHBondContact O-CZ 3.46Å; F185-H187 PolarHBondContact O-N 3.38Å; F185-S208 VanDerWaalsContact CE2-CB 3.42Å
186	R	61.9	Low	69.4	Low	81 Å²	81	78.8 Å²	78.8	31%	0.306	44%	0.443	S	S	.	.			trans	-70.7	121.3	177.3	-69.4	-176.7	111.3	125.7	8.1	109.2	E188 D189 C190 E369	R186-E188 PolarHBondContact O-N 2.85Å; R186-D189 HydrophobicContact CB-CB 4.17Å; R186-D189 WeakPolarHBondContact CB-OD2 3.38Å; R186-D189 WeakPolarHBondContact CD-OD2 3.25Å; R186-D189 PolarHBondContact O-N 2.84Å; R186-C190 PolarHBondContact O-N 3.1Å; R186-E369 IonicContact CZ-OE1 3.61Å; R186-E369 PolarHBondContact NE-O 3.15Å; R186-E369 PolarHBondContact NH1-O 3.06Å; R186-E369 IonicContact NH1-OE1 2.79Å; R186-E369 PolarHBondContact NH1-OE1 2.89Å; R186-E369 PolarHBondContact NH2-O 2.9Å; R186-E369 IonicContact NH2-OE1 3.74Å
187	H	56.8	Low	67.6	Low	127 Å²	127	84.3 Å²	84.3	59%	0.588	48%	0.476	S	S	*	.	H	α-helix	trans	-59.4	-30.9	173.1	-95.6	-66	0	0	0	112.5	F185 C190 A191	F185-H187 PolarHBondContact O-N 3.38Å; H187-C190 WeakPolarHBondContact O-CB 3.42Å; H187-C190 PolarHBondContact O-N 3Å; H187-A191 PolarHBondContact O-N 3.1Å
188	E	55.2	Low	65.9	Low	137 Å²	137	85.2 Å²	85.2	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-68.6	-38	178.8	-64.7	-179.4	167.7	0	0	112.7	R186 C190 A191	R186-E188 PolarHBondContact O-N 2.85Å; E188-C190 PolarHBondContact O-N 2.83Å; E188-A191 WeakPolarHBondContact O-CB 3.39Å; E188-A191 PolarHBondContact O-N 3.49Å; E188-A191 VanDerWaalsContact O-N 3.15Å
189	D	55.2	Low	64.4	Low	83 Å²	83	86.3 Å²	86.3	44%	0.444	49%	0.487	S	S	.	.	H	α-helix	trans	-67	-27.8	175.2	-67.6	-26.7	0	0	0	111.2	I184 R186 N192	I184-D189 HydrophobicContact CG2-CB 4.01Å; R186-D189 HydrophobicContact CB-CB 4.17Å; R186-D189 WeakPolarHBondContact CB-OD2 3.38Å; R186-D189 WeakPolarHBondContact CD-OD2 3.25Å; R186-D189 PolarHBondContact O-N 2.84Å; D189-N192 PolarHBondContact O-N 2.86Å
190	C	57.8	Low	63.2	Low	18 Å²	18	82.8 Å²	82.8	12%	0.122	47%	0.465	C	S	.	.	H	α-helix	trans	-72.1	-29.1	174.5	-170.4	0	0	0	0	113.2	R186 H187 E188 N192 A193 C200 L203	R186-C190 PolarHBondContact O-N 3.1Å; H187-C190 WeakPolarHBondContact O-CB 3.42Å; H187-C190 PolarHBondContact O-N 3Å; E188-C190 PolarHBondContact O-N 2.83Å; C190-N192 VanDerWaalsContact C-N 3.28Å; C190-N192 PolarHBondContact O-N 3.44Å; C190-A193 WeakPolarHBondContact O-CB 3.44Å; C190-A193 PolarHBondContact O-N 2.94Å; C190-C200 HydrophobicContact CB-CB 4.27Å; C190-C200 WeakPolarHBondContact CB-SG 3.49Å; C190-C200 WeakPolarHBondContact SG-CA 3.42Å; C190-C200 WeakPolarHBondContact SG-CB 3.2Å; C190-C200 PolarHBondContact SG-N 2.97Å; C190-C200 CovalentContact SG-SG 2.05Å; C190-C200 PolarHBondContact SG-SG 3.4Å; C190-L203 HydrophobicContact CB-CD2 4.36Å
191	A	55.5	Low	62	Low	80 Å²	80	85.6 Å²	85.6	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-68.9	-27.4	175.9	0	0	0	0	0	112.6	H187 E188 A193	H187-A191 PolarHBondContact O-N 3.1Å; E188-A191 WeakPolarHBondContact O-CB 3.39Å; E188-A191 PolarHBondContact O-N 3.49Å; E188-A191 VanDerWaalsContact O-N 3.15Å; A191-A193 VanDerWaalsContact C-N 3.3Å; A191-A193 PolarHBondContact O-N 2.87Å
192	N	54	Low	60.5	Low	124 Å²	124	89.4 Å²	89.4	66%	0.663	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	46	175.3	-73	-29.3	0	0	0	111.8	D189 C190 S194	D189-N192 PolarHBondContact O-N 2.86Å; C190-N192 VanDerWaalsContact C-N 3.28Å; C190-N192 PolarHBondContact O-N 3.44Å; N192-S194 PolarHBondContact O-N 3.25Å
193	A	49.9	Very low	59.5	Low	60 Å²	60	89.8 Å²	89.8	50%	0.496	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	54.1	-171.7	0	0	0	0	0	117.1	C190 A191	C190-A193 WeakPolarHBondContact O-CB 3.44Å; C190-A193 PolarHBondContact O-N 2.94Å; A191-A193 VanDerWaalsContact C-N 3.3Å; A191-A193 PolarHBondContact O-N 2.87Å
194	S	49.5	Very low	58.7	Low	106 Å²	106	89.5 Å²	89.5	74%	0.741	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-12.5	167.5	64.2	0	0	0	0	113.2	N192	N192-S194 PolarHBondContact O-N 3.25Å
195	L	50.7	Low	58.6	Low	172 Å²	172	91.2 Å²	91.2	90%	0.901	52%	0.52	S	S	*	.	S	Bend	trans	-87.6	-18.7	179.3	-78.2	162.6	0	0	0	114
196	A	54.3	Low	59.2	Low	57 Å²	57	92.1 Å²	92.1	47%	0.471	52%	0.522	S	S	.	.	S	Bend	trans	-144.8	134	167.4	0	0	0	0	0	107.8	L198	A196-L198 HydrophobicContact CB-CD1 4.2Å; A196-L198 PolarHBondContact O-N 3.42Å
197	N	58	Low	60.3	Low	165 Å²	165	92.4 Å²	92.4	88%	0.882	52%	0.523	S	S	*	.	S	Bend	trans	-66.5	35.9	178.2	-80.4	-18.5	0	0	0	113.6
198	L	59.9	Low	61.8	Low	45 Å²	45	87 Å²	87	24%	0.236	50%	0.499	C	S	.	.			trans	-110.9	140.3	179.1	-81.6	95.7	0	0	0	111.5	A196 Q202 R206	A196-L198 HydrophobicContact CB-CD1 4.2Å; A196-L198 PolarHBondContact O-N 3.42Å; L198-Q202 HydrophobicContact CB-CB 4.5Å; L198-Q202 HydrophobicContact CD2-CB 4.04Å; L198-Q202 HydrophobicContact CG-CB 4.48Å; L198-R206 HydrophobicContact CD2-CG 4.31Å
199	T	63.1	Low	63.6	Low	74 Å²	74	80.4 Å²	80.4	45%	0.454	47%	0.469	S	S	.	.			trans	-81.9	160	166.5	63.3	0	0	0	0	110.7	D201 Q202 L203	T199-D201 PolarHBondContact O-N 2.93Å; T199-Q202 WeakPolarHBondContact O-CB 3.27Å; T199-Q202 PolarHBondContact O-N 3.16Å; T199-Q202 VanDerWaalsContact OG1-CG 3.29Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.49Å; T199-Q202 PolarHBondContact OG1-N 3.37Å; T199-L203 PolarHBondContact O-N 3.13Å; T199-L203 VanDerWaalsContact O-N 3.13Å
200	C	62.9	Low	65.4	Low	46 Å²	46	76.5 Å²	76.5	31%	0.311	45%	0.448	S	S	.	.	H	α-helix	trans	-65.4	-28.9	178	-55.7	0	0	0	0	113.5	C190 Q202 L203 A204	C190-C200 HydrophobicContact CB-CB 4.27Å; C190-C200 WeakPolarHBondContact CB-SG 3.49Å; C190-C200 WeakPolarHBondContact SG-CA 3.42Å; C190-C200 WeakPolarHBondContact SG-CB 3.2Å; C190-C200 PolarHBondContact SG-N 2.97Å; C190-C200 CovalentContact SG-SG 2.05Å; C190-C200 PolarHBondContact SG-SG 3.4Å; C200-Q202 VanDerWaalsContact C-N 3.31Å; C200-L203 WeakPolarHBondContact O-CB 3.49Å; C200-L203 PolarHBondContact O-N 3.27Å; C200-A204 PolarHBondContact O-N 3.33Å
201	D	61.9	Low	66.9	Low	137 Å²	137	77.4 Å²	77.4	73%	0.733	45%	0.451	S	S	*	.	H	α-helix	trans	-62.8	-40.7	170.5	-68	-24	0	0	0	110.9	T199 L203 A204	T199-D201 PolarHBondContact O-N 2.93Å; D201-L203 VanDerWaalsContact C-N 3.26Å; D201-L203 PolarHBondContact O-N 3.3Å; D201-A204 WeakPolarHBondContact O-CB 3.17Å; D201-A204 PolarHBondContact O-N 2.92Å
202	Q	60	Low	68.8	Low	96 Å²	96	73.6 Å²	73.6	45%	0.449	42%	0.419	S	S	.	.	H	α-helix	trans	-69.6	-22.2	176.2	-70.8	172.8	-15.1	0	0	113.2	L198 T199 C200 R206	L198-Q202 HydrophobicContact CB-CB 4.5Å; L198-Q202 HydrophobicContact CD2-CB 4.04Å; L198-Q202 HydrophobicContact CG-CB 4.48Å; T199-Q202 WeakPolarHBondContact O-CB 3.27Å; T199-Q202 PolarHBondContact O-N 3.16Å; T199-Q202 VanDerWaalsContact OG1-CG 3.29Å; T199-Q202 WeakPolarHBondContact OG1-CG 3.49Å; T199-Q202 PolarHBondContact OG1-N 3.37Å; C200-Q202 VanDerWaalsContact C-N 3.31Å; Q202-R206 VanDerWaalsContact O-CG 3.3Å; Q202-R206 WeakPolarHBondContact O-CG 3.44Å
203	L	65	Low	70.8	Confident	33 Å²	33	67.7 Å²	67.7	17%	0.173	39%	0.388	C	S	.	.	H	α-helix	trans	-76	-26.1	176	-161.5	72.2	0	0	0	111.9	V182 C190 T199 C200 D201 D205 R206	V182-L203 HydrophobicContact CG2-CD1 4.1Å; C190-L203 HydrophobicContact CB-CD2 4.36Å; T199-L203 PolarHBondContact O-N 3.13Å; T199-L203 VanDerWaalsContact O-N 3.13Å; C200-L203 WeakPolarHBondContact O-CB 3.49Å; C200-L203 PolarHBondContact O-N 3.27Å; D201-L203 VanDerWaalsContact C-N 3.26Å; D201-L203 PolarHBondContact O-N 3.3Å; L203-D205 VanDerWaalsContact C-N 3.26Å; L203-D205 PolarHBondContact O-N 3.31Å; L203-R206 HydrophobicContact CD1-CG 4.39Å; L203-R206 WeakPolarHBondContact O-CB 3.46Å; L203-R206 PolarHBondContact O-N 3.42Å; L203-R206 VanDerWaalsContact O-N 3.12Å
204	A	64.4	Low	73	Confident	82 Å²	82	65 Å²	65	68%	0.678	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-31.7	-179.5	0	0	0	0	0	113	C200 D201	C200-A204 PolarHBondContact O-N 3.33Å; D201-A204 WeakPolarHBondContact O-CB 3.17Å; D201-A204 PolarHBondContact O-N 2.92Å
205	D	68.8	Low	75.1	Confident	140 Å²	140	60.8 Å²	60.8	75%	0.749	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.6	177.9	-65	-32.7	0	0	0	113.2	L203	L203-D205 VanDerWaalsContact C-N 3.26Å; L203-D205 PolarHBondContact O-N 3.31Å
206	R	78.4	Confident	77.3	Confident	72 Å²	72	55.3 Å²	55.3	27%	0.272	31%	0.305	S	S	.	.			trans	-82.1	154.5	-178	-64.4	-71.4	-179.2	152.4	-13.4	111.9	P179 D180 V182 L198 Q202 L203	P179-R206 PolarHBondContact O-NH1 2.96Å; D180-R206 WeakPolarHBondContact O-CD 3.43Å; D180-R206 IonicContact OD1-CZ 3.84Å; D180-R206 IonicContact OD1-NH1 3.85Å; V182-R206 HydrophobicContact CB-CB 4.4Å; V182-R206 HydrophobicContact CG1-CB 3.96Å; V182-R206 HydrophobicContact CG1-CG 3.9Å; V182-R206 HydrophobicContact CG2-CB 3.54Å; V182-R206 HydrophobicContact CG2-CG 4.33Å; L198-R206 HydrophobicContact CD2-CG 4.31Å; Q202-R206 VanDerWaalsContact O-CG 3.3Å; Q202-R206 WeakPolarHBondContact O-CG 3.44Å; L203-R206 HydrophobicContact CD1-CG 4.39Å; L203-R206 WeakPolarHBondContact O-CB 3.46Å; L203-R206 PolarHBondContact O-N 3.42Å; L203-R206 VanDerWaalsContact O-N 3.12Å
207	R	84.5	Confident	79.3	Confident	87 Å²	87	54.4 Å²	54.4	33%	0.328	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-114.7	149.1	-176.5	-54.7	-161.6	86.1	-179.7	-0.2	112.1	D180 C181 V182 I211 E212 E215	D180-R207 PolarHBondContact O-N 3.39Å; C181-R207 WeakPolarHBondContact CA-O 3.34Å; V182-R207 PolarHBondContact N-O 3.11Å; R207-I211 VanDerWaalsContact NH2-CG2 3.27Å; R207-E212 HydrophobicContact CB-CG 4.08Å; R207-E215 IonicContact CZ-OE1 3.93Å; R207-E215 IonicContact CZ-OE2 3.1Å; R207-E215 IonicContact NH1-OE2 3.48Å; R207-E215 PolarHBondContact NH1-OE2 2.89Å; R207-E215 IonicContact NH2-OE1 2.9Å; R207-E215 PolarHBondContact NH2-OE1 3.44Å; R207-E215 IonicContact NH2-OE2 2.77Å; R207-E215 PolarHBondContact NH2-OE2 2.95Å
208	S	88.7	Confident	81.1	Confident	12 Å²	12	46.7 Å²	46.7	8%	0.084	25%	0.249	C	C	.	.			trans	-83.3	150.6	179.3	77.4	0	0	0	0	111.7	F185 V210 I211 E212	F185-S208 VanDerWaalsContact CE2-CB 3.42Å; S208-V210 PolarHBondContact O-N 2.72Å; S208-V210 VanDerWaalsContact O-N 3.11Å; S208-I211 PolarHBondContact O-N 3.37Å; S208-I211 VanDerWaalsContact O-N 3.15Å; S208-I211 VanDerWaalsContact OG-CG1 3.32Å; S208-I211 WeakPolarHBondContact OG-CG1 3.22Å; S208-I211 PolarHBondContact OG-N 2.86Å; S208-E212 PolarHBondContact O-N 3.05Å
209	P	92.8	Very high	82.8	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-25.2	176	23.8	-35.4	0	0	0	112.4	T171 V182 F213	T171-P209 WeakPolarHBondContact O-CB 3.33Å; V182-P209 WeakPolarHBondContact O-CD 3.3Å; P209-F213 WeakPolarHBondContact O-CB 3.39Å; P209-F213 PolarHBondContact O-N 3.14Å
210	V	92.6	Very high	84.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-73.4	-44.5	177.8	-169	0	0	0	0	111.9	W169 S208 F213 W214 I387 P390 R391	W169-V210 HydrophobicContact CB-CB 4.47Å; W169-V210 HydrophobicContact CB-CG1 4.39Å; W169-V210 HydrophobicContact CB-CG2 4.27Å; W169-V210 VanDerWaalsContact O-CG2 3.23Å; W169-V210 WeakPolarHBondContact O-CG2 3.3Å; S208-V210 PolarHBondContact O-N 2.72Å; S208-V210 VanDerWaalsContact O-N 3.11Å; V210-F213 PolarHBondContact O-N 3.14Å; V210-W214 PolarHBondContact O-N 2.74Å; V210-I387 HydrophobicContact CG1-CG2 4.29Å; V210-I387 WeakPolarHBondContact CG1-O 3.04Å; V210-P390 HydrophobicContact CG1-CB 4.06Å; V210-R391 HydrophobicContact CG2-CB 3.99Å; V210-R391 HydrophobicContact CG2-CG 4.48Å
211	I	90.5	Very high	85.9	Confident	37 Å²	37	46.5 Å²	46.5	19%	0.19	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-46	176.1	-68.2	168.1	0	0	0	109.8	R207 S208 F213 W214 E215 I387	R207-I211 VanDerWaalsContact NH2-CG2 3.27Å; S208-I211 PolarHBondContact O-N 3.37Å; S208-I211 VanDerWaalsContact O-N 3.15Å; S208-I211 VanDerWaalsContact OG-CG1 3.32Å; S208-I211 WeakPolarHBondContact OG-CG1 3.22Å; S208-I211 PolarHBondContact OG-N 2.86Å; I211-F213 VanDerWaalsContact C-N 3.34Å; I211-F213 PolarHBondContact O-N 3.02Å; I211-W214 PolarHBondContact O-N 2.78Å; I211-E215 HydrophobicContact CG2-CG 4.34Å; I211-E215 WeakPolarHBondContact O-CB 3.08Å; I211-E215 PolarHBondContact O-N 2.8Å; I211-I387 HydrophobicContact CG1-CD1 4.47Å; I211-I387 HydrophobicContact CG1-CG2 3.69Å
212	E	94.5	Very high	87.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.8	-33.8	178.9	-68.1	-166.6	173.4	0	0	112.8	N177 T178 C181 R207 S208 N216 K217	N177-E212 WeakPolarHBondContact CA-OE2 3.44Å; N177-E212 WeakPolarHBondContact CB-OE2 3.26Å; N177-E212 PolarHBondContact ND2-OE2 2.91Å; T178-E212 WeakPolarHBondContact CB-OE1 3.43Å; T178-E212 PolarHBondContact N-OE2 3.49Å; T178-E212 PolarHBondContact OG1-OE1 3.33Å; C181-E212 WeakPolarHBondContact CB-OE2 3.22Å; R207-E212 HydrophobicContact CB-CG 4.08Å; S208-E212 PolarHBondContact O-N 3.05Å; E212-N216 WeakPolarHBondContact O-CA 3.36Å; E212-N216 WeakPolarHBondContact O-CB 3.33Å; E212-N216 PolarHBondContact O-N 3.11Å; E212-K217 PolarHBondContact O-N 2.94Å
213	F	96.4	Very high	89	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-62.4	-45.5	171.5	-179.5	-101.7	0	0	0	111.1	Y157 Y158 K161 P168 W169 W176 P209 V210 I211 K217 V218	Y157-F213 HydrophobicContact CD1-CZ 4.42Å; Y157-F213 HydrophobicContact CE1-CE1 4.14Å; Y157-F213 HydrophobicContact CE1-CE2 4.34Å; Y157-F213 AromaticContact CE1-CZ 3.57Å; Y157-F213 HydrophobicContact CE1-CZ 3.57Å; Y158-F213 HydrophobicContact CD1-CE1 4.03Å; Y158-F213 HydrophobicContact CD2-CE1 4.37Å; Y158-F213 AromaticContact CE1-CD1 3.84Å; Y158-F213 HydrophobicContact CE1-CD1 3.84Å; Y158-F213 AromaticContact CE1-CE1 3.58Å; Y158-F213 HydrophobicContact CE1-CE1 3.58Å; Y158-F213 HydrophobicContact CE2-CD1 4.39Å; Y158-F213 AromaticContact CE2-CE1 3.92Å; Y158-F213 HydrophobicContact CE2-CE1 3.92Å; Y158-F213 HydrophobicContact CG-CE1 4.44Å; Y158-F213 AromaticContact CZ-CD1 3.67Å; Y158-F213 AromaticContact CZ-CE1 3.52Å; K161-F213 HydrophobicContact CG-CZ 4.29Å; P168-F213 HydrophobicContact CB-CD2 4.21Å; P168-F213 HydrophobicContact CB-CE2 3.75Å; P168-F213 HydrophobicContact CB-CZ 4.37Å; W169-F213 HydrophobicContact CB-CB 3.76Å; W169-F213 HydrophobicContact CB-CD1 3.86Å; W169-F213 HydrophobicContact CB-CG 3.8Å; W169-F213 HydrophobicContact CD2-CD1 4.44Å; W169-F213 HydrophobicContact CD2-CE1 4.38Å; W169-F213 AromaticContact CE3-CD1 3.89Å; W169-F213 HydrophobicContact CE3-CD1 3.89Å; W169-F213 AromaticContact CE3-CE1 3.45Å; W169-F213 HydrophobicContact CE3-CE1 3.45Å; W169-F213 VanDerWaalsContact CE3-CE1 3.45Å; W169-F213 HydrophobicContact CE3-CE2 4.42Å; W169-F213 AromaticContact CE3-CZ 3.73Å; W169-F213 HydrophobicContact CE3-CZ 3.73Å; W169-F213 HydrophobicContact CG-CD1 4.49Å; W169-F213 HydrophobicContact CZ3-CE1 4Å; W169-F213 HydrophobicContact CZ3-CZ 4.13Å; W176-F213 AromaticContact CE2-CD2 3.92Å; W176-F213 AromaticContact CZ2-CD2 3.8Å; W176-F213 HydrophobicContact CZ2-CD2 3.8Å; W176-F213 HydrophobicContact CZ2-CE2 4.21Å; W176-F213 AromaticContact NE1-CD2 3.94Å; P209-F213 WeakPolarHBondContact O-CB 3.39Å; P209-F213 PolarHBondContact O-N 3.14Å; V210-F213 PolarHBondContact O-N 3.14Å; I211-F213 VanDerWaalsContact C-N 3.34Å; I211-F213 PolarHBondContact O-N 3.02Å; F213-K217 HydrophobicContact CD2-CB 4.06Å; F213-K217 HydrophobicContact CD2-CG 4.05Å; F213-K217 HydrophobicContact CE2-CB 4.44Å; F213-K217 HydrophobicContact CE2-CG 3.95Å; F213-K217 WeakPolarHBondContact O-CA 3.42Å; F213-K217 VanDerWaalsContact O-CB 3.29Å; F213-K217 WeakPolarHBondContact O-CB 3.45Å; F213-K217 PolarHBondContact O-N 2.86Å; F213-V218 HydrophobicContact CD1-CG2 3.87Å; F213-V218 HydrophobicContact CE1-CG2 3.59Å; F213-V218 HydrophobicContact CZ-CG2 4.09Å; F213-V218 WeakPolarHBondContact O-CG2 3.47Å; F213-V218 PolarHBondContact O-N 3.3Å
214	W	95.5	Very high	90.4	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.019	21%	0.207	C	C	.	.	I	π-helix	trans	-63	-56.4	177	176.9	-112.9	0	0	0	112.1	W154 Y158 V210 I211 V218 L219 P382 F386 I387	W154-W214 HydrophobicContact CB-CH2 4.35Å; W154-W214 HydrophobicContact CB-CZ3 4.11Å; W154-W214 AromaticContact CD2-CH2 3.64Å; W154-W214 HydrophobicContact CD2-CH2 3.64Å; W154-W214 HydrophobicContact CD2-CZ3 4.2Å; W154-W214 AromaticContact CE3-CH2 3.65Å; W154-W214 HydrophobicContact CE3-CH2 3.65Å; W154-W214 AromaticContact CG-CH2 3.96Å; W154-W214 HydrophobicContact CG-CH2 3.96Å; W154-W214 HydrophobicContact CG-CZ3 4.01Å; W154-W214 HydrophobicContact CZ3-CH2 4.18Å; Y158-W214 AromaticContact CE2-CE3 3.85Å; Y158-W214 HydrophobicContact CE2-CE3 3.85Å; Y158-W214 HydrophobicContact CE2-CZ3 4.02Å; V210-W214 PolarHBondContact O-N 2.74Å; I211-W214 PolarHBondContact O-N 2.78Å; W214-V218 HydrophobicContact CE3-CB 4.05Å; W214-V218 HydrophobicContact CE3-CG1 3.93Å; W214-V218 HydrophobicContact CE3-CG2 4.39Å; W214-V218 HydrophobicContact CZ3-CB 4.45Å; W214-V218 HydrophobicContact CZ3-CG1 3.83Å; W214-V218 WeakPolarHBondContact O-CB 3.28Å; W214-V218 PolarHBondContact O-N 3.37Å; W214-L219 HydrophobicContact CD2-CD1 4.2Å; W214-L219 HydrophobicContact CD2-CG 4.17Å; W214-L219 HydrophobicContact CG-CD1 4.48Å; W214-L219 HydrophobicContact CH2-CD2 4.04Å; W214-L219 HydrophobicContact CH2-CG 4.44Å; W214-L219 HydrophobicContact CZ2-CD1 3.79Å; W214-L219 HydrophobicContact CZ2-CD2 3.91Å; W214-L219 HydrophobicContact CZ2-CG 4.02Å; W214-L219 VanDerWaalsContact NE1-CD1 3.35Å; W214-L219 WeakPolarHBondContact O-CB 3.24Å; W214-L219 WeakPolarHBondContact O-CG 3.29Å; W214-L219 PolarHBondContact O-N 2.9Å; W214-P382 HydrophobicContact CZ2-CB 4.34Å; W214-F386 HydrophobicContact CD2-CB 3.97Å; W214-F386 HydrophobicContact CE3-CB 3.53Å; W214-F386 HydrophobicContact CE3-CG 4.03Å; W214-F386 HydrophobicContact CH2-CB 3.99Å; W214-F386 AromaticContact CH2-CD2 3.63Å; W214-F386 HydrophobicContact CH2-CD2 3.63Å; W214-F386 HydrophobicContact CH2-CE2 4.26Å; W214-F386 AromaticContact CH2-CG 3.81Å; W214-F386 HydrophobicContact CH2-CG 3.81Å; W214-F386 HydrophobicContact CZ2-CB 4.4Å; W214-F386 HydrophobicContact CZ2-CD2 4.31Å; W214-F386 HydrophobicContact CZ3-CB 3.53Å; W214-F386 AromaticContact CZ3-CD1 3.94Å; W214-F386 HydrophobicContact CZ3-CD1 3.94Å; W214-F386 AromaticContact CZ3-CD2 3.82Å; W214-F386 HydrophobicContact CZ3-CD2 3.82Å; W214-F386 AromaticContact CZ3-CG 3.49Å; W214-F386 HydrophobicContact CZ3-CG 3.49Å; W214-F386 VanDerWaalsContact CZ3-CG 3.49Å; W214-I387 HydrophobicContact CB-CG1 4.08Å; W214-I387 HydrophobicContact CG-CD1 4.22Å; W214-I387 HydrophobicContact CG-CG1 4.03Å
215	E	94.3	Very high	91.9	Very high	17 Å²	17	34.7 Å²	34.7	8%	0.079	18%	0.179	C	C	.	.	I	π-helix	trans	-75.5	-46.1	-172.7	-66.7	-178.2	-173.5	0	0	112.7	R207 I211 R220 L221	R207-E215 IonicContact CZ-OE1 3.93Å; R207-E215 IonicContact CZ-OE2 3.1Å; R207-E215 IonicContact NH1-OE2 3.48Å; R207-E215 PolarHBondContact NH1-OE2 2.89Å; R207-E215 IonicContact NH2-OE1 2.9Å; R207-E215 PolarHBondContact NH2-OE1 3.44Å; R207-E215 IonicContact NH2-OE2 2.77Å; R207-E215 PolarHBondContact NH2-OE2 2.95Å; I211-E215 HydrophobicContact CG2-CG 4.34Å; I211-E215 WeakPolarHBondContact O-CB 3.08Å; I211-E215 PolarHBondContact O-N 2.8Å; E215-R220 CarbonylContact O-C 3.56Å; E215-R220 VanDerWaalsContact O-CA 3.25Å; E215-R220 WeakPolarHBondContact O-CA 3.49Å; E215-R220 PolarHBondContact O-N 3.46Å; E215-L221 PolarHBondContact O-N 2.86Å
216	N	96.2	Very high	93.1	Very high	56 Å²	56	33 Å²	33	30%	0.299	17%	0.167	S	C	.	.	I	π-helix	trans	-90.9	-30.3	-171.1	-56.2	-14.6	0	0	0	112.9	W176 E212	W176-N216 HydrophobicContact CB-CB 4.21Å; W176-N216 WeakPolarHBondContact O-CB 3.36Å; W176-N216 PolarHBondContact O-ND2 3.34Å; W176-N216 VanDerWaalsContact O-ND2 3.12Å; E212-N216 WeakPolarHBondContact O-CA 3.36Å; E212-N216 WeakPolarHBondContact O-CB 3.33Å; E212-N216 PolarHBondContact O-N 3.11Å
217	K	96.5	Very high	94	Very high	39 Å²	39	33 Å²	33	17%	0.17	18%	0.175	C	C	.	.	I	π-helix	trans	-100.4	-49	-177.6	179.7	59.1	-173.8	173.1	0	113.5	Y157 W176 E212 F213 N232 E234	Y157-K217 WeakPolarHBondContact OH-CE 3.36Å; W176-K217 HydrophobicContact CB-CB 3.98Å; W176-K217 HydrophobicContact CD2-CB 3.77Å; W176-K217 HydrophobicContact CD2-CD 4.07Å; W176-K217 HydrophobicContact CD2-CG 3.9Å; W176-K217 HydrophobicContact CE3-CB 4.33Å; W176-K217 HydrophobicContact CE3-CD 3.72Å; W176-K217 HydrophobicContact CE3-CG 4Å; W176-K217 HydrophobicContact CG-CB 3.6Å; W176-K217 HydrophobicContact CG-CD 4.48Å; W176-K217 HydrophobicContact CG-CG 4.26Å; W176-K217 HydrophobicContact CZ3-CD 4.22Å; W176-K217 HydrophobicContact CZ3-CG 4.42Å; E212-K217 PolarHBondContact O-N 2.94Å; F213-K217 HydrophobicContact CD2-CB 4.06Å; F213-K217 HydrophobicContact CD2-CG 4.05Å; F213-K217 HydrophobicContact CE2-CB 4.44Å; F213-K217 HydrophobicContact CE2-CG 3.95Å; F213-K217 WeakPolarHBondContact O-CA 3.42Å; F213-K217 VanDerWaalsContact O-CB 3.29Å; F213-K217 WeakPolarHBondContact O-CB 3.45Å; F213-K217 PolarHBondContact O-N 2.86Å; K217-N232 PolarHBondContact O-ND2 2.72Å; K217-E234 IonicContact NZ-OE1 2.71Å; K217-E234 PolarHBondContact NZ-OE1 3.49Å; K217-E234 IonicContact NZ-OE2 3.78Å
218	V	97	Very high	94.4	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	18%	0.183	C	C	.	.	I	π-helix	trans	-78.9	-57.8	-176.7	-179.3	0	0	0	0	110.3	W154 Y157 Y158 F213 W214 N232 V235	W154-V218 HydrophobicContact CG-CG1 4.39Å; Y157-V218 HydrophobicContact CD1-CG1 4.45Å; Y157-V218 HydrophobicContact CD1-CG2 3.88Å; Y157-V218 HydrophobicContact CE1-CG2 3.57Å; Y158-V218 HydrophobicContact CD2-CG2 4.49Å; Y158-V218 HydrophobicContact CE2-CG1 4.37Å; Y158-V218 HydrophobicContact CE2-CG2 3.71Å; F213-V218 HydrophobicContact CD1-CG2 3.87Å; F213-V218 HydrophobicContact CE1-CG2 3.59Å; F213-V218 HydrophobicContact CZ-CG2 4.09Å; F213-V218 WeakPolarHBondContact O-CG2 3.47Å; F213-V218 PolarHBondContact O-N 3.3Å; W214-V218 HydrophobicContact CE3-CB 4.05Å; W214-V218 HydrophobicContact CE3-CG1 3.93Å; W214-V218 HydrophobicContact CE3-CG2 4.39Å; W214-V218 HydrophobicContact CZ3-CB 4.45Å; W214-V218 HydrophobicContact CZ3-CG1 3.83Å; W214-V218 WeakPolarHBondContact O-CB 3.28Å; W214-V218 PolarHBondContact O-N 3.37Å; V218-N232 PolarHBondContact O-ND2 2.84Å; V218-V235 HydrophobicContact CG1-CG2 4.42Å
219	L	95.8	Very high	94.7	Very high	11 Å²	11	34 Å²	34	6%	0.058	20%	0.2	C	C	.	.	I	π-helix	trans	-80.2	-35.6	-178.4	-63.1	-175.7	0	0	0	112.6	W154 W214 L221 M467	W154-L219 HydrophobicContact CZ2-CD2 3.8Å; W214-L219 HydrophobicContact CD2-CD1 4.2Å; W214-L219 HydrophobicContact CD2-CG 4.17Å; W214-L219 HydrophobicContact CG-CD1 4.48Å; W214-L219 HydrophobicContact CH2-CD2 4.04Å; W214-L219 HydrophobicContact CH2-CG 4.44Å; W214-L219 HydrophobicContact CZ2-CD1 3.79Å; W214-L219 HydrophobicContact CZ2-CD2 3.91Å; W214-L219 HydrophobicContact CZ2-CG 4.02Å; W214-L219 VanDerWaalsContact NE1-CD1 3.35Å; W214-L219 WeakPolarHBondContact O-CB 3.24Å; W214-L219 WeakPolarHBondContact O-CG 3.29Å; W214-L219 PolarHBondContact O-N 2.9Å; L219-L221 VanDerWaalsContact C-N 3.26Å; L219-L221 HydrophobicContact CB-CB 4.41Å; L219-M467 HydrophobicContact CD1-CB 4.15Å; L219-M467 HydrophobicContact CD1-CG 3.89Å; L219-M467 HydrophobicContact CD1-SD 3.98Å; L219-M467 HydrophobicContact CD2-CB 4.46Å; L219-M467 HydrophobicContact CD2-SD 4.05Å
220	R	96.2	Very high	94.9	Very high	107 Å²	107	36.5 Å²	36.5	40%	0.404	22%	0.221	S	C	.	.			trans	54.8	46	-169.3	-49.7	179	99.2	-171.6	6.4	110.7	E215 S222 D464	E215-R220 CarbonylContact O-C 3.56Å; E215-R220 VanDerWaalsContact O-CA 3.25Å; E215-R220 WeakPolarHBondContact O-CA 3.49Å; E215-R220 PolarHBondContact O-N 3.46Å; R220-S222 PolarHBondContact O-N 2.92Å; R220-D464 HydrophobicContact CB-CB 4.5Å; R220-D464 WeakPolarHBondContact CB-OD1 3.32Å; R220-D464 VanDerWaalsContact O-CA 3.23Å; R220-D464 WeakPolarHBondContact O-CA 3.27Å; R220-D464 WeakPolarHBondContact O-CB 3.25Å
221	L	93.9	Very high	95.1	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.225	24%	0.243	C	C	.	.			trans	-54.4	120.1	-164.8	-169	69.6	0	0	0	112.2	E215 L219 D464 M467 Y468 Y547	E215-L221 PolarHBondContact O-N 2.86Å; L219-L221 VanDerWaalsContact C-N 3.26Å; L219-L221 HydrophobicContact CB-CB 4.41Å; L221-D464 WeakPolarHBondContact CA-O 3.5Å; L221-M467 HydrophobicContact CD1-CB 3.79Å; L221-M467 HydrophobicContact CD1-CG 4.36Å; L221-Y468 HydrophobicContact CD1-CE2 3.9Å; L221-Y468 HydrophobicContact CG-CE2 4.5Å; L221-Y547 HydrophobicContact CD1-CE1 4.3Å; L221-Y547 HydrophobicContact CD2-CE1 3.8Å
222	S	95.2	Very high	95.5	Very high	19 Å²	19	39.1 Å²	39.1	13%	0.133	24%	0.235	C	C	.	.			trans	-77	176.3	172.8	78.2	0	0	0	0	111.6	R220 G224 V227 D464 G465 Y468	R220-S222 PolarHBondContact O-N 2.92Å; S222-G224 PolarHBondContact O-N 2.96Å; S222-G224 PolarHBondContact OG-N 2.98Å; S222-G224 PolarHBondContact OG-O 3.46Å; S222-G224 VanDerWaalsContact OG-O 3.04Å; S222-V227 WeakPolarHBondContact CB-O 3.47Å; S222-V227 PolarHBondContact OG-O 2.85Å; S222-D464 PolarHBondContact N-O 2.93Å; S222-G465 WeakPolarHBondContact OG-CA 3.37Å; S222-G465 PolarHBondContact OG-N 2.97Å; S222-Y468 PolarHBondContact O-OH 3.4Å; S222-Y468 VanDerWaalsContact O-OH 3.08Å
223	G	92.7	Very high	95.6	Very high	63 Å²	63	46.9 Å²	46.9	65%	0.649	26%	0.264	S	S	*	.	S	Bend	trans	-69.1	-15.7	179.4	0	0	0	0	0	115.3	Y551	G223-Y551 WeakPolarHBondContact O-CE2 3.07Å
224	G	94.3	Very high	95.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	171.7	176.5	-173.9	0	0	0	0	0	114.5	S222 E226 V227 Y468	S222-G224 PolarHBondContact O-N 2.96Å; S222-G224 PolarHBondContact OG-N 2.98Å; S222-G224 PolarHBondContact OG-O 3.46Å; S222-G224 VanDerWaalsContact OG-O 3.04Å; G224-E226 WeakPolarHBondContact CA-OE1 3.38Å; G224-E226 PolarHBondContact O-N 2.88Å; G224-V227 PolarHBondContact O-N 3.35Å; G224-V227 VanDerWaalsContact O-N 3.1Å; G224-Y468 VanDerWaalsContact C-CD2 3.44Å
225	L	95.2	Very high	95.8	Very high	18 Å²	18	48.5 Å²	48.5	9%	0.094	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-31.8	-177.9	-176	69.3	0	0	0	112.2	V227 Y468 V469 L472 Y551 Y553 P554 W556	L225-V227 VanDerWaalsContact C-N 3.25Å; L225-V227 PolarHBondContact O-N 2.84Å; L225-Y468 HydrophobicContact CB-CG 4.45Å; L225-V469 HydrophobicContact CD1-CG2 3.69Å; L225-L472 HydrophobicContact CD1-CD1 4.13Å; L225-L472 HydrophobicContact CD2-CD1 3.78Å; L225-Y551 WeakPolarHBondContact CB-OH 3.48Å; L225-Y551 PolarHBondContact N-OH 3.48Å; L225-Y553 HydrophobicContact CD2-CD1 4.01Å; L225-Y553 HydrophobicContact CD2-CE1 4.32Å; L225-P554 HydrophobicContact CD2-CG 4.4Å; L225-W556 HydrophobicContact CB-CH2 4.3Å; L225-W556 HydrophobicContact CD2-CE3 4.22Å; L225-W556 HydrophobicContact CD2-CH2 3.35Å; L225-W556 HydrophobicContact CD2-CZ2 4.03Å; L225-W556 HydrophobicContact CD2-CZ3 3.43Å; L225-W556 VanDerWaalsContact CD2-CZ3 3.43Å; L225-W556 HydrophobicContact CG-CH2 3.49Å; L225-W556 VanDerWaalsContact CG-CH2 3.49Å; L225-W556 HydrophobicContact CG-CZ2 4.22Å; L225-W556 HydrophobicContact CG-CZ3 4.01Å
226	E	94.9	Very high	96	Very high	104 Å²	104	48.9 Å²	48.9	49%	0.486	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.5	176.9	63.8	-70.2	159.6	0	0	114.2	G224 P228 Y551 W556	G224-E226 WeakPolarHBondContact CA-OE1 3.38Å; G224-E226 PolarHBondContact O-N 2.88Å; E226-P228 VanDerWaalsContact O-CD 3.28Å; E226-P228 WeakPolarHBondContact O-CD 3.3Å; E226-Y551 PolarHBondContact OE2-OH 3.45Å; E226-W556 HydrophobicContact CB-CZ2 4.32Å
227	V	95.6	Very high	96.1	Very high	72 Å²	72	50.8 Å²	50.8	44%	0.436	29%	0.285	S	S	.	.			trans	-112.5	87	177.3	-172	0	0	0	0	108.8	S222 G224 L225 G229	S222-V227 WeakPolarHBondContact CB-O 3.47Å; S222-V227 PolarHBondContact OG-O 2.85Å; G224-V227 PolarHBondContact O-N 3.35Å; G224-V227 VanDerWaalsContact O-N 3.1Å; L225-V227 VanDerWaalsContact C-N 3.25Å; L225-V227 PolarHBondContact O-N 2.84Å; V227-G229 VanDerWaalsContact C-N 3.26Å; V227-G229 PolarHBondContact O-N 2.86Å
228	P	93.8	Very high	96.2	Very high	78 Å²	78	49.5 Å²	49.5	51%	0.506	28%	0.281	S	S	.	.			trans	-63.9	-33.7	-178.1	24.2	-33.7	0	0	0	112.4	E226 T463 D464 G465	E226-P228 VanDerWaalsContact O-CD 3.28Å; E226-P228 WeakPolarHBondContact O-CD 3.3Å; P228-T463 WeakPolarHBondContact O-CB 3.49Å; P228-T463 PolarHBondContact O-OG1 3.23Å; P228-D464 PolarHBondContact O-N 3.19Å; P228-G465 PolarHBondContact O-N 2.97Å
229	G	95.6	Very high	96.3	Very high	43 Å²	43	49.4 Å²	49.4	44%	0.443	28%	0.281	S	S	.	.			trans	63.8	-154.2	-176.1	0	0	0	0	0	113.5	V227 D464	V227-G229 VanDerWaalsContact C-N 3.26Å; V227-G229 PolarHBondContact O-N 2.86Å; G229-D464 WeakPolarHBondContact CA-OD2 3.4Å
230	A	96.8	Very high	96.4	Very high	52 Å²	52	52.8 Å²	52.8	43%	0.43	30%	0.298	S	S	.	.			trans	-92.8	159.4	-175.9	0	0	0	0	0	112.4	T463 D464	A230-T463 CarbonylContact O-C 3.54Å; A230-T463 WeakPolarHBondContact O-CA 3.41Å; A230-D464 PolarHBondContact N-OD2 3.33Å; A230-D464 PolarHBondContact O-N 3.13Å
231	L	97.3	Very high	96.5	Very high	89 Å²	89	49.3 Å²	49.3	47%	0.466	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-73	129	171	-72.3	165.4	0	0	0	110.6	W233 L459 V462 T463	L231-W233 PolarHBondContact O-N 3.48Å; L231-W233 VanDerWaalsContact O-N 3.16Å; L231-L459 HydrophobicContact CD2-CB 4.39Å; L231-L459 VanDerWaalsContact CD2-O 3.23Å; L231-L459 WeakPolarHBondContact CD2-O 3.44Å; L231-V462 HydrophobicContact CD2-CG2 3.7Å; L231-T463 HydrophobicContact CD2-CG2 3.54Å; L231-T463 HydrophobicContact CG-CG2 4.13Å
232	N	97.4	Very high	96.8	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	28%	0.281	C	S	.	.			trans	-77.5	99.4	169.3	-171.7	-18.3	0	0	0	110.1	K217 V218 E234 V235 T236 V462	K217-N232 PolarHBondContact O-ND2 2.72Å; V218-N232 PolarHBondContact O-ND2 2.84Å; N232-E234 VanDerWaalsContact C-N 3.3Å; N232-E234 PolarHBondContact O-N 3.06Å; N232-E234 PolarHBondContact OD1-N 3.46Å; N232-V235 HydrophobicContact CB-CB 4.34Å; N232-V235 HydrophobicContact CB-CG2 4.4Å; N232-V235 WeakPolarHBondContact ND2-CG2 3.39Å; N232-V235 PolarHBondContact O-N 3.01Å; N232-T236 WeakPolarHBondContact O-CB 3.46Å; N232-T236 PolarHBondContact O-N 3.46Å; N232-T236 PolarHBondContact O-OG1 2.71Å; N232-V462 WeakPolarHBondContact CB-O 3.11Å; N232-V462 PolarHBondContact N-O 3.38Å
233	W	97.4	Very high	96.9	Very high	163 Å²	163	46.7 Å²	46.7	62%	0.617	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-33.2	-176.5	76.7	-89.6	0	0	0	113.4	L231 T236 L237	L231-W233 PolarHBondContact O-N 3.48Å; L231-W233 VanDerWaalsContact O-N 3.16Å; W233-T236 PolarHBondContact O-N 2.91Å; W233-L237 HydrophobicContact CE3-CD1 3.53Å; W233-L237 HydrophobicContact CE3-CG 4.23Å; W233-L237 HydrophobicContact CZ3-CD1 3.42Å; W233-L237 VanDerWaalsContact CZ3-CD1 3.42Å; W233-L237 WeakPolarHBondContact O-CG 3.14Å; W233-L237 PolarHBondContact O-N 2.86Å
234	E	97.8	Very high	97.2	Very high	36 Å²	36	46.8 Å²	46.8	17%	0.168	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-46.3	179.6	-67.5	-178.2	-135.3	0	0	110.4	Y157 K161 K217 N232 L237 C238	Y157-E234 HydrophobicContact CD2-CB 4.24Å; Y157-E234 HydrophobicContact CE2-CB 3.76Å; Y157-E234 VanDerWaalsContact CE2-OE2 3.32Å; Y157-E234 WeakPolarHBondContact CE2-OE2 3.19Å; Y157-E234 PolarHBondContact OH-OE2 3.04Å; K161-E234 IonicContact NZ-OE2 2.9Å; K161-E234 PolarHBondContact NZ-OE2 2.87Å; K217-E234 IonicContact NZ-OE1 2.71Å; K217-E234 PolarHBondContact NZ-OE1 3.49Å; K217-E234 IonicContact NZ-OE2 3.78Å; N232-E234 VanDerWaalsContact C-N 3.3Å; N232-E234 PolarHBondContact O-N 3.06Å; N232-E234 PolarHBondContact OD1-N 3.46Å; E234-L237 PolarHBondContact O-N 3.25Å; E234-C238 PolarHBondContact O-N 3.48Å
235	V	98.1	Very high	97.3	Very high	2 Å²	2	50 Å²	50	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-70.5	-34.5	176.8	-177.5	0	0	0	0	110.9	A153 Y157 V218 N232 L237 C238 L239 V462	A153-V235 HydrophobicContact CB-CG1 4.33Å; Y157-V235 HydrophobicContact CD2-CG2 4.34Å; V218-V235 HydrophobicContact CG1-CG2 4.42Å; N232-V235 HydrophobicContact CB-CB 4.34Å; N232-V235 HydrophobicContact CB-CG2 4.4Å; N232-V235 WeakPolarHBondContact ND2-CG2 3.39Å; N232-V235 PolarHBondContact O-N 3.01Å; V235-L237 VanDerWaalsContact C-N 3.28Å; V235-L237 PolarHBondContact O-N 3.47Å; V235-C238 WeakPolarHBondContact O-CB 3.47Å; V235-C238 PolarHBondContact O-N 3.48Å; V235-C238 VanDerWaalsContact O-N 3.14Å; V235-L239 WeakPolarHBondContact O-CB 3.32Å; V235-L239 PolarHBondContact O-N 3.18Å; V235-V462 HydrophobicContact CG1-CG1 3.94Å
236	T	98.5	Very high	97.4	Very high	25 Å²	25	49.2 Å²	49.2	15%	0.153	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-38	174.6	-56	0	0	0	0	111.7	N232 W233 L239 L240 F455 L459	N232-T236 WeakPolarHBondContact O-CB 3.46Å; N232-T236 PolarHBondContact O-N 3.46Å; N232-T236 PolarHBondContact O-OG1 2.71Å; W233-T236 PolarHBondContact O-N 2.91Å; T236-L239 WeakPolarHBondContact O-CB 3.31Å; T236-L239 PolarHBondContact O-N 2.93Å; T236-L240 WeakPolarHBondContact O-CB 3.32Å; T236-L240 PolarHBondContact O-N 3.48Å; T236-F455 HydrophobicContact CG2-CZ 4.32Å; T236-L459 HydrophobicContact CG2-CD2 3.94Å
237	L	98.5	Very high	97.6	Very high	97 Å²	97	46.8 Å²	46.8	51%	0.508	26%	0.264	S	S	.	.	H	α-helix	trans	-67.8	-40.3	173.9	-71.2	178.5	0	0	0	112.4	W233 E234 V235 L239 L240 A241	W233-L237 HydrophobicContact CE3-CD1 3.53Å; W233-L237 HydrophobicContact CE3-CG 4.23Å; W233-L237 HydrophobicContact CZ3-CD1 3.42Å; W233-L237 VanDerWaalsContact CZ3-CD1 3.42Å; W233-L237 WeakPolarHBondContact O-CG 3.14Å; W233-L237 PolarHBondContact O-N 2.86Å; E234-L237 PolarHBondContact O-N 3.25Å; V235-L237 VanDerWaalsContact C-N 3.28Å; V235-L237 PolarHBondContact O-N 3.47Å; L237-L239 VanDerWaalsContact C-N 3.35Å; L237-L240 PolarHBondContact O-N 2.7Å; L237-A241 WeakPolarHBondContact O-CB 3.18Å; L237-A241 PolarHBondContact O-N 2.78Å
238	C	98.6	Very high	97.6	Very high	12 Å²	12	48.2 Å²	48.2	8%	0.081	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-43.7	173.3	-69.6	0	0	0	0	111.6	A153 F156 E234 V235 A241 C242	A153-C238 HydrophobicContact CB-CB 4.43Å; A153-C238 WeakPolarHBondContact O-CB 3.46Å; F156-C238 HydrophobicContact CB-CB 4.17Å; F156-C238 HydrophobicContact CG-CB 4.5Å; E234-C238 PolarHBondContact O-N 3.48Å; V235-C238 WeakPolarHBondContact O-CB 3.47Å; V235-C238 PolarHBondContact O-N 3.48Å; V235-C238 VanDerWaalsContact O-N 3.14Å; C238-A241 WeakPolarHBondContact O-CB 3.29Å; C238-A241 PolarHBondContact O-N 3.37Å; C238-C242 PolarHBondContact O-N 3.49Å; C238-C242 PolarHBondContact O-SG 3.14Å
239	L	98.6	Very high	97.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-47.3	174.8	173.4	65.8	0	0	0	111.6	I149 M150 A153 V235 T236 L237 A241 C242 W243 F455 D458 V462	I149-L239 HydrophobicContact CG2-CD1 3.58Å; M150-L239 HydrophobicContact SD-CD1 4.16Å; M150-L239 HydrophobicContact SD-CD2 4.44Å; A153-L239 HydrophobicContact CB-CB 4.02Å; A153-L239 HydrophobicContact CB-CD1 4.46Å; V235-L239 WeakPolarHBondContact O-CB 3.32Å; V235-L239 PolarHBondContact O-N 3.18Å; T236-L239 WeakPolarHBondContact O-CB 3.31Å; T236-L239 PolarHBondContact O-N 2.93Å; L237-L239 VanDerWaalsContact C-N 3.35Å; L239-A241 VanDerWaalsContact C-N 3.33Å; L239-A241 PolarHBondContact O-N 3.25Å; L239-C242 PolarHBondContact O-N 2.97Å; L239-W243 PolarHBondContact O-N 2.91Å; L239-F455 HydrophobicContact CD2-CD2 3.96Å; L239-F455 HydrophobicContact CD2-CE2 3.91Å; L239-F455 HydrophobicContact CG-CD2 3.89Å; L239-F455 HydrophobicContact CG-CE2 3.94Å; L239-D458 HydrophobicContact CD1-CB 3.99Å; L239-D458 HydrophobicContact CD2-CB 3.57Å; L239-D458 HydrophobicContact CG-CB 4.37Å; L239-V462 HydrophobicContact CD2-CG1 3.83Å
240	L	98.5	Very high	97.6	Very high	82 Å²	82	43.2 Å²	43.2	43%	0.429	22%	0.224	S	C	.	.	H	α-helix	trans	-59.6	-44.6	175.9	179.9	63.1	0	0	0	111.2	T236 L237 C242 W243 V244 F455	T236-L240 WeakPolarHBondContact O-CB 3.32Å; T236-L240 PolarHBondContact O-N 3.48Å; L237-L240 PolarHBondContact O-N 2.7Å; L240-C242 PolarHBondContact O-N 2.91Å; L240-W243 PolarHBondContact O-N 3.28Å; L240-V244 HydrophobicContact CD1-CG2 4.38Å; L240-V244 WeakPolarHBondContact O-CB 3.42Å; L240-V244 VanDerWaalsContact O-CG2 3.26Å; L240-V244 WeakPolarHBondContact O-CG2 3.31Å; L240-V244 PolarHBondContact O-N 3.44Å; L240-F455 HydrophobicContact CB-CE2 3.91Å; L240-F455 HydrophobicContact CB-CZ 4.43Å; L240-F455 HydrophobicContact CD1-CE2 4.14Å; L240-F455 HydrophobicContact CD1-CZ 4.34Å
241	A	98.5	Very high	97.5	Very high	33 Å²	33	44.1 Å²	44.1	27%	0.273	22%	0.216	S	C	.	.	H	α-helix	trans	-60.8	-43.3	177	0	0	0	0	0	111.9	F156 L237 C238 L239 V244 L245	F156-A241 HydrophobicContact CE2-CB 4.03Å; F156-A241 HydrophobicContact CZ-CB 4.26Å; L237-A241 WeakPolarHBondContact O-CB 3.18Å; L237-A241 PolarHBondContact O-N 2.78Å; C238-A241 WeakPolarHBondContact O-CB 3.29Å; C238-A241 PolarHBondContact O-N 3.37Å; L239-A241 VanDerWaalsContact C-N 3.33Å; L239-A241 PolarHBondContact O-N 3.25Å; A241-V244 PolarHBondContact O-N 3.34Å; A241-L245 WeakPolarHBondContact O-CG 3.46Å; A241-L245 PolarHBondContact O-N 3.13Å
242	C	98.6	Very high	97.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-47.7	175.5	-70.9	0	0	0	0	112.1	I149 C238 L239 L240 V244 L245 V246	I149-C242 HydrophobicContact CD1-CB 4.02Å; I149-C242 HydrophobicContact CG1-CB 4.07Å; C238-C242 PolarHBondContact O-N 3.49Å; C238-C242 PolarHBondContact O-SG 3.14Å; L239-C242 PolarHBondContact O-N 2.97Å; L240-C242 PolarHBondContact O-N 2.91Å; C242-V244 VanDerWaalsContact C-N 3.35Å; C242-V244 PolarHBondContact O-N 2.68Å; C242-L245 WeakPolarHBondContact O-CB 3.28Å; C242-L245 PolarHBondContact O-N 3.4Å; C242-V246 WeakPolarHBondContact O-CG2 3.48Å; C242-V246 PolarHBondContact O-N 3.46Å
243	W	98.4	Very high	97.1	Very high	7 Å²	7	44.6 Å²	44.6	3%	0.027	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-37.3	177.6	-84.9	113.5	0	0	0	113.2	I149 L239 L240 L245 V246 Y247 V422 C451 C454 F455 D458	I149-W243 HydrophobicContact CB-CZ2 4.25Å; I149-W243 HydrophobicContact CD1-CD2 3.41Å; I149-W243 VanDerWaalsContact CD1-CD2 3.41Å; I149-W243 HydrophobicContact CD1-CE3 3.81Å; I149-W243 HydrophobicContact CD1-CG 3.75Å; I149-W243 HydrophobicContact CD1-CH2 4.08Å; I149-W243 HydrophobicContact CD1-CZ2 3.69Å; I149-W243 HydrophobicContact CD1-CZ3 4.14Å; I149-W243 HydrophobicContact CG2-CZ2 3.88Å; L239-W243 PolarHBondContact O-N 2.91Å; L240-W243 PolarHBondContact O-N 3.28Å; W243-L245 VanDerWaalsContact C-N 3.35Å; W243-V246 HydrophobicContact CE3-CB 4.28Å; W243-V246 HydrophobicContact CE3-CG1 4.22Å; W243-V246 HydrophobicContact CZ3-CG1 4.11Å; W243-V246 PolarHBondContact O-N 3.33Å; W243-Y247 WeakPolarHBondContact O-CB 3.49Å; W243-Y247 PolarHBondContact O-N 2.92Å; W243-V422 HydrophobicContact CZ3-CG2 4.13Å; W243-C451 HydrophobicContact CD2-CB 4.21Å; W243-C451 HydrophobicContact CE3-CB 3.56Å; W243-C451 HydrophobicContact CZ3-CB 4.1Å; W243-C454 HydrophobicContact CH2-CB 3.48Å; W243-C454 VanDerWaalsContact CH2-CB 3.48Å; W243-C454 HydrophobicContact CZ2-CB 3.18Å; W243-C454 HydrophobicContact CZ3-CB 4.39Å; W243-F455 AromaticContact CD1-CD2 3.78Å; W243-F455 HydrophobicContact CG-CB 4.37Å; W243-D458 PolarHBondContact NE1-OD2 3.14Å
244	V	98.3	Very high	96.8	Very high	66 Å²	66	36.8 Å²	36.8	40%	0.4	19%	0.185	S	C	.	.	H	α-helix	trans	-62.9	-42.3	174.2	170	0	0	0	0	111	L240 A241 C242 Y247 F248	L240-V244 HydrophobicContact CD1-CG2 4.38Å; L240-V244 WeakPolarHBondContact O-CB 3.42Å; L240-V244 VanDerWaalsContact O-CG2 3.26Å; L240-V244 WeakPolarHBondContact O-CG2 3.31Å; L240-V244 PolarHBondContact O-N 3.44Å; A241-V244 PolarHBondContact O-N 3.34Å; C242-V244 VanDerWaalsContact C-N 3.35Å; C242-V244 PolarHBondContact O-N 2.68Å; V244-Y247 PolarHBondContact O-N 3.06Å; V244-F248 HydrophobicContact CG1-CD2 3.75Å; V244-F248 HydrophobicContact CG1-CE2 3.59Å; V244-F248 WeakPolarHBondContact O-CD2 3.34Å; V244-F248 PolarHBondContact O-N 2.99Å; V244-F248 VanDerWaalsContact O-N 3.14Å
245	L	97.2	Very high	96.4	Very high	68 Å²	68	40 Å²	40	36%	0.356	20%	0.198	S	C	.	.	H	α-helix	trans	-61.6	-48.7	174.3	-70.7	173.1	0	0	0	111.3	F156 A241 C242 W243 Y247 F248 C249 L415	F156-L245 HydrophobicContact CE2-CD1 4.1Å; A241-L245 WeakPolarHBondContact O-CG 3.46Å; A241-L245 PolarHBondContact O-N 3.13Å; C242-L245 WeakPolarHBondContact O-CB 3.28Å; C242-L245 PolarHBondContact O-N 3.4Å; W243-L245 VanDerWaalsContact C-N 3.35Å; L245-Y247 VanDerWaalsContact C-N 3.33Å; L245-Y247 PolarHBondContact O-N 3.39Å; L245-F248 PolarHBondContact O-N 3.08Å; L245-C249 WeakPolarHBondContact O-CB 3.24Å; L245-C249 PolarHBondContact O-N 3.25Å; L245-C249 PolarHBondContact O-SG 3.26Å; L245-L415 HydrophobicContact CB-CD2 4.23Å; L245-L415 HydrophobicContact CD1-CD1 4.32Å
246	V	97.8	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.8	-45.8	177.6	171.5	0	0	0	0	111.3	I149 C242 W243 F248 C249 V250 L415 Q418 F419 V422	I149-V246 HydrophobicContact CD1-CG2 4.19Å; C242-V246 WeakPolarHBondContact O-CG2 3.48Å; C242-V246 PolarHBondContact O-N 3.46Å; W243-V246 HydrophobicContact CE3-CB 4.28Å; W243-V246 HydrophobicContact CE3-CG1 4.22Å; W243-V246 HydrophobicContact CZ3-CG1 4.11Å; W243-V246 PolarHBondContact O-N 3.33Å; V246-F248 PolarHBondContact O-N 3.11Å; V246-C249 PolarHBondContact O-N 3.48Å; V246-V250 HydrophobicContact CG1-CG2 4.4Å; V246-V250 WeakPolarHBondContact O-CB 3.38Å; V246-V250 WeakPolarHBondContact O-CG2 3.28Å; V246-V250 PolarHBondContact O-N 2.82Å; V246-L415 HydrophobicContact CG2-CD2 4.06Å; V246-Q418 HydrophobicContact CG2-CB 4.03Å; V246-F419 HydrophobicContact CB-CD1 4.41Å; V246-F419 HydrophobicContact CB-CE1 4.4Å; V246-F419 HydrophobicContact CG1-CD1 4.45Å; V246-F419 HydrophobicContact CG2-CD1 4.08Å; V246-F419 HydrophobicContact CG2-CE1 3.95Å; V246-V422 HydrophobicContact CG1-CB 4.32Å; V246-V422 HydrophobicContact CG1-CG2 3.89Å
247	Y	97.6	Very high	95.6	Very high	53 Å²	53	39.9 Å²	39.9	21%	0.208	20%	0.199	C	C	.	.	H	α-helix	trans	-54.8	-55.9	177.1	174.3	-105	0	0	0	111.7	W243 V244 L245 C249 V250 W251 E444 V447 A448	W243-Y247 WeakPolarHBondContact O-CB 3.49Å; W243-Y247 PolarHBondContact O-N 2.92Å; V244-Y247 PolarHBondContact O-N 3.06Å; L245-Y247 VanDerWaalsContact C-N 3.33Å; L245-Y247 PolarHBondContact O-N 3.39Å; Y247-C249 VanDerWaalsContact C-N 3.28Å; Y247-C249 PolarHBondContact O-N 3.39Å; Y247-V250 PolarHBondContact O-N 3.03Å; Y247-W251 HydrophobicContact CD1-CE3 4.22Å; Y247-W251 HydrophobicContact CD2-CB 4.42Å; Y247-W251 HydrophobicContact CE1-CD2 4.11Å; Y247-W251 AromaticContact CE1-CE3 3.32Å; Y247-W251 HydrophobicContact CE1-CE3 3.32Å; Y247-W251 AromaticContact CE1-CZ3 3.77Å; Y247-W251 HydrophobicContact CE1-CZ3 3.77Å; Y247-W251 HydrophobicContact CE2-CB 4.11Å; Y247-W251 HydrophobicContact CE2-CE3 4.48Å; Y247-W251 AromaticContact CZ-CE3 3.5Å; Y247-W251 VanDerWaalsContact CZ-CE3 3.5Å; Y247-W251 WeakPolarHBondContact O-CB 3.49Å; Y247-W251 PolarHBondContact O-N 3.07Å; Y247-E444 WeakPolarHBondContact CE2-O 3.48Å; Y247-V447 HydrophobicContact CD2-CB 4.26Å; Y247-V447 HydrophobicContact CD2-CG1 3.82Å; Y247-V447 HydrophobicContact CE2-CB 4.36Å; Y247-V447 HydrophobicContact CE2-CG1 4.39Å; Y247-A448 HydrophobicContact CD2-CB 4.19Å; Y247-A448 HydrophobicContact CE2-CB 3.61Å
248	F	96	Very high	95.2	Very high	103 Å²	103	35.3 Å²	35.3	45%	0.452	18%	0.175	S	C	.	.	H	α-helix	trans	-68.9	-25.7	-176.9	-73.4	-59.4	0	0	0	113.6	V244 L245 V246 W251	V244-F248 HydrophobicContact CG1-CD2 3.75Å; V244-F248 HydrophobicContact CG1-CE2 3.59Å; V244-F248 WeakPolarHBondContact O-CD2 3.34Å; V244-F248 PolarHBondContact O-N 2.99Å; V244-F248 VanDerWaalsContact O-N 3.14Å; L245-F248 PolarHBondContact O-N 3.08Å; V246-F248 PolarHBondContact O-N 3.11Å; F248-W251 HydrophobicContact CD1-CD2 4.01Å; F248-W251 AromaticContact CD1-CE2 3.75Å; F248-W251 HydrophobicContact CD1-CE3 4.01Å; F248-W251 AromaticContact CD1-CH2 3.52Å; F248-W251 HydrophobicContact CD1-CH2 3.52Å; F248-W251 AromaticContact CD1-CZ2 3.54Å; F248-W251 HydrophobicContact CD1-CZ2 3.54Å; F248-W251 AromaticContact CD1-CZ3 3.75Å; F248-W251 HydrophobicContact CD1-CZ3 3.75Å; F248-W251 HydrophobicContact CE1-CE3 4.17Å; F248-W251 AromaticContact CE1-CH2 3.43Å; F248-W251 HydrophobicContact CE1-CH2 3.43Å; F248-W251 VanDerWaalsContact CE1-CH2 3.43Å; F248-W251 AromaticContact CE1-CZ2 3.96Å; F248-W251 HydrophobicContact CE1-CZ2 3.96Å; F248-W251 AromaticContact CE1-CZ3 3.54Å; F248-W251 HydrophobicContact CE1-CZ3 3.54Å; F248-W251 PolarHBondContact O-NE1 3.48Å
249	C	95.3	Very high	94.8	Very high	15 Å²	15	41.7 Å²	41.7	10%	0.101	20%	0.201	C	C	.	.	H	α-helix	trans	-70.9	-46.7	174.6	-66.6	0	0	0	0	110.8	L245 V246 Y247 S256 I260 F419	L245-C249 WeakPolarHBondContact O-CB 3.24Å; L245-C249 PolarHBondContact O-N 3.25Å; L245-C249 PolarHBondContact O-SG 3.26Å; V246-C249 PolarHBondContact O-N 3.48Å; Y247-C249 VanDerWaalsContact C-N 3.28Å; Y247-C249 PolarHBondContact O-N 3.39Å; C249-S256 WeakPolarHBondContact O-CB 3.42Å; C249-S256 PolarHBondContact O-OG 2.91Å; C249-I260 HydrophobicContact CB-CD1 3.83Å; C249-F419 HydrophobicContact CB-CD1 3.74Å; C249-F419 HydrophobicContact CB-CD2 4.1Å; C249-F419 HydrophobicContact CB-CE1 3.51Å; C249-F419 HydrophobicContact CB-CE2 3.88Å; C249-F419 HydrophobicContact CB-CG 4.04Å; C249-F419 HydrophobicContact CB-CZ 3.58Å; C249-F419 WeakPolarHBondContact SG-CZ 3.23Å
250	V	95.3	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-85.8	-39.2	-171.4	179.8	0	0	0	0	112.4	V246 Y247 K252 G253 F419 V422 E423 R443 V447	V246-V250 HydrophobicContact CG1-CG2 4.4Å; V246-V250 WeakPolarHBondContact O-CB 3.38Å; V246-V250 WeakPolarHBondContact O-CG2 3.28Å; V246-V250 PolarHBondContact O-N 2.82Å; Y247-V250 PolarHBondContact O-N 3.03Å; V250-K252 PolarHBondContact O-N 2.66Å; V250-G253 PolarHBondContact O-N 3.17Å; V250-F419 HydrophobicContact CG2-CB 4.01Å; V250-F419 HydrophobicContact CG2-CD1 4.31Å; V250-F419 HydrophobicContact CG2-CG 4.45Å; V250-F419 WeakPolarHBondContact CG2-O 3.03Å; V250-V422 HydrophobicContact CG1-CG1 4.23Å; V250-V422 HydrophobicContact CG2-CB 4.49Å; V250-E423 HydrophobicContact CG1-CB 4.43Å; V250-R443 VanDerWaalsContact O-CZ 3.28Å; V250-R443 PolarHBondContact O-NH1 3.31Å; V250-R443 PolarHBondContact O-NH2 3.13Å; V250-R443 VanDerWaalsContact O-NH2 3.16Å; V250-V447 HydrophobicContact CB-CG1 4.32Å; V250-V447 HydrophobicContact CG1-CG1 4.34Å; V250-V447 HydrophobicContact CG1-CG2 4.25Å
251	W	94.5	Very high	94.4	Very high	72 Å²	72	40.2 Å²	40.2	27%	0.273	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-25.6	-165.1	70.7	-24.1	0	0	0	118	Y247 F248 R443 E444	Y247-W251 HydrophobicContact CD1-CE3 4.22Å; Y247-W251 HydrophobicContact CD2-CB 4.42Å; Y247-W251 HydrophobicContact CE1-CD2 4.11Å; Y247-W251 AromaticContact CE1-CE3 3.32Å; Y247-W251 HydrophobicContact CE1-CE3 3.32Å; Y247-W251 AromaticContact CE1-CZ3 3.77Å; Y247-W251 HydrophobicContact CE1-CZ3 3.77Å; Y247-W251 HydrophobicContact CE2-CB 4.11Å; Y247-W251 HydrophobicContact CE2-CE3 4.48Å; Y247-W251 AromaticContact CZ-CE3 3.5Å; Y247-W251 VanDerWaalsContact CZ-CE3 3.5Å; Y247-W251 WeakPolarHBondContact O-CB 3.49Å; Y247-W251 PolarHBondContact O-N 3.07Å; F248-W251 HydrophobicContact CD1-CD2 4.01Å; F248-W251 AromaticContact CD1-CE2 3.75Å; F248-W251 HydrophobicContact CD1-CE3 4.01Å; F248-W251 AromaticContact CD1-CH2 3.52Å; F248-W251 HydrophobicContact CD1-CH2 3.52Å; F248-W251 AromaticContact CD1-CZ2 3.54Å; F248-W251 HydrophobicContact CD1-CZ2 3.54Å; F248-W251 AromaticContact CD1-CZ3 3.75Å; F248-W251 HydrophobicContact CD1-CZ3 3.75Å; F248-W251 HydrophobicContact CE1-CE3 4.17Å; F248-W251 AromaticContact CE1-CH2 3.43Å; F248-W251 HydrophobicContact CE1-CH2 3.43Å; F248-W251 VanDerWaalsContact CE1-CH2 3.43Å; F248-W251 AromaticContact CE1-CZ2 3.96Å; F248-W251 HydrophobicContact CE1-CZ2 3.96Å; F248-W251 AromaticContact CE1-CZ3 3.54Å; F248-W251 HydrophobicContact CE1-CZ3 3.54Å; F248-W251 PolarHBondContact O-NE1 3.48Å; W251-R443 PolarHBondContact O-NH1 2.98Å; W251-E444 HydrophobicContact CB-CG 4.29Å; W251-E444 HydrophobicContact CE3-CG 4.44Å
252	K	92.7	Very high	94.2	Very high	102 Å²	102	42.1 Å²	42.1	44%	0.443	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	11.9	-178.7	-69.8	-67.9	176.5	-166.5	0	114.4	V250 E444	V250-K252 PolarHBondContact O-N 2.66Å; K252-E444 IonicContact NZ-OE1 2.71Å; K252-E444 PolarHBondContact NZ-OE1 2.97Å
253	G	92.2	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.217	C	C	.	.			trans	90	-175.2	174.8	0	0	0	0	0	113.2	V250 K255 S256 T257 R443	V250-G253 PolarHBondContact O-N 3.17Å; G253-K255 PolarHBondContact O-N 3.24Å; G253-S256 WeakPolarHBondContact O-CB 3.35Å; G253-S256 PolarHBondContact O-N 2.89Å; G253-T257 PolarHBondContact O-N 3.28Å; G253-T257 VanDerWaalsContact O-N 3.17Å; G253-T257 PolarHBondContact O-OG1 2.99Å; G253-R443 VanDerWaalsContact CA-NH2 3.34Å
254	V	92	Very high	94	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.3	-23.3	176.9	-67.9	0	0	0	0	113.4	E53 W55 S256 G258 Y330 E423	E53-V254 HydrophobicContact CB-CG2 4.49Å; E53-V254 HydrophobicContact CG-CG2 3.86Å; W55-V254 HydrophobicContact CD2-CB 4.32Å; W55-V254 HydrophobicContact CE3-CB 3.81Å; W55-V254 HydrophobicContact CE3-CG2 4.47Å; W55-V254 HydrophobicContact CH2-CB 3.68Å; W55-V254 HydrophobicContact CH2-CG1 3.55Å; W55-V254 HydrophobicContact CZ2-CB 4.18Å; W55-V254 HydrophobicContact CZ2-CG1 3.82Å; W55-V254 HydrophobicContact CZ3-CB 3.49Å; W55-V254 VanDerWaalsContact CZ3-CB 3.49Å; W55-V254 HydrophobicContact CZ3-CG1 3.94Å; V254-S256 VanDerWaalsContact C-N 3.35Å; V254-G258 WeakPolarHBondContact O-CA 3.48Å; V254-G258 PolarHBondContact O-N 3.2Å; V254-Y330 HydrophobicContact CG1-CD1 4.12Å; V254-Y330 HydrophobicContact CG1-CD2 3.47Å; V254-Y330 VanDerWaalsContact CG1-CD2 3.47Å; V254-Y330 HydrophobicContact CG1-CE1 4.3Å; V254-Y330 HydrophobicContact CG1-CE2 3.66Å; V254-Y330 HydrophobicContact CG1-CG 3.74Å; V254-Y330 HydrophobicContact CG2-CD1 3.95Å; V254-Y330 HydrophobicContact CG2-CE1 4.39Å; V254-Y330 HydrophobicContact CG2-CG 4.13Å; V254-E423 HydrophobicContact CG1-CG 4.33Å
255	K	88.9	Confident	93.8	Very high	102 Å²	102	44.4 Å²	44.4	44%	0.443	20%	0.2	S	C	.	.	H	α-helix	trans	-68.8	-28.8	172.9	-76.2	-173.4	-175.6	134.2	0	114.4	E53 T56 G253 K259	E53-K255 WeakPolarHBondContact OE1-CD 3.26Å; E53-K255 WeakPolarHBondContact OE1-CE 3.4Å; E53-K255 WeakPolarHBondContact OE1-CG 3.33Å; E53-K255 IonicContact OE1-NZ 2.72Å; E53-K255 PolarHBondContact OE1-NZ 3.41Å; T56-K255 HydrophobicContact CG2-CD 4.37Å; T56-K255 HydrophobicContact CG2-CG 3.86Å; G253-K255 PolarHBondContact O-N 3.24Å; K255-K259 WeakPolarHBondContact O-CG 3.38Å
256	S	89.3	Confident	93.7	Very high	25 Å²	25	43.8 Å²	43.8	18%	0.175	20%	0.199	C	C	.	.	H	α-helix	trans	-84.8	-54.4	175.7	179.9	0	0	0	0	109.7	C249 G253 V254 G258 K259 I260	C249-S256 WeakPolarHBondContact O-CB 3.42Å; C249-S256 PolarHBondContact O-OG 2.91Å; G253-S256 WeakPolarHBondContact O-CB 3.35Å; G253-S256 PolarHBondContact O-N 2.89Å; V254-S256 VanDerWaalsContact C-N 3.35Å; S256-G258 VanDerWaalsContact C-N 3.3Å; S256-G258 PolarHBondContact O-N 3.3Å; S256-K259 PolarHBondContact O-N 2.93Å; S256-I260 PolarHBondContact O-N 3.19Å
257	T	90.6	Very high	93.6	Very high	1 Å²	1	46 Å²	46	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-51.7	-50.5	177.3	-51.1	0	0	0	0	111	G253 K259 I260 V261 F419	G253-T257 PolarHBondContact O-N 3.28Å; G253-T257 VanDerWaalsContact O-N 3.17Å; G253-T257 PolarHBondContact O-OG1 2.99Å; T257-K259 PolarHBondContact O-N 2.89Å; T257-I260 PolarHBondContact O-N 3.43Å; T257-V261 HydrophobicContact CG2-CG1 4.05Å; T257-V261 WeakPolarHBondContact O-CG1 3.34Å; T257-V261 WeakPolarHBondContact O-CG2 3.3Å; T257-V261 PolarHBondContact O-N 2.77Å; T257-F419 HydrophobicContact CG2-CB 4.21Å
258	G	89.3	Confident	93.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-23.2	-178.8	0	0	0	0	0	115.1	V254 S256 V261 Y262	V254-G258 WeakPolarHBondContact O-CA 3.48Å; V254-G258 PolarHBondContact O-N 3.2Å; S256-G258 VanDerWaalsContact C-N 3.3Å; S256-G258 PolarHBondContact O-N 3.3Å; G258-V261 WeakPolarHBondContact O-CG2 3.26Å; G258-Y262 WeakPolarHBondContact O-CD2 3.43Å; G258-Y262 VanDerWaalsContact O-CE2 3.24Å; G258-Y262 WeakPolarHBondContact O-CE2 3.46Å
259	K	91.3	Very high	93.6	Very high	147 Å²	147	41.6 Å²	41.6	64%	0.639	19%	0.19	S	C	*	.	H	α-helix	trans	-86.6	-38.6	175.1	-67.8	175.6	-173.4	176.5	0	112.3	K255 S256 T257	K255-K259 WeakPolarHBondContact O-CG 3.38Å; S256-K259 PolarHBondContact O-N 2.93Å; T257-K259 PolarHBondContact O-N 2.89Å
260	I	93.8	Very high	93.7	Very high	49 Å²	49	44.9 Å²	44.9	25%	0.251	21%	0.209	S	C	.	.	H	α-helix	trans	-68.7	-41.3	-177	-65.2	169.1	0	0	0	110	C249 S256 T257 Y262 F263 T264 F419	C249-I260 HydrophobicContact CB-CD1 3.83Å; S256-I260 PolarHBondContact O-N 3.19Å; T257-I260 PolarHBondContact O-N 3.43Å; I260-Y262 PolarHBondContact O-N 3.37Å; I260-Y262 VanDerWaalsContact O-N 3.08Å; I260-F263 PolarHBondContact O-N 3.41Å; I260-T264 HydrophobicContact CG2-CG2 3.88Å; I260-T264 PolarHBondContact O-N 2.84Å; I260-T264 PolarHBondContact O-OG1 3.46Å; I260-F419 HydrophobicContact CG2-CE2 3.95Å
261	V	94.5	Very high	93.8	Very high	1 Å²	1	45 Å²	45	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-23.3	179.8	-63.4	0	0	0	0	114.3	M63 T257 G258 F263 T264 A265	M63-V261 HydrophobicContact CB-CB 4.41Å; M63-V261 HydrophobicContact CB-CG2 3.82Å; T257-V261 HydrophobicContact CG2-CG1 4.05Å; T257-V261 WeakPolarHBondContact O-CG1 3.34Å; T257-V261 WeakPolarHBondContact O-CG2 3.3Å; T257-V261 PolarHBondContact O-N 2.77Å; G258-V261 WeakPolarHBondContact O-CG2 3.26Å; V261-F263 VanDerWaalsContact C-N 3.26Å; V261-F263 PolarHBondContact O-N 3.33Å; V261-T264 VanDerWaalsContact CA-OG1 3.25Å; V261-T264 WeakPolarHBondContact CA-OG1 3.46Å; V261-A265 WeakPolarHBondContact O-CB 3.46Å; V261-A265 PolarHBondContact O-N 3.31Å
262	Y	94.6	Very high	93.8	Very high	74 Å²	74	41.7 Å²	41.7	29%	0.29	20%	0.197	S	C	.	.	H	α-helix	trans	-61.8	-35.8	174.9	-84.8	-86.1	0	0	0	112.8	M59 D60 M63 G258 I260 T266	M59-Y262 VanDerWaalsContact CB-OH 3.25Å; M59-Y262 WeakPolarHBondContact CB-OH 3.31Å; M59-Y262 HydrophobicContact CG-CE1 3.76Å; M59-Y262 VanDerWaalsContact CG-OH 3.27Å; M59-Y262 WeakPolarHBondContact CG-OH 3.28Å; D60-Y262 WeakPolarHBondContact OD1-CE2 3.27Å; D60-Y262 PolarHBondContact OD1-OH 2.67Å; M63-Y262 HydrophobicContact CG-CD1 4.4Å; M63-Y262 HydrophobicContact CG-CE1 4.34Å; G258-Y262 WeakPolarHBondContact O-CD2 3.43Å; G258-Y262 VanDerWaalsContact O-CE2 3.24Å; G258-Y262 WeakPolarHBondContact O-CE2 3.46Å; I260-Y262 PolarHBondContact O-N 3.37Å; I260-Y262 VanDerWaalsContact O-N 3.08Å; Y262-T266 WeakPolarHBondContact O-CB 3.02Å; Y262-T266 WeakPolarHBondContact O-CG2 3.29Å; Y262-T266 PolarHBondContact O-OG1 3.46Å
263	F	96.1	Very high	94.1	Very high	109 Å²	109	40.5 Å²	40.5	48%	0.478	20%	0.199	S	C	.	.	H	α-helix	trans	-85.9	-51	175.2	173	-104	0	0	0	110.3	I260 V261 A265 T266 F267 F408 L412	I260-F263 PolarHBondContact O-N 3.41Å; V261-F263 VanDerWaalsContact C-N 3.26Å; V261-F263 PolarHBondContact O-N 3.33Å; F263-A265 VanDerWaalsContact C-N 3.34Å; F263-A265 PolarHBondContact O-N 3.09Å; F263-T266 PolarHBondContact O-N 3.42Å; F263-T266 PolarHBondContact O-OG1 3.18Å; F263-F267 HydrophobicContact CD2-CB 4.35Å; F263-F267 HydrophobicContact CE2-CB 4.01Å; F263-F267 AromaticContact CE2-CD2 3.7Å; F263-F267 HydrophobicContact CE2-CD2 3.7Å; F263-F267 HydrophobicContact CE2-CE2 4.48Å; F263-F267 HydrophobicContact CE2-CG 4.03Å; F263-F267 HydrophobicContact CZ-CB 4.18Å; F263-F267 AromaticContact CZ-CD2 3.95Å; F263-F267 HydrophobicContact CZ-CD2 3.95Å; F263-F267 HydrophobicContact CZ-CG 4.01Å; F263-F267 VanDerWaalsContact O-CB 3.24Å; F263-F267 WeakPolarHBondContact O-CB 3.48Å; F263-F267 PolarHBondContact O-N 2.77Å; F263-F408 HydrophobicContact CE1-CE1 4.45Å; F263-F408 HydrophobicContact CE1-CZ 4.09Å; F263-F408 HydrophobicContact CZ-CE1 4.11Å; F263-F408 HydrophobicContact CZ-CZ 4.12Å; F263-L412 HydrophobicContact CE1-CD1 3.93Å; F263-L412 HydrophobicContact CZ-CD1 4.38Å
264	T	96.1	Very high	94.3	Very high	8 Å²	8	43.4 Å²	43.4	5%	0.049	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-32.5	-170.5	52.7	0	0	0	0	112.9	I260 V261 P268 L412 D416	I260-T264 HydrophobicContact CG2-CG2 3.88Å; I260-T264 PolarHBondContact O-N 2.84Å; I260-T264 PolarHBondContact O-OG1 3.46Å; V261-T264 VanDerWaalsContact CA-OG1 3.25Å; V261-T264 WeakPolarHBondContact CA-OG1 3.46Å; T264-P268 WeakPolarHBondContact O-CD 3.47Å; T264-P268 WeakPolarHBondContact O-CG 3.44Å; T264-L412 HydrophobicContact CG2-CD2 3.84Å; T264-D416 WeakPolarHBondContact CB-OD1 3.31Å; T264-D416 VanDerWaalsContact O-OD2 3.13Å; T264-D416 PolarHBondContact OG1-OD1 3.42Å; T264-D416 PolarHBondContact OG1-OD2 2.91Å
265	A	94.9	Very high	94.4	Very high	4 Å²	4	43.5 Å²	43.5	3%	0.033	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-25.8	177.5	0	0	0	0	0	113.4	V261 F263 Y269 D416	V261-A265 WeakPolarHBondContact O-CB 3.46Å; V261-A265 PolarHBondContact O-N 3.31Å; F263-A265 VanDerWaalsContact C-N 3.34Å; F263-A265 PolarHBondContact O-N 3.09Å; A265-Y269 VanDerWaalsContact O-CD2 3.26Å; A265-Y269 WeakPolarHBondContact O-CD2 3.21Å; A265-Y269 WeakPolarHBondContact O-CE2 3.37Å; A265-D416 WeakPolarHBondContact CA-OD2 3.27Å; A265-D416 PolarHBondContact N-OD2 3.48Å
266	T	95.4	Very high	94.8	Very high	55 Å²	55	40.3 Å²	40.3	34%	0.337	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-35.1	-178	65.4	0	0	0	0	113.2	M63 Y262 F263 Y269 V270	M63-T266 HydrophobicContact CE-CG2 4.05Å; M63-T266 HydrophobicContact SD-CG2 4.13Å; Y262-T266 WeakPolarHBondContact O-CB 3.02Å; Y262-T266 WeakPolarHBondContact O-CG2 3.29Å; Y262-T266 PolarHBondContact O-OG1 3.46Å; F263-T266 PolarHBondContact O-N 3.42Å; F263-T266 PolarHBondContact O-OG1 3.18Å; T266-Y269 WeakPolarHBondContact O-CB 3.43Å; T266-Y269 PolarHBondContact O-N 2.87Å; T266-Y269 VanDerWaalsContact O-N 3.08Å; T266-V270 PolarHBondContact O-N 3.12Å
267	F	96.2	Very high	95.2	Very high	47 Å²	47	43 Å²	43	21%	0.206	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-38.7	-179.5	-173.8	-89.7	0	0	0	113.6	F263 Y269 V270 V271 F408 L412	F263-F267 HydrophobicContact CD2-CB 4.35Å; F263-F267 HydrophobicContact CE2-CB 4.01Å; F263-F267 AromaticContact CE2-CD2 3.7Å; F263-F267 HydrophobicContact CE2-CD2 3.7Å; F263-F267 HydrophobicContact CE2-CE2 4.48Å; F263-F267 HydrophobicContact CE2-CG 4.03Å; F263-F267 HydrophobicContact CZ-CB 4.18Å; F263-F267 AromaticContact CZ-CD2 3.95Å; F263-F267 HydrophobicContact CZ-CD2 3.95Å; F263-F267 HydrophobicContact CZ-CG 4.01Å; F263-F267 VanDerWaalsContact O-CB 3.24Å; F263-F267 WeakPolarHBondContact O-CB 3.48Å; F263-F267 PolarHBondContact O-N 2.77Å; F267-Y269 PolarHBondContact O-N 3.43Å; F267-V270 WeakPolarHBondContact O-CA 3.42Å; F267-V270 WeakPolarHBondContact O-CB 3.38Å; F267-V270 PolarHBondContact O-N 3.42Å; F267-V271 HydrophobicContact CD1-CG2 3.82Å; F267-V271 HydrophobicContact CE1-CG2 3.29Å; F267-V271 HydrophobicContact CZ-CG2 3.87Å; F267-V271 PolarHBondContact O-N 3.34Å; F267-V271 VanDerWaalsContact O-N 3.08Å; F267-F408 HydrophobicContact CD1-CD1 4.01Å; F267-F408 AromaticContact CD1-CE1 3.91Å; F267-F408 HydrophobicContact CD1-CE1 3.91Å; F267-F408 AromaticContact CE1-CD1 3.33Å; F267-F408 HydrophobicContact CE1-CD1 3.33Å; F267-F408 AromaticContact CE1-CE1 3.53Å; F267-F408 HydrophobicContact CE1-CE1 3.53Å; F267-F408 AromaticContact CZ-CD1 3.86Å; F267-F408 HydrophobicContact CZ-CD1 3.86Å; F267-F408 AromaticContact CZ-CE1 3.87Å; F267-F408 HydrophobicContact CZ-CE1 3.87Å; F267-L412 HydrophobicContact CB-CD1 3.91Å; F267-L412 HydrophobicContact CD1-CD1 3.6Å; F267-L412 HydrophobicContact CE1-CD1 4.49Å; F267-L412 HydrophobicContact CG-CD1 4.03Å
268	P	96.6	Very high	95.4	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-53.4	-37.9	172.3	-31.2	37.9	0	0	0	113.8	T264 V270 V271 L272 M409 L412 L413	T264-P268 WeakPolarHBondContact O-CD 3.47Å; T264-P268 WeakPolarHBondContact O-CG 3.44Å; P268-V270 VanDerWaalsContact C-N 3.35Å; P268-V270 PolarHBondContact O-N 3.09Å; P268-V271 PolarHBondContact O-N 3.42Å; P268-L272 WeakPolarHBondContact O-CB 3.3Å; P268-L272 VanDerWaalsContact O-CG 3.27Å; P268-L272 WeakPolarHBondContact O-CG 3.46Å; P268-L272 PolarHBondContact O-N 3.37Å; P268-M409 HydrophobicContact CB-CG 3.87Å; P268-M409 HydrophobicContact CG-CG 4.43Å; P268-L412 HydrophobicContact CG-CB 4.18Å; P268-L413 HydrophobicContact CB-CD1 4.43Å; P268-L413 HydrophobicContact CB-CD2 3.61Å; P268-L413 HydrophobicContact CB-CG 3.9Å; P268-L413 HydrophobicContact CG-CD2 3.74Å; P268-L413 HydrophobicContact CG-CG 3.9Å
269	Y	96.5	Very high	95.7	Very high	62 Å²	62	45.8 Å²	45.8	24%	0.243	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-37.5	175.8	-70	-82.4	0	0	0	112.6	V66 A265 T266 F267 V271 L272 V273 I347 T351	V66-Y269 HydrophobicContact CG1-CE2 4.23Å; A265-Y269 VanDerWaalsContact O-CD2 3.26Å; A265-Y269 WeakPolarHBondContact O-CD2 3.21Å; A265-Y269 WeakPolarHBondContact O-CE2 3.37Å; T266-Y269 WeakPolarHBondContact O-CB 3.43Å; T266-Y269 PolarHBondContact O-N 2.87Å; T266-Y269 VanDerWaalsContact O-N 3.08Å; F267-Y269 PolarHBondContact O-N 3.43Å; Y269-V271 VanDerWaalsContact C-N 3.32Å; Y269-V271 PolarHBondContact O-N 3.12Å; Y269-L272 PolarHBondContact O-N 3.4Å; Y269-V273 VanDerWaalsContact O-CG2 3.3Å; Y269-V273 WeakPolarHBondContact O-CG2 3.29Å; Y269-V273 PolarHBondContact O-N 2.69Å; Y269-I347 WeakPolarHBondContact OH-CG2 3Å; Y269-T351 HydrophobicContact CE1-CG2 3.72Å; Y269-T351 WeakPolarHBondContact CE1-OG1 3.16Å; Y269-T351 PolarHBondContact OH-OG1 3.19Å
270	V	97.4	Very high	95.9	Very high	84 Å²	84	42.1 Å²	42.1	51%	0.509	22%	0.219	S	C	.	.	H	α-helix	trans	-59.9	-47.1	173.9	-179.7	0	0	0	0	109.8	T266 F267 P268 V273 V274	T266-V270 PolarHBondContact O-N 3.12Å; F267-V270 WeakPolarHBondContact O-CA 3.42Å; F267-V270 WeakPolarHBondContact O-CB 3.38Å; F267-V270 PolarHBondContact O-N 3.42Å; P268-V270 VanDerWaalsContact C-N 3.35Å; P268-V270 PolarHBondContact O-N 3.09Å; V270-V273 PolarHBondContact O-N 2.84Å; V270-V274 WeakPolarHBondContact O-CG2 3.24Å; V270-V274 PolarHBondContact O-N 3.22Å
271	V	96.4	Very high	96.1	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-44.3	178.5	179.1	0	0	0	0	111.5	F267 P268 Y269 V273 V274 L275 L405 M409	F267-V271 HydrophobicContact CD1-CG2 3.82Å; F267-V271 HydrophobicContact CE1-CG2 3.29Å; F267-V271 HydrophobicContact CZ-CG2 3.87Å; F267-V271 PolarHBondContact O-N 3.34Å; F267-V271 VanDerWaalsContact O-N 3.08Å; P268-V271 PolarHBondContact O-N 3.42Å; Y269-V271 VanDerWaalsContact C-N 3.32Å; Y269-V271 PolarHBondContact O-N 3.12Å; V271-V273 VanDerWaalsContact C-N 3.3Å; V271-V273 PolarHBondContact O-N 3.27Å; V271-V274 PolarHBondContact O-N 2.64Å; V271-L275 HydrophobicContact CG1-CD1 3.73Å; V271-L275 HydrophobicContact CG1-CG 3.98Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 VanDerWaalsContact O-CG 3.3Å; V271-L275 WeakPolarHBondContact O-CG 3.41Å; V271-L275 PolarHBondContact O-N 3.17Å; V271-L405 HydrophobicContact CG1-CB 4.25Å; V271-M409 HydrophobicContact CB-CB 4Å; V271-M409 HydrophobicContact CB-CG 4.24Å; V271-M409 HydrophobicContact CB-SD 3.81Å; V271-M409 HydrophobicContact CG1-CB 3.84Å; V271-M409 HydrophobicContact CG1-CE 4.38Å; V271-M409 HydrophobicContact CG1-CG 4.29Å; V271-M409 HydrophobicContact CG1-SD 3.65Å; V271-M409 HydrophobicContact CG2-CB 4.16Å
272	L	96	Very high	96.1	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-40.5	177.2	-70.9	173.3	0	0	0	111.8	V75 P268 Y269 L276 T351 F354 V358 M409	V75-L272 HydrophobicContact CG1-CD2 4.14Å; V75-L272 HydrophobicContact CG2-CD2 4.38Å; P268-L272 WeakPolarHBondContact O-CB 3.3Å; P268-L272 VanDerWaalsContact O-CG 3.27Å; P268-L272 WeakPolarHBondContact O-CG 3.46Å; P268-L272 PolarHBondContact O-N 3.37Å; Y269-L272 PolarHBondContact O-N 3.4Å; L272-L276 WeakPolarHBondContact O-CB 3.29Å; L272-L276 PolarHBondContact O-N 3.44Å; L272-T351 HydrophobicContact CD1-CG2 4.3Å; L272-F354 HydrophobicContact CB-CD1 4.33Å; L272-F354 HydrophobicContact CB-CE1 3.77Å; L272-V358 HydrophobicContact CB-CG2 4.37Å; L272-V358 HydrophobicContact CD2-CB 4.48Å; L272-V358 HydrophobicContact CD2-CG1 4.35Å; L272-V358 HydrophobicContact CD2-CG2 4.2Å; L272-V358 WeakPolarHBondContact O-CG2 3.47Å; L272-M409 HydrophobicContact CD2-CE 4.18Å; L272-M409 HydrophobicContact CD2-SD 3.75Å; L272-M409 HydrophobicContact CG-SD 3.77Å
273	V	97.9	Very high	96.1	Very high	77 Å²	77	46.8 Å²	46.8	47%	0.467	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-45.4	175.4	170.9	0	0	0	0	111.3	Y269 V270 V271 L275 L276 V277 F354	Y269-V273 VanDerWaalsContact O-CG2 3.3Å; Y269-V273 WeakPolarHBondContact O-CG2 3.29Å; Y269-V273 PolarHBondContact O-N 2.69Å; V270-V273 PolarHBondContact O-N 2.84Å; V271-V273 VanDerWaalsContact C-N 3.3Å; V271-V273 PolarHBondContact O-N 3.27Å; V273-L275 PolarHBondContact O-N 3.32Å; V273-L276 WeakPolarHBondContact O-CB 3.45Å; V273-L276 PolarHBondContact O-N 3.15Å; V273-V277 WeakPolarHBondContact O-CG2 3.34Å; V273-V277 PolarHBondContact O-N 3.43Å; V273-F354 HydrophobicContact CG2-CE1 4.34Å; V273-F354 HydrophobicContact CG2-CZ 3.98Å
274	V	96.8	Very high	96.1	Very high	60 Å²	60	42.5 Å²	42.5	36%	0.364	24%	0.24	S	C	.	.	H	α-helix	trans	-61.2	-45.3	177.3	168.1	0	0	0	0	111.2	V270 V271 L276 V277 R278 W402 L405	V270-V274 WeakPolarHBondContact O-CG2 3.24Å; V270-V274 PolarHBondContact O-N 3.22Å; V271-V274 PolarHBondContact O-N 2.64Å; V274-L276 VanDerWaalsContact C-N 3.34Å; V274-V277 PolarHBondContact O-N 3.1Å; V274-R278 WeakPolarHBondContact O-CB 3.15Å; V274-R278 PolarHBondContact O-N 3.41Å; V274-W402 HydrophobicContact CG1-CZ3 4.02Å; V274-L405 HydrophobicContact CG1-CD1 4.45Å
275	L	94.7	Very high	96.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-67.2	-33.7	177.1	-70.7	179.9	0	0	0	112.2	V271 V273 G279 V358 I362 Y389 W402 F406 M409	V271-L275 HydrophobicContact CG1-CD1 3.73Å; V271-L275 HydrophobicContact CG1-CG 3.98Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 VanDerWaalsContact O-CG 3.3Å; V271-L275 WeakPolarHBondContact O-CG 3.41Å; V271-L275 PolarHBondContact O-N 3.17Å; V273-L275 PolarHBondContact O-N 3.32Å; L275-G279 WeakPolarHBondContact O-CA 3.48Å; L275-G279 PolarHBondContact O-N 3.32Å; L275-V358 HydrophobicContact CB-CG1 3.58Å; L275-V358 HydrophobicContact CD1-CG1 4.4Å; L275-I362 HydrophobicContact CB-CD1 4.45Å; L275-Y389 VanDerWaalsContact CD1-OH 3.27Å; L275-Y389 WeakPolarHBondContact CD1-OH 3.45Å; L275-Y389 WeakPolarHBondContact CD2-OH 3.43Å; L275-W402 HydrophobicContact CD2-CE3 4.04Å; L275-F406 HydrophobicContact CD1-CD2 4.39Å; L275-M409 HydrophobicContact CD1-CE 4.22Å
276	L	96.2	Very high	96.2	Very high	35 Å²	35	47.8 Å²	47.8	18%	0.183	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-53.2	172.8	-176.9	61.3	0	0	0	110.7	L272 V273 V274 R278 G279 V280 F354 F357 V358	L272-L276 WeakPolarHBondContact O-CB 3.29Å; L272-L276 PolarHBondContact O-N 3.44Å; V273-L276 WeakPolarHBondContact O-CB 3.45Å; V273-L276 PolarHBondContact O-N 3.15Å; V274-L276 VanDerWaalsContact C-N 3.34Å; L276-R278 VanDerWaalsContact C-N 3.27Å; L276-R278 PolarHBondContact O-N 3.18Å; L276-G279 PolarHBondContact O-N 2.89Å; L276-G279 VanDerWaalsContact O-N 3.11Å; L276-V280 HydrophobicContact CD1-CG1 3.8Å; L276-V280 HydrophobicContact CG-CG1 4.3Å; L276-V280 WeakPolarHBondContact O-CG1 3.23Å; L276-V280 WeakPolarHBondContact O-CG2 3.41Å; L276-V280 PolarHBondContact O-N 3.24Å; L276-F354 HydrophobicContact CB-CZ 4.37Å; L276-F354 HydrophobicContact CD2-CD2 4.39Å; L276-F354 HydrophobicContact CD2-CE2 3.4Å; L276-F354 HydrophobicContact CD2-CZ 3.59Å; L276-F357 HydrophobicContact CD1-CB 3.74Å; L276-V358 HydrophobicContact CB-CG2 4.02Å; L276-V358 HydrophobicContact CD1-CG2 4.34Å
277	V	97.5	Very high	96.2	Very high	81 Å²	81	50.2 Å²	50.2	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-57.6	-45.2	-179.7	172.3	0	0	0	0	109.9	V273 V274 V280 L281	V273-V277 WeakPolarHBondContact O-CG2 3.34Å; V273-V277 PolarHBondContact O-N 3.43Å; V274-V277 PolarHBondContact O-N 3.1Å; V277-V280 WeakPolarHBondContact O-CG2 2.97Å; V277-L281 HydrophobicContact CG1-CD1 4.13Å; V277-L281 WeakPolarHBondContact O-CD1 3.24Å; V277-L281 WeakPolarHBondContact O-CG 3.46Å; V277-L281 PolarHBondContact O-N 3.14Å
278	R	94.8	Very high	96.1	Very high	60 Å²	60	48 Å²	48	23%	0.226	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-47.9	175.2	179.5	57.2	-177.5	155.6	2.1	111.5	V274 L276 L281 L282 M396 W402	V274-R278 WeakPolarHBondContact O-CB 3.15Å; V274-R278 PolarHBondContact O-N 3.41Å; L276-R278 VanDerWaalsContact C-N 3.27Å; L276-R278 PolarHBondContact O-N 3.18Å; R278-L281 PolarHBondContact O-N 3.19Å; R278-L282 WeakPolarHBondContact O-CG 3.5Å; R278-L282 PolarHBondContact O-N 2.57Å; R278-M396 HydrophobicContact CG-SD 4.19Å; R278-W402 HydrophobicContact CB-CH2 3.84Å; R278-W402 HydrophobicContact CB-CZ3 3.89Å; R278-W402 HydrophobicContact CG-CD2 4.48Å; R278-W402 HydrophobicContact CG-CE3 4.31Å; R278-W402 HydrophobicContact CG-CH2 3.62Å; R278-W402 HydrophobicContact CG-CZ2 3.8Å; R278-W402 HydrophobicContact CG-CZ3 3.89Å
279	G	95.3	Very high	96.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-48.1	-176.3	0	0	0	0	0	112.8	L275 L276 L281 L282 A285	L275-G279 WeakPolarHBondContact O-CA 3.48Å; L275-G279 PolarHBondContact O-N 3.32Å; L276-G279 PolarHBondContact O-N 2.89Å; L276-G279 VanDerWaalsContact O-N 3.11Å; G279-L281 PolarHBondContact O-N 3.44Å; G279-L282 WeakPolarHBondContact O-CB 3.35Å; G279-L282 PolarHBondContact O-N 3.1Å; G279-L282 VanDerWaalsContact O-N 3.17Å; G279-A285 WeakPolarHBondContact O-CB 3.5Å
280	V	97.3	Very high	96.1	Very high	70 Å²	70	50.6 Å²	50.6	42%	0.424	29%	0.286	S	S	.	.	H	α-helix	trans	-70	-18.4	-179.6	-58.2	0	0	0	0	113.9	L276 V277 I289	L276-V280 HydrophobicContact CD1-CG1 3.8Å; L276-V280 HydrophobicContact CG-CG1 4.3Å; L276-V280 WeakPolarHBondContact O-CG1 3.23Å; L276-V280 WeakPolarHBondContact O-CG2 3.41Å; L276-V280 PolarHBondContact O-N 3.24Å; V277-V280 WeakPolarHBondContact O-CG2 2.97Å; V280-I289 HydrophobicContact CG1-CD1 4.16Å
281	L	96.5	Very high	95.9	Very high	126 Å²	126	49.8 Å²	49.8	66%	0.66	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5.5	176.1	-66.8	173.7	0	0	0	113	V277 R278 G279	V277-L281 HydrophobicContact CG1-CD1 4.13Å; V277-L281 WeakPolarHBondContact O-CD1 3.24Å; V277-L281 WeakPolarHBondContact O-CG 3.46Å; V277-L281 PolarHBondContact O-N 3.14Å; R278-L281 PolarHBondContact O-N 3.19Å; G279-L281 PolarHBondContact O-N 3.44Å
282	L	95.2	Very high	95.8	Very high	14 Å²	14	49.7 Å²	49.7	7%	0.073	27%	0.273	C	S	.	.	S	Bend	trans	-83.4	149.4	177.2	-67.4	166.8	0	0	0	111.2	R278 G279 A285 F365 M396	R278-L282 WeakPolarHBondContact O-CG 3.5Å; R278-L282 PolarHBondContact O-N 2.57Å; G279-L282 WeakPolarHBondContact O-CB 3.35Å; G279-L282 PolarHBondContact O-N 3.1Å; G279-L282 VanDerWaalsContact O-N 3.17Å; L282-A285 VanDerWaalsContact O-CB 3.27Å; L282-A285 WeakPolarHBondContact O-CB 3.38Å; L282-A285 PolarHBondContact O-N 3.15Å; L282-F365 HydrophobicContact CB-CB 3.73Å; L282-F365 HydrophobicContact CB-CD2 3.84Å; L282-F365 HydrophobicContact CB-CG 3.78Å; L282-F365 HydrophobicContact CD1-CB 3.97Å; L282-F365 HydrophobicContact CD1-CD1 3.73Å; L282-F365 HydrophobicContact CD1-CD2 4.47Å; L282-F365 HydrophobicContact CD1-CE1 4.35Å; L282-F365 HydrophobicContact CD1-CG 3.78Å; L282-F365 HydrophobicContact CD2-CD1 4.42Å; L282-F365 HydrophobicContact CD2-CD2 4.19Å; L282-F365 HydrophobicContact CD2-CE1 4.41Å; L282-F365 HydrophobicContact CD2-CE2 4.22Å; L282-F365 HydrophobicContact CD2-CG 4.29Å; L282-F365 HydrophobicContact CD2-CZ 4.32Å; L282-F365 HydrophobicContact CG-CB 4.42Å; L282-F365 HydrophobicContact CG-CD1 4.46Å; L282-F365 HydrophobicContact CG-CD2 4.38Å; L282-F365 HydrophobicContact CG-CG 4.16Å; L282-M396 HydrophobicContact CD1-CG 4.35Å; L282-M396 HydrophobicContact CD1-SD 3.74Å; L282-M396 HydrophobicContact CD2-CG 4.45Å
283	P	95.2	Very high	95.8	Very high	82 Å²	82	52 Å²	52	53%	0.532	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	145.4	174.2	26.6	-32.3	0	0	0	110.5	A285 F365	P283-A285 PolarHBondContact O-N 3.09Å; P283-F365 HydrophobicContact CG-CD2 3.81Å; P283-F365 HydrophobicContact CG-CE2 3.95Å; P283-F365 VanDerWaalsContact O-CA 3.22Å; P283-F365 WeakPolarHBondContact O-CA 3.21Å; P283-F365 WeakPolarHBondContact O-CB 3.32Å
284	G	95	Very high	95.7	Very high	19 Å²	19	55.4 Å²	55.4	20%	0.196	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-5.6	-178.7	0	0	0	0	0	115.8	L286 D287 G288 G364	G284-L286 PolarHBondContact O-N 3.47Å; G284-D287 PolarHBondContact O-N 3.46Å; G284-D287 VanDerWaalsContact O-N 3.13Å; G284-G288 PolarHBondContact O-N 2.88Å; G284-G364 CarbonylContact O-C 3.39Å; G284-G364 WeakPolarHBondContact O-CA 3.32Å
285	A	96.2	Very high	95.6	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-36.1	-179.7	0	0	0	0	0	113.4	G279 L282 P283 G288 I289 S361	G279-A285 WeakPolarHBondContact O-CB 3.5Å; L282-A285 VanDerWaalsContact O-CB 3.27Å; L282-A285 WeakPolarHBondContact O-CB 3.38Å; L282-A285 PolarHBondContact O-N 3.15Å; P283-A285 PolarHBondContact O-N 3.09Å; A285-G288 PolarHBondContact O-N 3.41Å; A285-I289 WeakPolarHBondContact O-CG1 3.46Å; A285-I289 PolarHBondContact O-N 3.39Å; A285-S361 WeakPolarHBondContact CA-O 3.15Å
286	L	96.7	Very high	95.6	Very high	119 Å²	119	58.9 Å²	58.9	62%	0.623	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-41.8	177.7	-178	63.7	0	0	0	111.9	G284 G288 I289 I290	G284-L286 PolarHBondContact O-N 3.47Å; L286-G288 PolarHBondContact O-N 2.93Å; L286-I289 PolarHBondContact O-N 2.84Å; L286-I290 HydrophobicContact CD1-CD1 4.24Å; L286-I290 HydrophobicContact CD1-CG1 4.32Å; L286-I290 HydrophobicContact CD2-CD1 4.44Å; L286-I290 HydrophobicContact CG-CD1 3.88Å; L286-I290 HydrophobicContact CG-CG1 4.38Å; L286-I290 WeakPolarHBondContact O-CB 3.12Å; L286-I290 VanDerWaalsContact O-CG1 3.32Å; L286-I290 WeakPolarHBondContact O-CG1 3.25Å; L286-I290 PolarHBondContact O-N 3.03Å
287	D	95.2	Very high	95.6	Very high	106 Å²	106	64.9 Å²	64.9	57%	0.567	33%	0.334	S	S	*	.	H	α-helix	trans	-62	-38.2	178.5	-63.9	-42	0	0	0	110.9	G284 Y291	G284-D287 PolarHBondContact O-N 3.46Å; G284-D287 VanDerWaalsContact O-N 3.13Å; D287-Y291 VanDerWaalsContact O-CB 3.29Å; D287-Y291 WeakPolarHBondContact O-CB 3.38Å; D287-Y291 PolarHBondContact O-N 3.44Å
288	G	95	Very high	95.6	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.6	-44.8	174	0	0	0	0	0	113.6	G284 A285 L286 I290 Y291 Y292 F360 I374	G284-G288 PolarHBondContact O-N 2.88Å; A285-G288 PolarHBondContact O-N 3.41Å; L286-G288 PolarHBondContact O-N 2.93Å; G288-I290 VanDerWaalsContact C-N 3.34Å; G288-I290 PolarHBondContact O-N 3.32Å; G288-Y291 PolarHBondContact O-N 3.15Å; G288-Y292 PolarHBondContact O-N 2.63Å; G288-F360 WeakPolarHBondContact CA-O 3.4Å; G288-F360 WeakPolarHBondContact O-CB 3.1Å; G288-F360 WeakPolarHBondContact O-CD1 3.36Å; G288-I374 VanDerWaalsContact CA-CD1 3.4Å
289	I	96.4	Very high	95.5	Very high	33 Å²	33	66 Å²	66	17%	0.169	35%	0.345	C	S	.	.	H	α-helix	trans	-64	-40.4	176.6	-67.1	167.2	0	0	0	111.3	V280 A285 L286 Y291 Y292 L293 F357	V280-I289 HydrophobicContact CG1-CD1 4.16Å; A285-I289 WeakPolarHBondContact O-CG1 3.46Å; A285-I289 PolarHBondContact O-N 3.39Å; L286-I289 PolarHBondContact O-N 2.84Å; I289-Y291 VanDerWaalsContact C-N 3.33Å; I289-Y292 WeakPolarHBondContact O-CB 3.2Å; I289-Y292 PolarHBondContact O-N 3.01Å; I289-L293 PolarHBondContact O-N 2.88Å; I289-F357 HydrophobicContact CG1-CD1 4.36Å; I289-F357 HydrophobicContact CG2-CD1 3.97Å; I289-F357 HydrophobicContact CG2-CE1 3.94Å
290	I	96.5	Very high	95.4	Very high	86 Å²	86	68.2 Å²	68.2	44%	0.441	36%	0.357	S	S	.	.	H	α-helix	trans	-61.3	-46.7	173.6	-70.3	170.2	0	0	0	109.3	L286 G288 Y292 L293 K294	L286-I290 HydrophobicContact CD1-CD1 4.24Å; L286-I290 HydrophobicContact CD1-CG1 4.32Å; L286-I290 HydrophobicContact CD2-CD1 4.44Å; L286-I290 HydrophobicContact CG-CD1 3.88Å; L286-I290 HydrophobicContact CG-CG1 4.38Å; L286-I290 WeakPolarHBondContact O-CB 3.12Å; L286-I290 VanDerWaalsContact O-CG1 3.32Å; L286-I290 WeakPolarHBondContact O-CG1 3.25Å; L286-I290 PolarHBondContact O-N 3.03Å; G288-I290 VanDerWaalsContact C-N 3.34Å; G288-I290 PolarHBondContact O-N 3.32Å; I290-Y292 VanDerWaalsContact C-N 3.28Å; I290-Y292 PolarHBondContact O-N 3.23Å; I290-L293 PolarHBondContact O-N 3.08Å; I290-K294 HydrophobicContact CG2-CB 4.4Å; I290-K294 WeakPolarHBondContact O-CB 3.43Å; I290-K294 PolarHBondContact O-N 3.44Å
291	Y	92.4	Very high	95.1	Very high	67 Å²	67	68.2 Å²	68.2	26%	0.263	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-34.9	180	-168.8	-104.2	0	0	0	113.1	Y83 D287 G288 I289 F360 H373 I374 S375	Y83-Y291 HydrophobicContact CD2-CD1 4.45Å; Y83-Y291 AromaticContact CD2-CE1 3.48Å; Y83-Y291 HydrophobicContact CD2-CE1 3.48Å; Y83-Y291 VanDerWaalsContact CD2-CE1 3.48Å; Y83-Y291 HydrophobicContact CE2-CE1 4.17Å; Y83-Y291 AromaticContact CG-CE1 3.99Å; Y83-Y291 HydrophobicContact CG-CE1 3.99Å; D287-Y291 VanDerWaalsContact O-CB 3.29Å; D287-Y291 WeakPolarHBondContact O-CB 3.38Å; D287-Y291 PolarHBondContact O-N 3.44Å; G288-Y291 PolarHBondContact O-N 3.15Å; I289-Y291 VanDerWaalsContact C-N 3.33Å; Y291-F360 HydrophobicContact CD1-CD1 4.34Å; Y291-F360 AromaticContact CD1-CE1 3.79Å; Y291-F360 HydrophobicContact CD1-CE1 3.79Å; Y291-F360 HydrophobicContact CE1-CE1 4.4Å; Y291-H373 AromaticContact CE2-CE1 3.71Å; Y291-I374 HydrophobicContact CD1-CB 4.42Å; Y291-I374 HydrophobicContact CD1-CD1 4.09Å; Y291-I374 HydrophobicContact CD1-CG1 4.14Å; Y291-I374 HydrophobicContact CD1-CG2 3.47Å; Y291-I374 VanDerWaalsContact CD1-CG2 3.47Å; Y291-I374 HydrophobicContact CD2-CG2 3.46Å; Y291-I374 VanDerWaalsContact CD2-CG2 3.46Å; Y291-I374 HydrophobicContact CE1-CG2 3.85Å; Y291-I374 HydrophobicContact CE2-CG2 3.87Å; Y291-I374 HydrophobicContact CG-CD1 4.39Å; Y291-I374 HydrophobicContact CG-CG2 3.25Å; Y291-S375 VanDerWaalsContact OH-CB 3.31Å; Y291-S375 WeakPolarHBondContact OH-CB 3.21Å
292	Y	94.7	Very high	94.9	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-41.9	174.4	173.5	-135.9	0	0	0	113.4	F78 C82 G87 G288 I289 I290 F353 F357 F360	F78-Y292 WeakPolarHBondContact CE1-OH 3.04Å; C82-Y292 HydrophobicContact CB-CD2 4.1Å; C82-Y292 HydrophobicContact CB-CE2 3.64Å; C82-Y292 WeakPolarHBondContact SG-CE2 3.28Å; G87-Y292 CarbonylContact C-O 3.53Å; G87-Y292 WeakPolarHBondContact CA-O 3.33Å; G288-Y292 PolarHBondContact O-N 2.63Å; I289-Y292 WeakPolarHBondContact O-CB 3.2Å; I289-Y292 PolarHBondContact O-N 3.01Å; I290-Y292 VanDerWaalsContact C-N 3.28Å; I290-Y292 PolarHBondContact O-N 3.23Å; Y292-F353 HydrophobicContact CE1-CE2 4.45Å; Y292-F353 WeakPolarHBondContact OH-CD2 3.25Å; Y292-F353 PolarHBondContact OH-O 3.36Å; Y292-F357 HydrophobicContact CE1-CD2 4.06Å; Y292-F357 HydrophobicContact CE1-CE2 4.08Å; Y292-F357 HydrophobicContact CE1-CG 4.46Å; Y292-F360 AromaticContact CD2-CD2 3.73Å; Y292-F360 HydrophobicContact CD2-CD2 3.73Å; Y292-F360 AromaticContact CD2-CE2 3.89Å; Y292-F360 HydrophobicContact CD2-CE2 3.89Å; Y292-F360 HydrophobicContact CD2-CG 4.46Å; Y292-F360 HydrophobicContact CG-CB 4.4Å; Y292-F360 AromaticContact CG-CD2 3.79Å; Y292-F360 HydrophobicContact CG-CD2 3.79Å; Y292-F360 HydrophobicContact CG-CE2 4.36Å; Y292-F360 HydrophobicContact CG-CG 4.12Å
293	L	95.7	Very high	94.7	Very high	52 Å²	52	67 Å²	67	27%	0.272	37%	0.373	S	S	.	.	H	α-helix	trans	-104.5	-17.6	-170.3	-65.5	179.4	0	0	0	114.7	G88 I289 I290 P295 F353 F357	G88-L293 WeakPolarHBondContact CA-O 3.27Å; G88-L293 PolarHBondContact N-O 3.35Å; G88-L293 VanDerWaalsContact N-O 3.08Å; I289-L293 PolarHBondContact O-N 2.88Å; I290-L293 PolarHBondContact O-N 3.08Å; L293-P295 VanDerWaalsContact O-CD 3.31Å; L293-P295 WeakPolarHBondContact O-CD 3.33Å; L293-P295 VanDerWaalsContact O-N 3.12Å; L293-F353 HydrophobicContact CD2-CE2 3.85Å; L293-F353 HydrophobicContact CD2-CZ 4.41Å; L293-F357 HydrophobicContact CD1-CE1 3.92Å; L293-F357 HydrophobicContact CD1-CZ 3.77Å
294	K	95.4	Very high	94.4	Very high	147 Å²	147	66.5 Å²	66.5	64%	0.639	36%	0.363	S	S	*	.			trans	-58.9	117.9	-176.2	-176.8	175.9	-178.4	-179.1	0	109.8	I290 D296	I290-K294 HydrophobicContact CG2-CB 4.4Å; I290-K294 WeakPolarHBondContact O-CB 3.43Å; I290-K294 PolarHBondContact O-N 3.44Å; K294-D296 PolarHBondContact O-N 3.38Å
295	P	95.9	Very high	94.2	Very high	66 Å²	66	65.7 Å²	65.7	43%	0.429	35%	0.354	S	S	.	.			trans	-76.9	127.1	-173.7	28.7	-33.5	0	0	0	111.7	G86 V89 L293 W297	G86-P295 WeakPolarHBondContact O-CA 3.21Å; V89-P295 HydrophobicContact CG2-CB 3.43Å; V89-P295 VanDerWaalsContact CG2-CB 3.43Å; L293-P295 VanDerWaalsContact O-CD 3.31Å; L293-P295 WeakPolarHBondContact O-CD 3.33Å; L293-P295 VanDerWaalsContact O-N 3.12Å; P295-W297 HydrophobicContact CB-CZ2 4.35Å
296	D	94.7	Very high	94	Very high	69 Å²	69	70.2 Å²	70.2	37%	0.369	37%	0.371	S	S	.	.			trans	-106.2	94.5	163.9	179.3	4.8	0	0	0	109.8	G86 K294 S298 K299	G86-D296 PolarHBondContact O-N 3.2Å; K294-D296 PolarHBondContact O-N 3.38Å; D296-S298 VanDerWaalsContact CG-OG 3.28Å; D296-S298 PolarHBondContact O-N 2.91Å; D296-S298 WeakPolarHBondContact OD1-CB 3.24Å; D296-S298 PolarHBondContact OD1-N 3.39Å; D296-S298 PolarHBondContact OD1-OG 3.26Å; D296-S298 PolarHBondContact OD2-OG 3.5Å; D296-K299 HydrophobicContact CB-CG 4.14Å; D296-K299 WeakPolarHBondContact O-CB 3.31Å; D296-K299 PolarHBondContact O-N 2.85Å; D296-K299 VanDerWaalsContact O-N 3.16Å
297	W	96.5	Very high	93.6	Very high	162 Å²	162	65 Å²	65	61%	0.614	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-63.6	-22.3	-175.2	-63.5	98	0	0	0	113.9	V89 I92 P295 K299 L300	V89-W297 HydrophobicContact CG2-CD2 4.04Å; V89-W297 HydrophobicContact CG2-CE3 4.08Å; V89-W297 HydrophobicContact CG2-CG 4.4Å; V89-W297 HydrophobicContact CG2-CZ3 4.49Å; I92-W297 HydrophobicContact CD1-CH2 4.28Å; I92-W297 HydrophobicContact CD1-CZ3 3.82Å; P295-W297 HydrophobicContact CB-CZ2 4.35Å; W297-K299 PolarHBondContact O-N 2.79Å; W297-L300 HydrophobicContact CE3-CD1 3.91Å; W297-L300 HydrophobicContact CZ3-CD1 4.2Å; W297-L300 PolarHBondContact O-N 3.49Å
298	S	96	Very high	93.3	Very high	87 Å²	87	60.5 Å²	60.5	61%	0.608	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-61.6	-26.7	177.5	73.1	0	0	0	0	112	D296 L300 G301	D296-S298 VanDerWaalsContact CG-OG 3.28Å; D296-S298 PolarHBondContact O-N 2.91Å; D296-S298 WeakPolarHBondContact OD1-CB 3.24Å; D296-S298 PolarHBondContact OD1-N 3.39Å; D296-S298 PolarHBondContact OD1-OG 3.26Å; D296-S298 PolarHBondContact OD2-OG 3.5Å; S298-L300 VanDerWaalsContact C-N 3.34Å; S298-L300 PolarHBondContact O-N 3.29Å; S298-G301 PolarHBondContact O-N 2.97Å
299	K	93	Very high	93.2	Very high	77 Å²	77	60.5 Å²	60.5	34%	0.335	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-67.9	-27.1	-178.8	-66.3	-69.6	-173	173.4	0	113.5	N85 D296 W297 G301 S302 V305	N85-K299 WeakPolarHBondContact O-CB 3.26Å; D296-K299 HydrophobicContact CB-CG 4.14Å; D296-K299 WeakPolarHBondContact O-CB 3.31Å; D296-K299 PolarHBondContact O-N 2.85Å; D296-K299 VanDerWaalsContact O-N 3.16Å; W297-K299 PolarHBondContact O-N 2.79Å; K299-G301 PolarHBondContact O-N 2.98Å; K299-G301 VanDerWaalsContact O-N 3.16Å; K299-S302 WeakPolarHBondContact O-CB 3.37Å; K299-S302 PolarHBondContact O-N 3.47Å; K299-V305 HydrophobicContact CB-CG2 4.01Å; K299-V305 WeakPolarHBondContact O-CG2 3.27Å
300	L	93.4	Very high	93	Very high	46 Å²	46	59 Å²	59	24%	0.241	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-60.6	-27.1	176.9	-73.6	178.2	0	0	0	113.5	V89 I92 W297 S298 S302 W306	V89-L300 HydrophobicContact CG1-CD1 4.02Å; V89-L300 HydrophobicContact CG1-CD2 3.41Å; V89-L300 VanDerWaalsContact CG1-CD2 3.41Å; V89-L300 HydrophobicContact CG1-CG 3.33Å; I92-L300 HydrophobicContact CD1-CD1 4.34Å; W297-L300 HydrophobicContact CE3-CD1 3.91Å; W297-L300 HydrophobicContact CZ3-CD1 4.2Å; W297-L300 PolarHBondContact O-N 3.49Å; S298-L300 VanDerWaalsContact C-N 3.34Å; S298-L300 PolarHBondContact O-N 3.29Å; L300-S302 PolarHBondContact O-N 3.1Å; L300-W306 HydrophobicContact CD2-CZ2 4.41Å; L300-W306 PolarHBondContact O-NE1 2.96Å; L300-W306 VanDerWaalsContact O-NE1 3.11Å
301	G	92	Very high	92.6	Very high	70 Å²	70	55.4 Å²	55.4	72%	0.722	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-73.7	-12.5	176.1	0	0	0	0	0	113.8	S298 K299	S298-G301 PolarHBondContact O-N 2.97Å; K299-G301 PolarHBondContact O-N 2.98Å; K299-G301 VanDerWaalsContact O-N 3.16Å
302	S	92.2	Very high	92.5	Very high	47 Å²	47	52.2 Å²	52.2	33%	0.329	28%	0.281	S	S	.	.			trans	-87.9	123.6	178.9	-179.6	0	0	0	0	110.9	K299 L300 Q304 V305	K299-S302 WeakPolarHBondContact O-CB 3.37Å; K299-S302 PolarHBondContact O-N 3.47Å; L300-S302 PolarHBondContact O-N 3.1Å; S302-Q304 PolarHBondContact O-N 3.41Å; S302-V305 PolarHBondContact O-N 3.46Å
303	P	89.8	Confident	92.4	Very high	69 Å²	69	52.2 Å²	52.2	45%	0.448	28%	0.281	S	S	.	.	H	α-helix	trans	-56.7	-31.2	175.2	-26.4	35.2	0	0	0	113.5	V305 W306 I307 F537	P303-V305 PolarHBondContact O-N 2.96Å; P303-W306 PolarHBondContact O-N 3.39Å; P303-W306 VanDerWaalsContact O-N 3.12Å; P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 2.97Å; P303-F537 HydrophobicContact CB-CD2 4.39Å; P303-F537 HydrophobicContact CB-CE2 3.6Å; P303-F537 HydrophobicContact CB-CZ 3.84Å; P303-F537 HydrophobicContact CG-CE2 4.18Å
304	Q	88.9	Confident	92.2	Very high	71 Å²	71	49.8 Å²	49.8	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-34.4	-178.2	-167.8	61.4	42.2	0	0	112.7	S302 W306 I307 D308	S302-Q304 PolarHBondContact O-N 3.41Å; Q304-W306 VanDerWaalsContact C-N 3.3Å; Q304-W306 PolarHBondContact O-N 3.31Å; Q304-I307 PolarHBondContact O-N 2.88Å; Q304-D308 PolarHBondContact NE2-OD1 2.96Å; Q304-D308 WeakPolarHBondContact O-CB 3.4Å; Q304-D308 PolarHBondContact O-N 3.21Å
305	V	92.2	Very high	91.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-41.7	178.7	174.9	0	0	0	0	110.8	N85 F90 P93 K299 S302 P303 A309	N85-V305 HydrophobicContact CB-CB 4.33Å; N85-V305 HydrophobicContact CB-CG1 4.07Å; N85-V305 HydrophobicContact CB-CG2 3.9Å; F90-V305 HydrophobicContact CD2-CG1 4.15Å; P93-V305 HydrophobicContact CG-CG1 3.76Å; K299-V305 HydrophobicContact CB-CG2 4.01Å; K299-V305 WeakPolarHBondContact O-CG2 3.27Å; S302-V305 PolarHBondContact O-N 3.46Å; P303-V305 PolarHBondContact O-N 2.96Å; V305-A309 VanDerWaalsContact O-CB 3.28Å; V305-A309 WeakPolarHBondContact O-CB 3.37Å; V305-A309 PolarHBondContact O-N 3.2Å
306	W	91.5	Very high	91.6	Very high	99 Å²	99	42.1 Å²	42.1	38%	0.375	23%	0.229	S	C	.	.	H	α-helix	trans	-70.5	-34.9	179.4	-64.8	87.6	0	0	0	111.9	P93 L96 I97 L300 P303 Q304 G310	P93-W306 HydrophobicContact CB-CD2 3.74Å; P93-W306 HydrophobicContact CB-CE3 3.43Å; P93-W306 VanDerWaalsContact CB-CE3 3.43Å; P93-W306 HydrophobicContact CB-CG 4.37Å; P93-W306 HydrophobicContact CB-CH2 4.16Å; P93-W306 HydrophobicContact CB-CZ2 4.43Å; P93-W306 HydrophobicContact CB-CZ3 3.66Å; L96-W306 HydrophobicContact CD1-CH2 3.99Å; L96-W306 HydrophobicContact CD1-CZ3 4.03Å; I97-W306 WeakPolarHBondContact CD1-O 3.35Å; L300-W306 HydrophobicContact CD2-CZ2 4.41Å; L300-W306 PolarHBondContact O-NE1 2.96Å; L300-W306 VanDerWaalsContact O-NE1 3.11Å; P303-W306 PolarHBondContact O-N 3.39Å; P303-W306 VanDerWaalsContact O-N 3.12Å; Q304-W306 VanDerWaalsContact C-N 3.3Å; Q304-W306 PolarHBondContact O-N 3.31Å; W306-G310 PolarHBondContact O-N 3.18Å
307	I	87.9	Confident	91.6	Very high	10 Å²	10	39 Å²	39	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-72	-47.3	178	-67.4	162.4	0	0	0	111.2	P303 Q304 A309 G310 T311 I534 F537 N538	P303-I307 WeakPolarHBondContact O-CG1 3.24Å; P303-I307 PolarHBondContact O-N 2.97Å; Q304-I307 PolarHBondContact O-N 2.88Å; I307-A309 PolarHBondContact O-N 3.03Å; I307-G310 PolarHBondContact O-N 3.34Å; I307-T311 HydrophobicContact CG2-CG2 4.29Å; I307-T311 WeakPolarHBondContact O-CB 3.42Å; I307-T311 WeakPolarHBondContact O-CG2 3.48Å; I307-T311 PolarHBondContact O-N 2.97Å; I307-T311 PolarHBondContact O-OG1 2.79Å; I307-I534 HydrophobicContact CB-CG2 4.39Å; I307-I534 HydrophobicContact CG1-CG1 4.43Å; I307-I534 HydrophobicContact CG1-CG2 4.19Å; I307-I534 HydrophobicContact CG2-CG2 3.92Å; I307-F537 HydrophobicContact CD1-CB 3.98Å; I307-F537 HydrophobicContact CD1-CD1 2.98Å; I307-F537 HydrophobicContact CD1-CD2 4.01Å; I307-F537 HydrophobicContact CD1-CE1 3.24Å; I307-F537 HydrophobicContact CD1-CE2 4.22Å; I307-F537 HydrophobicContact CD1-CG 3.39Å; I307-F537 HydrophobicContact CD1-CZ 3.87Å; I307-F537 HydrophobicContact CG1-CD1 4.34Å; I307-N538 WeakPolarHBondContact CG2-OD1 3.35Å
308	D	90.3	Very high	91.3	Very high	12 Å²	12	31.5 Å²	31.5	6%	0.064	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-40.4	175.9	-79	5.9	0	0	0	110.1	L81 K84 N85 F90 Q304 T311 Q312	L81-D308 HydrophobicContact CD2-CB 4.18Å; K84-D308 IonicContact NZ-OD2 3.37Å; K84-D308 PolarHBondContact NZ-OD2 3.41Å; N85-D308 WeakPolarHBondContact ND2-CB 3.49Å; N85-D308 PolarHBondContact ND2-OD2 2.87Å; N85-D308 PolarHBondContact OD1-OD2 2.83Å; F90-D308 HydrophobicContact CE2-CB 4.04Å; Q304-D308 PolarHBondContact NE2-OD1 2.96Å; Q304-D308 WeakPolarHBondContact O-CB 3.4Å; Q304-D308 PolarHBondContact O-N 3.21Å; D308-T311 PolarHBondContact O-OG1 2.84Å; D308-Q312 WeakPolarHBondContact O-CB 3.25Å; D308-Q312 PolarHBondContact O-N 3.25Å
309	A	93	Very high	91.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64	-46.1	175.2	0	0	0	0	0	112.3	F90 P93 I97 V305 I307 I313	F90-A309 HydrophobicContact CD2-CB 4.35Å; F90-A309 HydrophobicContact CE2-CB 3.66Å; F90-A309 HydrophobicContact CZ-CB 3.95Å; P93-A309 HydrophobicContact CB-CB 3.88Å; P93-A309 HydrophobicContact CG-CB 4.16Å; I97-A309 HydrophobicContact CD1-CB 3.92Å; V305-A309 VanDerWaalsContact O-CB 3.28Å; V305-A309 WeakPolarHBondContact O-CB 3.37Å; V305-A309 PolarHBondContact O-N 3.2Å; I307-A309 PolarHBondContact O-N 3.03Å; A309-I313 WeakPolarHBondContact O-CG1 3.23Å; A309-I313 PolarHBondContact O-N 3.2Å
310	G	90.6	Very high	91	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.7	-48	-178.9	0	0	0	0	0	113	W306 I307 Q312 I313 F314	W306-G310 PolarHBondContact O-N 3.18Å; I307-G310 PolarHBondContact O-N 3.34Å; G310-Q312 VanDerWaalsContact C-N 3.28Å; G310-Q312 PolarHBondContact O-N 3.02Å; G310-I313 PolarHBondContact O-N 2.82Å; G310-F314 WeakPolarHBondContact O-CD2 3.19Å; G310-F314 PolarHBondContact O-N 3.32Å
311	T	88.6	Confident	91	Very high	12 Å²	12	22 Å²	22	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-39.3	175.9	55.1	0	0	0	0	111.8	I307 D308 F315 L484 I534	I307-T311 HydrophobicContact CG2-CG2 4.29Å; I307-T311 WeakPolarHBondContact O-CB 3.42Å; I307-T311 WeakPolarHBondContact O-CG2 3.48Å; I307-T311 PolarHBondContact O-N 2.97Å; I307-T311 PolarHBondContact O-OG1 2.79Å; D308-T311 PolarHBondContact O-OG1 2.84Å; T311-F315 WeakPolarHBondContact O-CB 3.41Å; T311-F315 PolarHBondContact O-N 3.2Å; T311-L484 HydrophobicContact CG2-CD1 4.3Å; T311-I534 HydrophobicContact CG2-CG2 4.28Å
312	Q	91.2	Very high	91	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-43.9	174.9	179.9	62	28.5	0	0	112.4	G73 R77 F78 L81 Y94 D308 G310 S316	G73-Q312 PolarHBondContact O-NE2 2.81Å; R77-Q312 VanDerWaalsContact CD-OE1 3.28Å; F78-Q312 HydrophobicContact CD2-CG 4.18Å; L81-Q312 HydrophobicContact CD1-CB 3.8Å; L81-Q312 HydrophobicContact CD1-CG 4.11Å; Y94-Q312 HydrophobicContact CD2-CG 4.47Å; Y94-Q312 HydrophobicContact CE2-CG 3.98Å; D308-Q312 WeakPolarHBondContact O-CB 3.25Å; D308-Q312 PolarHBondContact O-N 3.25Å; G310-Q312 VanDerWaalsContact C-N 3.28Å; G310-Q312 PolarHBondContact O-N 3.02Å; Q312-S316 WeakPolarHBondContact O-CB 3.45Å; Q312-S316 PolarHBondContact O-N 3.37Å
313	I	92.5	Very high	91.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62	-49.9	177.9	-75.6	-67.3	0	0	0	110.8	Y94 I97 A98 A309 G310 F315 S316 Y317	Y94-I313 HydrophobicContact CD1-CD1 4.21Å; Y94-I313 HydrophobicContact CD2-CD1 3.73Å; Y94-I313 HydrophobicContact CD2-CG1 3.84Å; Y94-I313 HydrophobicContact CE1-CD1 3.82Å; Y94-I313 HydrophobicContact CE2-CD1 3.29Å; Y94-I313 HydrophobicContact CE2-CG1 3.79Å; Y94-I313 HydrophobicContact CG-CD1 4.17Å; Y94-I313 HydrophobicContact CG-CG1 4.42Å; I97-I313 HydrophobicContact CG2-CB 4.24Å; I97-I313 HydrophobicContact CG2-CG1 4.43Å; I97-I313 HydrophobicContact CG2-CG2 4.28Å; A98-I313 HydrophobicContact CB-CD1 3.67Å; A98-I313 HydrophobicContact CB-CG1 4.38Å; A309-I313 WeakPolarHBondContact O-CG1 3.23Å; A309-I313 PolarHBondContact O-N 3.2Å; G310-I313 PolarHBondContact O-N 2.82Å; I313-F315 PolarHBondContact O-N 2.96Å; I313-S316 PolarHBondContact O-N 3.06Å; I313-Y317 HydrophobicContact CD1-CE1 3.99Å; I313-Y317 VanDerWaalsContact O-CB 3.24Å; I313-Y317 WeakPolarHBondContact O-CB 3.47Å; I313-Y317 WeakPolarHBondContact O-CD1 3.32Å; I313-Y317 PolarHBondContact O-N 2.9Å
314	F	90.7	Very high	91.5	Very high	1 Å²	1	13.2 Å²	13.2	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-66.1	-41.4	-175	-79.6	-117	0	0	0	111.5	I97 I105 G310 A318 I319 L484 A487 C531	I97-F314 HydrophobicContact CG2-CD2 4.44Å; I97-F314 HydrophobicContact CG2-CE2 3.93Å; I105-F314 HydrophobicContact CD1-CD1 4.37Å; I105-F314 HydrophobicContact CD1-CE1 3.49Å; I105-F314 VanDerWaalsContact CD1-CE1 3.49Å; I105-F314 HydrophobicContact CD1-CZ 4.01Å; G310-F314 WeakPolarHBondContact O-CD2 3.19Å; G310-F314 PolarHBondContact O-N 3.32Å; F314-A318 PolarHBondContact O-N 3.41Å; F314-I319 HydrophobicContact CD1-CG2 4.12Å; F314-I319 PolarHBondContact O-N 3.25Å; F314-I319 VanDerWaalsContact O-N 3.1Å; F314-L484 HydrophobicContact CD1-CD2 3.99Å; F314-L484 HydrophobicContact CD2-CD2 4.48Å; F314-L484 HydrophobicContact CE1-CD2 4.05Å; F314-L484 HydrophobicContact CG-CD2 4.21Å; F314-L484 HydrophobicContact CZ-CD2 4.32Å; F314-A487 HydrophobicContact CD1-CB 3.96Å; F314-A487 HydrophobicContact CE1-CB 3.61Å; F314-C531 WeakPolarHBondContact CE1-SG 3.29Å; F314-C531 VanDerWaalsContact CZ-SG 3.52Å
315	F	87.6	Confident	91.9	Very high	48 Å²	48	10 Å²	10	21%	0.211	5%	0.046	C	C	.	.	H	α-helix	trans	-68.8	-48	175.9	-174.1	-94.2	0	0	0	112.2	T311 I313 Y317 A318 L483	T311-F315 WeakPolarHBondContact O-CB 3.41Å; T311-F315 PolarHBondContact O-N 3.2Å; I313-F315 PolarHBondContact O-N 2.96Å; F315-Y317 VanDerWaalsContact C-N 3.32Å; F315-Y317 PolarHBondContact O-N 3.49Å; F315-A318 WeakPolarHBondContact O-CA 2.98Å; F315-A318 PolarHBondContact O-N 3.01Å; F315-L483 HydrophobicContact CD2-CD1 4.08Å
316	S	92.2	Very high	92.1	Very high	4 Å²	4	10 Å²	10	3%	0.028	5%	0.045	C	C	.	.	H	α-helix	trans	-67.5	-31.8	-177.8	-178.3	0	0	0	0	112.7	A69 N74 Q312 I313 A318 N348	A69-S316 CarbonylContact C-O 3.36Å; A69-S316 WeakPolarHBondContact CA-O 3.3Å; N74-S316 PolarHBondContact ND2-OG 3.29Å; N74-S316 VanDerWaalsContact ND2-OG 3.11Å; N74-S316 PolarHBondContact OD1-OG 3.48Å; Q312-S316 WeakPolarHBondContact O-CB 3.45Å; Q312-S316 PolarHBondContact O-N 3.37Å; I313-S316 PolarHBondContact O-N 3.06Å; S316-A318 PolarHBondContact O-N 3.12Å; S316-N348 PolarHBondContact O-OD1 2.94Å; S316-N348 PolarHBondContact OG-ND2 3.49Å; S316-N348 PolarHBondContact OG-OD1 3.38Å; S316-N348 VanDerWaalsContact OG-OD1 3.1Å
317	Y	92.9	Very high	92.4	Very high	2 Å²	2	5.3 Å²	5.3	1%	0.008	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.7	174.5	-80.4	40.2	0	0	0	111.4	I103 F106 I313 F315 I319 A345 N348 S349	I103-Y317 HydrophobicContact CG1-CE2 4.14Å; F106-Y317 HydrophobicContact CB-CD2 4.14Å; F106-Y317 AromaticContact CD2-CD2 3.93Å; F106-Y317 HydrophobicContact CD2-CD2 3.93Å; F106-Y317 HydrophobicContact CD2-CG 4.27Å; F106-Y317 WeakPolarHBondContact CD2-O 3.44Å; F106-Y317 WeakPolarHBondContact CE2-O 3.36Å; F106-Y317 HydrophobicContact CG-CD2 4.3Å; I313-Y317 HydrophobicContact CD1-CE1 3.99Å; I313-Y317 VanDerWaalsContact O-CB 3.24Å; I313-Y317 WeakPolarHBondContact O-CB 3.47Å; I313-Y317 WeakPolarHBondContact O-CD1 3.32Å; I313-Y317 PolarHBondContact O-N 2.9Å; F315-Y317 VanDerWaalsContact C-N 3.32Å; F315-Y317 PolarHBondContact O-N 3.49Å; Y317-I319 VanDerWaalsContact C-N 3.27Å; Y317-I319 HydrophobicContact CD2-CD1 4.29Å; Y317-I319 HydrophobicContact CG-CD1 4.35Å; Y317-I319 PolarHBondContact O-N 3.24Å; Y317-A345 HydrophobicContact CE2-CB 3.56Å; Y317-A345 WeakPolarHBondContact OH-CA 3.39Å; Y317-A345 WeakPolarHBondContact OH-CB 3.42Å; Y317-A345 PolarHBondContact OH-O 2.94Å; Y317-N348 HydrophobicContact CD1-CB 4.44Å; Y317-N348 WeakPolarHBondContact CD1-ND2 3.19Å; Y317-N348 HydrophobicContact CE1-CB 4.14Å; Y317-N348 WeakPolarHBondContact CE1-ND2 2.92Å; Y317-S349 PolarHBondContact OH-OG 3.25Å; Y317-S349 VanDerWaalsContact OH-OG 3.05Å
318	A	90.2	Very high	92.8	Very high	6 Å²	6	4.9 Å²	4.9	5%	0.05	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	37.8	-179.9	0	0	0	0	0	113.3	F68 F314 F315 S316 L321	F68-A318 HydrophobicContact CD1-CB 3.53Å; F68-A318 HydrophobicContact CE1-CB 3.11Å; F68-A318 HydrophobicContact CE2-CB 4.29Å; F68-A318 HydrophobicContact CG-CB 4.28Å; F68-A318 HydrophobicContact CZ-CB 3.55Å; F314-A318 PolarHBondContact O-N 3.41Å; F315-A318 WeakPolarHBondContact O-CA 2.98Å; F315-A318 PolarHBondContact O-N 3.01Å; S316-A318 PolarHBondContact O-N 3.12Å; A318-L321 HydrophobicContact CB-CD1 4.06Å
319	I	92.5	Very high	93.1	Very high	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	143.8	-179.7	-72.7	162.5	0	0	0	110.6	G102 I105 E109 F314 Y317 L321 L483 A487	G102-I319 WeakPolarHBondContact O-CD1 3.21Å; I105-I319 HydrophobicContact CB-CD1 4.13Å; I105-I319 HydrophobicContact CB-CG1 4.4Å; I105-I319 HydrophobicContact CB-CG2 4.01Å; I105-I319 HydrophobicContact CD1-CG2 4.12Å; I105-I319 HydrophobicContact CG2-CB 4.46Å; I105-I319 HydrophobicContact CG2-CG1 4.32Å; I105-I319 HydrophobicContact CG2-CG2 3.38Å; E109-I319 WeakPolarHBondContact OE1-CA 3.34Å; F314-I319 HydrophobicContact CD1-CG2 4.12Å; F314-I319 PolarHBondContact O-N 3.25Å; F314-I319 VanDerWaalsContact O-N 3.1Å; Y317-I319 VanDerWaalsContact C-N 3.27Å; Y317-I319 HydrophobicContact CD2-CD1 4.29Å; Y317-I319 HydrophobicContact CG-CD1 4.35Å; Y317-I319 PolarHBondContact O-N 3.24Å; I319-L321 VanDerWaalsContact C-N 3.26Å; I319-L321 PolarHBondContact O-N 3.11Å; I319-L483 WeakPolarHBondContact O-CD2 3.31Å; I319-A487 HydrophobicContact CG2-CB 4.26Å
320	G	90.6	Very high	93.3	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-7.1	175.9	0	0	0	0	0	114.5	E109 S137 G322	E109-G320 PolarHBondContact OE1-N 3.18Å; S137-G320 PolarHBondContact OG-O 3.28Å; G320-G322 VanDerWaalsContact C-N 3.28Å; G320-G322 PolarHBondContact O-N 3.44Å
321	L	92.9	Very high	93.5	Very high	11 Å²	11	5 Å²	5	6%	0.058	3%	0.026	C	C	.	.	S	Bend	trans	-78.1	-13.2	178.9	-64.1	175.8	0	0	0	112.8	F68 I140 A318 I319 A323 L483	F68-L321 HydrophobicContact CZ-CB 4.46Å; F68-L321 HydrophobicContact CZ-CD1 3.74Å; I140-L321 HydrophobicContact CB-CD2 4.42Å; I140-L321 HydrophobicContact CG2-CD2 3.47Å; I140-L321 VanDerWaalsContact CG2-CD2 3.47Å; A318-L321 HydrophobicContact CB-CD1 4.06Å; I319-L321 VanDerWaalsContact C-N 3.26Å; I319-L321 PolarHBondContact O-N 3.11Å; L321-A323 HydrophobicContact CB-CB 4.49Å; L321-A323 PolarHBondContact O-N 3.43Å; L321-A323 VanDerWaalsContact O-N 3.1Å; L321-L483 HydrophobicContact CD2-CD2 3.77Å; L321-L483 HydrophobicContact CG-CD2 4.17Å
322	G	93.3	Very high	93.8	Very high	1 Å²	1	12 Å²	12	1%	0.01	5%	0.051	C	C	.	.	S	Bend	trans	69.7	-0.1	-176.2	0	0	0	0	0	114.3	S120 G320 T325 A326	S120-G322 WeakPolarHBondContact OG-CA 3.19Å; S120-G322 PolarHBondContact OG-O 3.13Å; G320-G322 VanDerWaalsContact C-N 3.28Å; G320-G322 PolarHBondContact O-N 3.44Å; G322-T325 WeakPolarHBondContact O-CB 3.38Å; G322-A326 PolarHBondContact O-N 3.34Å; G322-A326 VanDerWaalsContact O-N 3.09Å
323	A	95.6	Very high	93.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-74.5	-37.8	176.8	0	0	0	0	0	111.9	F68 L321 T325 A326 L327 V420	F68-A323 HydrophobicContact CE1-CB 3.6Å; F68-A323 HydrophobicContact CE2-CB 4.28Å; F68-A323 HydrophobicContact CZ-CB 3.46Å; F68-A323 VanDerWaalsContact CZ-CB 3.46Å; L321-A323 HydrophobicContact CB-CB 4.49Å; L321-A323 PolarHBondContact O-N 3.43Å; L321-A323 VanDerWaalsContact O-N 3.1Å; A323-T325 VanDerWaalsContact C-N 3.3Å; A323-T325 PolarHBondContact O-N 3.16Å; A323-A326 WeakPolarHBondContact O-CB 3.31Å; A323-A326 PolarHBondContact O-N 3.37Å; A323-A326 VanDerWaalsContact O-N 3.15Å; A323-L327 WeakPolarHBondContact O-CG 3.2Å; A323-L327 PolarHBondContact O-N 2.94Å; A323-V420 HydrophobicContact CB-CG1 4.1Å
324	L	96.4	Very high	93.9	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63	-39.8	172	-64.6	174.2	0	0	0	111.3	F68 F106 E109 I110 A326 L327 G328	F68-L324 HydrophobicContact CD1-CD2 3.96Å; F68-L324 HydrophobicContact CD1-CG 4.41Å; F68-L324 HydrophobicContact CE1-CD2 4.33Å; F68-L324 HydrophobicContact CE1-CG 4.29Å; F106-L324 HydrophobicContact CD2-CD1 3.44Å; F106-L324 VanDerWaalsContact CD2-CD1 3.44Å; F106-L324 HydrophobicContact CD2-CD2 4.38Å; F106-L324 HydrophobicContact CE2-CD1 3.6Å; F106-L324 HydrophobicContact CE2-CD2 3.67Å; F106-L324 HydrophobicContact CE2-CG 4.29Å; F106-L324 HydrophobicContact CG-CD1 4.03Å; F106-L324 HydrophobicContact CZ-CD1 4.29Å; F106-L324 HydrophobicContact CZ-CD2 3.77Å; E109-L324 HydrophobicContact CB-CB 4.02Å; E109-L324 WeakPolarHBondContact OE2-CB 3.16Å; I110-L324 HydrophobicContact CG1-CB 4.29Å; L324-A326 VanDerWaalsContact C-N 3.32Å; L324-A326 PolarHBondContact O-N 2.98Å; L324-L327 PolarHBondContact O-N 3.25Å; L324-G328 PolarHBondContact O-N 2.88Å
325	T	97.3	Very high	94.2	Very high	3 Å²	3	18.6 Å²	18.6	2%	0.018	9%	0.085	C	C	.	.	H	α-helix	trans	-58.3	-45.1	171.9	-45.1	0	0	0	0	111.5	E109 G113 V123 G322 A323 G328 S329	E109-T325 WeakPolarHBondContact O-CA 3.28Å; G113-T325 WeakPolarHBondContact CA-O 3.34Å; V123-T325 HydrophobicContact CB-CG2 3.88Å; V123-T325 HydrophobicContact CG1-CG2 3.96Å; V123-T325 HydrophobicContact CG2-CG2 3.54Å; G322-T325 WeakPolarHBondContact O-CB 3.38Å; A323-T325 VanDerWaalsContact C-N 3.3Å; A323-T325 PolarHBondContact O-N 3.16Å; T325-G328 PolarHBondContact O-N 3.37Å; T325-S329 PolarHBondContact O-N 3.42Å
326	A	96.8	Very high	94.6	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.2	-47.7	176.2	0	0	0	0	0	111.8	G322 A323 L324 G328 S329 Y330 T427	G322-A326 PolarHBondContact O-N 3.34Å; G322-A326 VanDerWaalsContact O-N 3.09Å; A323-A326 WeakPolarHBondContact O-CB 3.31Å; A323-A326 PolarHBondContact O-N 3.37Å; A323-A326 VanDerWaalsContact O-N 3.15Å; L324-A326 VanDerWaalsContact C-N 3.32Å; L324-A326 PolarHBondContact O-N 2.98Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 2.69Å; A326-S329 VanDerWaalsContact O-CB 3.31Å; A326-S329 WeakPolarHBondContact O-CB 3.25Å; A326-S329 PolarHBondContact O-N 3.31Å; A326-S329 VanDerWaalsContact O-N 3.1Å; A326-S329 PolarHBondContact O-OG 3.22Å; A326-Y330 WeakPolarHBondContact O-CD2 3.42Å; A326-Y330 WeakPolarHBondContact O-CE2 3.26Å; A326-T427 HydrophobicContact CB-CG2 4.06Å
327	L	96.8	Very high	94.8	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-60	-42.5	176.5	-65.8	-176.3	0	0	0	112.1	W55 F61 A323 L324 S329 Y330 V420	W55-L327 HydrophobicContact CH2-CD2 3.76Å; W55-L327 HydrophobicContact CZ2-CB 4.26Å; W55-L327 HydrophobicContact CZ2-CD2 3.56Å; W55-L327 HydrophobicContact CZ2-CG 4.47Å; W55-L327 PolarHBondContact NE1-O 3.1Å; F61-L327 HydrophobicContact CD2-CB 4.23Å; F61-L327 HydrophobicContact CE2-CB 3.95Å; A323-L327 WeakPolarHBondContact O-CG 3.2Å; A323-L327 PolarHBondContact O-N 2.94Å; L324-L327 PolarHBondContact O-N 3.25Å; L327-S329 VanDerWaalsContact C-N 3.28Å; L327-S329 PolarHBondContact O-N 3.49Å; L327-Y330 PolarHBondContact O-N 2.9Å; L327-V420 HydrophobicContact CD1-CG1 3.59Å; L327-V420 HydrophobicContact CD1-CG2 4.35Å; L327-V420 HydrophobicContact CD2-CG1 4.07Å; L327-V420 HydrophobicContact CD2-CG2 4.4Å; L327-V420 HydrophobicContact CG-CG1 3.91Å
328	G	97.2	Very high	95.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.9	-34.1	175	0	0	0	0	0	112.6	Q114 L324 T325 A326 Y330 N331	Q114-G328 WeakPolarHBondContact CA-O 3.48Å; Q114-G328 WeakPolarHBondContact CB-O 3.38Å; Q114-G328 PolarHBondContact N-O 3.18Å; L324-G328 PolarHBondContact O-N 2.88Å; T325-G328 PolarHBondContact O-N 3.37Å; A326-G328 VanDerWaalsContact C-N 3.33Å; A326-G328 PolarHBondContact O-N 2.69Å; G328-Y330 PolarHBondContact O-N 3.02Å; G328-N331 VanDerWaalsContact O-CB 3.3Å; G328-N331 WeakPolarHBondContact O-CB 3.02Å; G328-N331 PolarHBondContact O-N 3Å
329	S	96.7	Very high	95.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.6	-29.3	177.8	85.1	0	0	0	0	113.8	R52 G113 K117 A118 T325 A326 L327	R52-S329 VanDerWaalsContact CD-O 3.28Å; R52-S329 WeakPolarHBondContact CD-O 3.29Å; G113-S329 VanDerWaalsContact O-CA 3.27Å; G113-S329 WeakPolarHBondContact O-CA 3.42Å; K117-S329 WeakPolarHBondContact CD-O 3.49Å; A118-S329 WeakPolarHBondContact O-CB 3.46Å; T325-S329 PolarHBondContact O-N 3.42Å; A326-S329 VanDerWaalsContact O-CB 3.31Å; A326-S329 WeakPolarHBondContact O-CB 3.25Å; A326-S329 PolarHBondContact O-N 3.31Å; A326-S329 VanDerWaalsContact O-N 3.1Å; A326-S329 PolarHBondContact O-OG 3.22Å; L327-S329 VanDerWaalsContact C-N 3.28Å; L327-S329 PolarHBondContact O-N 3.49Å
330	Y	96.3	Very high	95.6	Very high	14 Å²	14	25.4 Å²	25.4	6%	0.055	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.8	177.6	-61.6	-73.1	0	0	0	113.3	R52 E53 T54 W55 V254 A326 L327 G328 E423 T427	R52-Y330 HydrophobicContact CG-CD1 3.88Å; R52-Y330 HydrophobicContact CG-CE1 3.91Å; E53-Y330 HydrophobicContact CB-CD1 4.39Å; E53-Y330 HydrophobicContact CB-CE1 4.5Å; E53-Y330 VanDerWaalsContact O-CD1 3.29Å; E53-Y330 WeakPolarHBondContact O-CD1 3.15Å; T54-Y330 CarbonylContact C-O 3.5Å; T54-Y330 WeakPolarHBondContact CA-O 3.47Å; T54-Y330 WeakPolarHBondContact CB-O 3.41Å; W55-Y330 PolarHBondContact N-O 2.93Å; V254-Y330 HydrophobicContact CG1-CD1 4.12Å; V254-Y330 HydrophobicContact CG1-CD2 3.47Å; V254-Y330 VanDerWaalsContact CG1-CD2 3.47Å; V254-Y330 HydrophobicContact CG1-CE1 4.3Å; V254-Y330 HydrophobicContact CG1-CE2 3.66Å; V254-Y330 HydrophobicContact CG1-CG 3.74Å; V254-Y330 HydrophobicContact CG2-CD1 3.95Å; V254-Y330 HydrophobicContact CG2-CE1 4.39Å; V254-Y330 HydrophobicContact CG2-CG 4.13Å; A326-Y330 WeakPolarHBondContact O-CD2 3.42Å; A326-Y330 WeakPolarHBondContact O-CE2 3.26Å; L327-Y330 PolarHBondContact O-N 2.9Å; G328-Y330 PolarHBondContact O-N 3.02Å; Y330-E423 PolarHBondContact OH-OE1 2.81Å; Y330-T427 HydrophobicContact CE2-CG2 4Å; Y330-T427 WeakPolarHBondContact CE2-OG1 3.35Å; Y330-T427 WeakPolarHBondContact OH-CG2 3.23Å; Y330-T427 PolarHBondContact OH-OG1 3.14Å
331	N	96.1	Very high	95.9	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.011	12%	0.115	C	C	.	.	S	Bend	trans	-65.3	153.8	172.4	-77.2	-19.4	0	0	0	111.2	W55 F61 Q114 K117 G328 N335	W55-N331 PolarHBondContact NE1-OD1 3Å; F61-N331 VanDerWaalsContact CD2-OD1 3.32Å; F61-N331 WeakPolarHBondContact CD2-OD1 3.43Å; F61-N331 WeakPolarHBondContact CG-OD1 3.27Å; F61-N331 WeakPolarHBondContact CZ-ND2 3.3Å; Q114-N331 HydrophobicContact CB-CB 4.47Å; Q114-N331 HydrophobicContact CG-CB 3.95Å; Q114-N331 VanDerWaalsContact OE1-CB 3.28Å; Q114-N331 PolarHBondContact OE1-ND2 3.18Å; Q114-N331 VanDerWaalsContact OE1-ND2 3.15Å; K117-N331 PolarHBondContact NZ-O 3.42Å; G328-N331 VanDerWaalsContact O-CB 3.3Å; G328-N331 WeakPolarHBondContact O-CB 3.02Å; G328-N331 PolarHBondContact O-N 3Å; N331-N335 HydrophobicContact CB-CB 4.1Å; N331-N335 PolarHBondContact ND2-ND2 3.47Å
332	R	94.2	Very high	96.1	Very high	159 Å²	159	27.6 Å²	27.6	60%	0.6	13%	0.126	S	C	*	.			trans	-63.3	146.4	163	-61.6	-179.4	-171.9	175.4	3.4	108.5	T56 N334 N335	T56-R332 PolarHBondContact O-NH2 3.27Å; R332-N334 PolarHBondContact O-N 2.83Å; R332-N335 VanDerWaalsContact O-CB 3.29Å; R332-N335 WeakPolarHBondContact O-CB 3.3Å; R332-N335 PolarHBondContact O-N 3.11Å; R332-N335 VanDerWaalsContact O-N 3.08Å
333	F	92.4	Very high	96.3	Very high	12 Å²	12	30.5 Å²	30.5	5%	0.053	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-39.8	-175.5	-170.9	-104.5	0	0	0	112.8	Q114 F115 N335 M510 Y606	Q114-F333 PolarHBondContact NE2-O 2.82Å; F115-F333 HydrophobicContact CD2-CE2 4.05Å; F115-F333 HydrophobicContact CD2-CZ 4.21Å; F115-F333 HydrophobicContact CE2-CZ 4.4Å; F333-N335 VanDerWaalsContact C-N 3.3Å; F333-N335 PolarHBondContact O-N 3.31Å; F333-M510 HydrophobicContact CD1-CG 4.28Å; F333-M510 HydrophobicContact CD2-CG 4.19Å; F333-M510 HydrophobicContact CD2-SD 4.44Å; F333-M510 HydrophobicContact CE1-CB 4.41Å; F333-M510 HydrophobicContact CE1-CG 3.79Å; F333-M510 HydrophobicContact CE2-CG 3.69Å; F333-M510 HydrophobicContact CE2-SD 4.12Å; F333-M510 HydrophobicContact CG-CG 4.48Å; F333-M510 HydrophobicContact CZ-CG 3.47Å; F333-M510 VanDerWaalsContact CZ-CG 3.47Å; F333-M510 HydrophobicContact CZ-SD 4.48Å; F333-Y606 HydrophobicContact CB-CE2 4.01Å; F333-Y606 WeakPolarHBondContact CB-OH 3.41Å; F333-Y606 AromaticContact CD1-CD1 3.86Å; F333-Y606 HydrophobicContact CD1-CD1 3.86Å; F333-Y606 AromaticContact CD1-CD2 3.75Å; F333-Y606 HydrophobicContact CD1-CD2 3.75Å; F333-Y606 AromaticContact CD1-CE1 3.5Å; F333-Y606 HydrophobicContact CD1-CE1 3.5Å; F333-Y606 VanDerWaalsContact CD1-CE1 3.5Å; F333-Y606 AromaticContact CD1-CE2 3.41Å; F333-Y606 HydrophobicContact CD1-CE2 3.41Å; F333-Y606 VanDerWaalsContact CD1-CE2 3.41Å; F333-Y606 AromaticContact CD1-CG 3.98Å; F333-Y606 HydrophobicContact CD1-CG 3.98Å; F333-Y606 AromaticContact CD1-CZ 3.27Å; F333-Y606 HydrophobicContact CD2-CD2 4.21Å; F333-Y606 AromaticContact CD2-CE2 3.81Å; F333-Y606 HydrophobicContact CD2-CE2 3.81Å; F333-Y606 AromaticContact CE1-CD1 3.7Å; F333-Y606 HydrophobicContact CE1-CD1 3.7Å; F333-Y606 AromaticContact CE1-CD2 3.5Å; F333-Y606 HydrophobicContact CE1-CD2 3.5Å; F333-Y606 AromaticContact CE1-CE1 3.87Å; F333-Y606 HydrophobicContact CE1-CE1 3.87Å; F333-Y606 AromaticContact CE1-CE2 3.7Å; F333-Y606 HydrophobicContact CE1-CE2 3.7Å; F333-Y606 AromaticContact CE1-CG 3.53Å; F333-Y606 HydrophobicContact CE1-CG 3.53Å; F333-Y606 AromaticContact CE1-CZ 3.88Å; F333-Y606 AromaticContact CE2-CD2 3.98Å; F333-Y606 HydrophobicContact CE2-CD2 3.98Å; F333-Y606 HydrophobicContact CE2-CE2 4.06Å; F333-Y606 HydrophobicContact CG-CD2 4.1Å; F333-Y606 HydrophobicContact CG-CE1 4.26Å; F333-Y606 AromaticContact CG-CE2 3.46Å; F333-Y606 HydrophobicContact CG-CE2 3.46Å; F333-Y606 VanDerWaalsContact CG-CE2 3.46Å; F333-Y606 AromaticContact CG-CZ 3.55Å; F333-Y606 AromaticContact CZ-CD2 3.61Å; F333-Y606 HydrophobicContact CZ-CD2 3.61Å; F333-Y606 HydrophobicContact CZ-CE2 4.01Å; F333-Y606 AromaticContact CZ-CG 3.94Å; F333-Y606 HydrophobicContact CZ-CG 3.94Å
334	N	93.7	Very high	96.3	Very high	108 Å²	108	30.7 Å²	30.7	58%	0.578	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	13.2	-179	-57	-13.5	0	0	0	114.7	R332 M510	R332-N334 PolarHBondContact O-N 2.83Å; N334-M510 VanDerWaalsContact CA-O 3.23Å; N334-M510 WeakPolarHBondContact CA-O 3.44Å; N334-M510 PolarHBondContact OD1-O 2.62Å
335	N	95.6	Very high	96.3	Very high	19 Å²	19	30.8 Å²	30.8	10%	0.102	14%	0.142	C	C	.	.			trans	-67.9	138.2	178.7	-177.8	65.6	0	0	0	110.5	Q114 N331 R332 F333 C337 D340 I511	Q114-N335 PolarHBondContact NE2-O 3.49Å; N331-N335 HydrophobicContact CB-CB 4.1Å; N331-N335 PolarHBondContact ND2-ND2 3.47Å; R332-N335 VanDerWaalsContact O-CB 3.29Å; R332-N335 WeakPolarHBondContact O-CB 3.3Å; R332-N335 PolarHBondContact O-N 3.11Å; R332-N335 VanDerWaalsContact O-N 3.08Å; F333-N335 VanDerWaalsContact C-N 3.3Å; F333-N335 PolarHBondContact O-N 3.31Å; N335-C337 PolarHBondContact O-N 3.25Å; N335-D340 PolarHBondContact ND2-OD2 2.81Å; N335-I511 WeakPolarHBondContact O-CG2 3.32Å
336	N	97.1	Very high	96.3	Very high	42 Å²	42	36.3 Å²	36.3	23%	0.225	17%	0.171	C	C	.	.			trans	-79	74.2	-179.5	-170.4	-18.6	0	0	0	111.5	Y338 K339 D340 Y513	N336-Y338 PolarHBondContact O-N 2.88Å; N336-Y338 PolarHBondContact OD1-N 2.64Å; N336-K339 HydrophobicContact CB-CB 4.45Å; N336-K339 PolarHBondContact O-N 3.16Å; N336-K339 PolarHBondContact OD1-N 2.99Å; N336-D340 VanDerWaalsContact O-CG 3.25Å; N336-D340 PolarHBondContact O-N 2.91Å; N336-D340 VanDerWaalsContact O-N 3.17Å; N336-Y513 WeakPolarHBondContact ND2-CE1 3.4Å; N336-Y513 PolarHBondContact ND2-OH 2.93Å; N336-Y513 PolarHBondContact OD1-OH 2.88Å
337	C	97	Very high	96.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-22.3	179.3	52.4	0	0	0	0	113.7	I110 N335 A341	I110-C337 HydrophobicContact CG2-CB 3.57Å; N335-C337 PolarHBondContact O-N 3.25Å; C337-A341 WeakPolarHBondContact O-CB 3.26Å; C337-A341 PolarHBondContact O-N 2.73Å
338	Y	97.6	Very high	96.3	Very high	36 Å²	36	38.8 Å²	38.8	14%	0.141	18%	0.183	C	C	.	.	H	α-helix	trans	-67.8	-48.9	176.2	-179.9	-110.8	0	0	0	111.8	F107 N336 D340 A341 I342 Y513 P515 C516 M519	F107-Y338 AromaticContact CD1-CD2 3.87Å; F107-Y338 HydrophobicContact CD1-CD2 3.87Å; F107-Y338 HydrophobicContact CD1-CE2 4.39Å; F107-Y338 HydrophobicContact CD2-CD2 4.22Å; F107-Y338 AromaticContact CE1-CD2 3.56Å; F107-Y338 HydrophobicContact CE1-CD2 3.56Å; F107-Y338 HydrophobicContact CE1-CE2 4.23Å; F107-Y338 AromaticContact CE2-CD2 3.95Å; F107-Y338 HydrophobicContact CE2-CD2 3.95Å; F107-Y338 HydrophobicContact CE2-CG 4.3Å; F107-Y338 HydrophobicContact CG-CD2 4.19Å; F107-Y338 AromaticContact CZ-CD2 3.58Å; F107-Y338 HydrophobicContact CZ-CD2 3.58Å; F107-Y338 HydrophobicContact CZ-CG 4.11Å; N336-Y338 PolarHBondContact O-N 2.88Å; N336-Y338 PolarHBondContact OD1-N 2.64Å; Y338-D340 VanDerWaalsContact C-N 3.31Å; Y338-A341 PolarHBondContact O-N 3.22Å; Y338-I342 HydrophobicContact CD1-CD1 4.26Å; Y338-I342 HydrophobicContact CE1-CD1 3.77Å; Y338-I342 HydrophobicContact CE2-CD1 4.23Å; Y338-I342 PolarHBondContact O-N 2.76Å; Y338-Y513 HydrophobicContact CD1-CE2 4.2Å; Y338-P515 HydrophobicContact CD2-CB 3.97Å; Y338-P515 HydrophobicContact CE2-CB 4.02Å; Y338-P515 HydrophobicContact CG-CB 4.33Å; Y338-C516 VanDerWaalsContact OH-CB 3.25Å; Y338-C516 WeakPolarHBondContact OH-CB 3.22Å; Y338-M519 HydrophobicContact CE2-CE 3.75Å; Y338-M519 HydrophobicContact CE2-CG 3.8Å; Y338-M519 HydrophobicContact CE2-SD 4.39Å
339	K	97	Very high	96.3	Very high	122 Å²	122	39.9 Å²	39.9	53%	0.53	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-41.7	175.7	-175.9	178.9	177.1	-179.7	0	110.8	N336 A341 I342 I343	N336-K339 HydrophobicContact CB-CB 4.45Å; N336-K339 PolarHBondContact O-N 3.16Å; N336-K339 PolarHBondContact OD1-N 2.99Å; K339-A341 PolarHBondContact O-N 3.3Å; K339-I342 PolarHBondContact O-N 2.59Å; K339-I343 HydrophobicContact CD-CD1 4.4Å; K339-I343 HydrophobicContact CG-CD1 3.84Å; K339-I343 HydrophobicContact CG-CG1 4.47Å; K339-I343 WeakPolarHBondContact O-CG1 3.36Å; K339-I343 PolarHBondContact O-N 3.47Å
340	D	96.8	Very high	96.3	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-60.6	-46.2	179.2	-64	-15.8	0	0	0	111.2	Q58 F61 I62 N335 N336 Y338 I342 I343 L344	Q58-D340 PolarHBondContact NE2-OD1 3.1Å; Q58-D340 PolarHBondContact NE2-OD2 3.3Å; F61-D340 HydrophobicContact CE1-CB 3.99Å; I62-D340 HydrophobicContact CD1-CB 3.74Å; N335-D340 PolarHBondContact ND2-OD2 2.81Å; N336-D340 VanDerWaalsContact O-CG 3.25Å; N336-D340 PolarHBondContact O-N 2.91Å; N336-D340 VanDerWaalsContact O-N 3.17Å; Y338-D340 VanDerWaalsContact C-N 3.31Å; D340-I342 VanDerWaalsContact C-N 3.34Å; D340-I342 PolarHBondContact O-N 2.66Å; D340-I343 PolarHBondContact O-N 3.32Å; D340-L344 HydrophobicContact CB-CD1 4.49Å; D340-L344 WeakPolarHBondContact O-CB 3.45Å; D340-L344 WeakPolarHBondContact O-CD1 3.2Å; D340-L344 WeakPolarHBondContact O-CG 3.49Å; D340-L344 PolarHBondContact O-N 2.69Å
341	A	97.1	Very high	96.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-42.3	177.8	0	0	0	0	0	112.8	F106 F107 C337 Y338 K339 A345	F106-A341 HydrophobicContact CD1-CB 3.9Å; F106-A341 HydrophobicContact CE1-CB 4.45Å; F107-A341 HydrophobicContact CB-CB 3.77Å; F107-A341 HydrophobicContact CD2-CB 4.14Å; F107-A341 HydrophobicContact CG-CB 4.34Å; C337-A341 WeakPolarHBondContact O-CB 3.26Å; C337-A341 PolarHBondContact O-N 2.73Å; Y338-A341 PolarHBondContact O-N 3.22Å; K339-A341 PolarHBondContact O-N 3.3Å; A341-A345 VanDerWaalsContact O-CB 3.28Å; A341-A345 WeakPolarHBondContact O-CB 3.06Å; A341-A345 PolarHBondContact O-N 3.14Å
342	I	96.9	Very high	96.3	Very high	56 Å²	56	41.1 Å²	41.1	29%	0.287	21%	0.208	S	C	.	.	H	α-helix	trans	-65.9	-45.4	177.1	-65.9	169.4	0	0	0	110.9	I103 Y338 K339 D340 A345 L346	I103-I342 HydrophobicContact CG2-CG1 4.37Å; Y338-I342 HydrophobicContact CD1-CD1 4.26Å; Y338-I342 HydrophobicContact CE1-CD1 3.77Å; Y338-I342 HydrophobicContact CE2-CD1 4.23Å; Y338-I342 PolarHBondContact O-N 2.76Å; K339-I342 PolarHBondContact O-N 2.59Å; D340-I342 VanDerWaalsContact C-N 3.34Å; D340-I342 PolarHBondContact O-N 2.66Å; I342-A345 PolarHBondContact O-N 3.04Å; I342-L346 HydrophobicContact CG2-CD1 4.16Å; I342-L346 WeakPolarHBondContact O-CG 3.4Å; I342-L346 PolarHBondContact O-N 2.84Å
343	I	97.3	Very high	96.4	Very high	63 Å²	63	37.4 Å²	37.4	32%	0.323	20%	0.196	S	C	.	.	H	α-helix	trans	-61.8	-46.9	178.9	-70.5	170.8	0	0	0	110.4	K339 D340 A345 L346 I347	K339-I343 HydrophobicContact CD-CD1 4.4Å; K339-I343 HydrophobicContact CG-CD1 3.84Å; K339-I343 HydrophobicContact CG-CG1 4.47Å; K339-I343 WeakPolarHBondContact O-CG1 3.36Å; K339-I343 PolarHBondContact O-N 3.47Å; D340-I343 PolarHBondContact O-N 3.32Å; I343-A345 VanDerWaalsContact C-N 3.34Å; I343-A345 PolarHBondContact O-N 3.4Å; I343-L346 PolarHBondContact O-N 3.2Å; I343-I347 HydrophobicContact CG2-CD1 3.72Å; I343-I347 HydrophobicContact CG2-CG1 4.37Å; I343-I347 WeakPolarHBondContact O-CG1 3.44Å; I343-I347 PolarHBondContact O-N 3.06Å
344	L	96.8	Very high	96.7	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-41.2	-179.1	-71.8	165.9	0	0	0	111.9	F61 I62 C65 V66 F106 I110 D340 L346 I347 N348	F61-L344 HydrophobicContact CE1-CD1 4.48Å; I62-L344 HydrophobicContact CD1-CD1 4.23Å; I62-L344 HydrophobicContact CD1-CD2 4.5Å; I62-L344 HydrophobicContact CD1-CG 4.32Å; I62-L344 HydrophobicContact CG2-CD2 4.13Å; C65-L344 HydrophobicContact CB-CD1 3.46Å; C65-L344 VanDerWaalsContact CB-CD1 3.46Å; C65-L344 HydrophobicContact CB-CD2 3.46Å; C65-L344 VanDerWaalsContact CB-CD2 3.46Å; C65-L344 HydrophobicContact CB-CG 4.08Å; V66-L344 HydrophobicContact CG2-CD2 3.64Å; F106-L344 HydrophobicContact CE1-CB 3.78Å; F106-L344 HydrophobicContact CE1-CD1 3.65Å; F106-L344 HydrophobicContact CE1-CG 4.36Å; F106-L344 HydrophobicContact CZ-CB 3.81Å; F106-L344 HydrophobicContact CZ-CD1 3.88Å; F106-L344 HydrophobicContact CZ-CG 4.42Å; I110-L344 HydrophobicContact CD1-CD1 4.39Å; D340-L344 HydrophobicContact CB-CD1 4.49Å; D340-L344 WeakPolarHBondContact O-CB 3.45Å; D340-L344 WeakPolarHBondContact O-CD1 3.2Å; D340-L344 WeakPolarHBondContact O-CG 3.49Å; D340-L344 PolarHBondContact O-N 2.69Å; L344-L346 PolarHBondContact O-N 3.45Å; L344-I347 PolarHBondContact O-N 3.28Å; L344-N348 WeakPolarHBondContact O-CB 3.34Å; L344-N348 PolarHBondContact O-N 3.47Å
345	A	96.2	Very high	96.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-43.1	173.9	0	0	0	0	0	113.1	I103 Y317 A341 I342 I343 N348 S349	I103-A345 HydrophobicContact CD1-CB 3.96Å; I103-A345 HydrophobicContact CG1-CB 3.47Å; I103-A345 VanDerWaalsContact CG1-CB 3.47Å; Y317-A345 HydrophobicContact CE2-CB 3.56Å; Y317-A345 WeakPolarHBondContact OH-CA 3.39Å; Y317-A345 WeakPolarHBondContact OH-CB 3.42Å; Y317-A345 PolarHBondContact OH-O 2.94Å; A341-A345 VanDerWaalsContact O-CB 3.28Å; A341-A345 WeakPolarHBondContact O-CB 3.06Å; A341-A345 PolarHBondContact O-N 3.14Å; I342-A345 PolarHBondContact O-N 3.04Å; I343-A345 VanDerWaalsContact C-N 3.34Å; I343-A345 PolarHBondContact O-N 3.4Å; A345-N348 PolarHBondContact O-N 3.36Å; A345-S349 WeakPolarHBondContact O-CB 3.28Å; A345-S349 PolarHBondContact O-N 3.04Å; A345-S349 PolarHBondContact O-OG 3.04Å
346	L	96.7	Very high	96.7	Very high	120 Å²	120	33.7 Å²	33.7	63%	0.628	17%	0.174	S	C	*	.	H	α-helix	trans	-65.7	-41.9	176.2	-70.9	173.5	0	0	0	111.9	I342 I343 L344 G350	I342-L346 HydrophobicContact CG2-CD1 4.16Å; I342-L346 WeakPolarHBondContact O-CG 3.4Å; I342-L346 PolarHBondContact O-N 2.84Å; I343-L346 PolarHBondContact O-N 3.2Å; L344-L346 PolarHBondContact O-N 3.45Å; L346-G350 WeakPolarHBondContact O-CA 3.24Å; L346-G350 PolarHBondContact O-N 3.48Å
347	I	97.2	Very high	96.7	Very high	52 Å²	52	34 Å²	34	27%	0.267	17%	0.173	S	C	.	.	H	α-helix	trans	-62.3	-47.9	175.4	-68.4	168.4	0	0	0	109.9	V66 V70 Y269 I343 L344 T351	V66-I347 HydrophobicContact CG1-CG2 4.04Å; V66-I347 HydrophobicContact CG2-CD1 3.91Å; V66-I347 HydrophobicContact CG2-CG2 3.91Å; V70-I347 HydrophobicContact CG2-CG2 4.33Å; Y269-I347 WeakPolarHBondContact OH-CG2 3Å; I343-I347 HydrophobicContact CG2-CD1 3.72Å; I343-I347 HydrophobicContact CG2-CG1 4.37Å; I343-I347 WeakPolarHBondContact O-CG1 3.44Å; I343-I347 PolarHBondContact O-N 3.06Å; L344-I347 PolarHBondContact O-N 3.28Å; I347-T351 VanDerWaalsContact O-CB 3.27Å; I347-T351 WeakPolarHBondContact O-CB 3.37Å; I347-T351 PolarHBondContact O-N 3.29Å; I347-T351 PolarHBondContact O-OG1 3.09Å
348	N	96.3	Very high	96.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-55.5	-179.4	-177.1	74.1	0	0	0	111.9	A69 N74 S316 Y317 L344 A345 T351 S352	A69-N348 HydrophobicContact CB-CB 4.33Å; A69-N348 PolarHBondContact O-OD1 3.39Å; N74-N348 PolarHBondContact ND2-O 3.23Å; N74-N348 PolarHBondContact ND2-OD1 3.27Å; S316-N348 PolarHBondContact O-OD1 2.94Å; S316-N348 PolarHBondContact OG-ND2 3.49Å; S316-N348 PolarHBondContact OG-OD1 3.38Å; S316-N348 VanDerWaalsContact OG-OD1 3.1Å; Y317-N348 HydrophobicContact CD1-CB 4.44Å; Y317-N348 WeakPolarHBondContact CD1-ND2 3.19Å; Y317-N348 HydrophobicContact CE1-CB 4.14Å; Y317-N348 WeakPolarHBondContact CE1-ND2 2.92Å; L344-N348 WeakPolarHBondContact O-CB 3.34Å; L344-N348 PolarHBondContact O-N 3.47Å; A345-N348 PolarHBondContact O-N 3.36Å; N348-T351 PolarHBondContact O-N 2.91Å; N348-S352 PolarHBondContact O-N 2.95Å; N348-S352 PolarHBondContact O-OG 3.18Å; N348-S352 VanDerWaalsContact O-OG 3.09Å
349	S	96.7	Very high	96.4	Very high	23 Å²	23	32.8 Å²	32.8	16%	0.161	17%	0.169	C	C	.	.	H	α-helix	trans	-67	-38	-179.1	-70.1	0	0	0	0	112.8	Y94 Y317 A345 T351 S352 F353	Y94-S349 WeakPolarHBondContact CE1-OG 3.2Å; Y94-S349 PolarHBondContact OH-OG 3.09Å; Y94-S349 VanDerWaalsContact OH-OG 3.13Å; Y317-S349 PolarHBondContact OH-OG 3.25Å; Y317-S349 VanDerWaalsContact OH-OG 3.05Å; A345-S349 WeakPolarHBondContact O-CB 3.28Å; A345-S349 PolarHBondContact O-N 3.04Å; A345-S349 PolarHBondContact O-OG 3.04Å; S349-T351 VanDerWaalsContact C-N 3.34Å; S349-S352 PolarHBondContact O-N 3.45Å; S349-F353 PolarHBondContact O-N 2.91Å
350	G	96.8	Very high	96.2	Very high	37 Å²	37	27 Å²	27	38%	0.381	14%	0.144	S	C	.	.	H	α-helix	trans	-64.3	-39.1	175	0	0	0	0	0	112.2	L346 F353 F354	L346-G350 WeakPolarHBondContact O-CA 3.24Å; L346-G350 PolarHBondContact O-N 3.48Å; G350-F353 PolarHBondContact O-N 3.34Å; G350-F354 WeakPolarHBondContact O-CB 3.37Å; G350-F354 PolarHBondContact O-N 3.44Å
351	T	97	Very high	96.2	Very high	6 Å²	6	26.9 Å²	26.9	4%	0.037	14%	0.144	C	C	.	.	H	α-helix	trans	-66.9	-43	176.3	-53.4	0	0	0	0	111.4	V70 Y269 L272 I347 N348 S349 F353 F354 A355	V70-T351 HydrophobicContact CG1-CG2 3.54Å; V70-T351 HydrophobicContact CG2-CG2 4.47Å; Y269-T351 HydrophobicContact CE1-CG2 3.72Å; Y269-T351 WeakPolarHBondContact CE1-OG1 3.16Å; Y269-T351 PolarHBondContact OH-OG1 3.19Å; L272-T351 HydrophobicContact CD1-CG2 4.3Å; I347-T351 VanDerWaalsContact O-CB 3.27Å; I347-T351 WeakPolarHBondContact O-CB 3.37Å; I347-T351 PolarHBondContact O-N 3.29Å; I347-T351 PolarHBondContact O-OG1 3.09Å; N348-T351 PolarHBondContact O-N 2.91Å; S349-T351 VanDerWaalsContact C-N 3.34Å; T351-F353 VanDerWaalsContact C-N 3.34Å; T351-F353 PolarHBondContact O-N 2.91Å; T351-F354 PolarHBondContact O-N 2.94Å; T351-A355 VanDerWaalsContact O-CB 3.31Å; T351-A355 WeakPolarHBondContact O-CB 3.34Å; T351-A355 PolarHBondContact O-N 3.32Å
352	S	96.3	Very high	96	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-56.6	-48.2	173.7	-59.5	0	0	0	0	111.8	N74 F78 N348 S349 F354 A355 G356	N74-S352 WeakPolarHBondContact CB-OG 3.21Å; N74-S352 PolarHBondContact ND2-OG 3.37Å; F78-S352 WeakPolarHBondContact CD1-O 3.44Å; F78-S352 WeakPolarHBondContact CE1-O 3.39Å; N348-S352 PolarHBondContact O-N 2.95Å; N348-S352 PolarHBondContact O-OG 3.18Å; N348-S352 VanDerWaalsContact O-OG 3.09Å; S349-S352 PolarHBondContact O-N 3.45Å; S352-F354 PolarHBondContact O-N 3.15Å; S352-A355 PolarHBondContact O-N 2.88Å; S352-G356 PolarHBondContact O-N 2.84Å
353	F	96.9	Very high	95.7	Very high	81 Å²	81	24.7 Å²	24.7	36%	0.355	13%	0.132	S	C	.	.	H	α-helix	trans	-62.3	-44.8	178.7	-178.7	-114.4	0	0	0	112.3	L91 Y292 L293 S349 G350 T351 G356 F357	L91-F353 HydrophobicContact CD1-CD2 4.13Å; L91-F353 HydrophobicContact CD1-CE2 3.77Å; L91-F353 HydrophobicContact CD2-CD2 4.22Å; Y292-F353 HydrophobicContact CE1-CE2 4.45Å; Y292-F353 WeakPolarHBondContact OH-CD2 3.25Å; Y292-F353 PolarHBondContact OH-O 3.36Å; L293-F353 HydrophobicContact CD2-CE2 3.85Å; L293-F353 HydrophobicContact CD2-CZ 4.41Å; S349-F353 PolarHBondContact O-N 2.91Å; G350-F353 PolarHBondContact O-N 3.34Å; T351-F353 VanDerWaalsContact C-N 3.34Å; T351-F353 PolarHBondContact O-N 2.91Å; F353-G356 PolarHBondContact O-N 2.74Å; F353-F357 HydrophobicContact CD1-CE2 4.08Å; F353-F357 AromaticContact CE1-CE2 3.59Å; F353-F357 HydrophobicContact CE1-CE2 3.59Å; F353-F357 HydrophobicContact CE1-CZ 4.16Å; F353-F357 HydrophobicContact CE2-CE2 4.05Å; F353-F357 AromaticContact CZ-CE2 3.56Å; F353-F357 HydrophobicContact CZ-CE2 3.56Å; F353-F357 AromaticContact CZ-CZ 3.86Å; F353-F357 HydrophobicContact CZ-CZ 3.86Å; F353-F357 WeakPolarHBondContact O-CD2 3.21Å
354	F	97.3	Very high	95.6	Very high	61 Å²	61	21.8 Å²	21.8	27%	0.268	12%	0.118	S	C	.	.	H	α-helix	trans	-63.1	-45.7	177.4	-179.9	-104.1	0	0	0	112.5	L272 V273 L276 G350 T351 S352 G356 F357 V358	L272-F354 HydrophobicContact CB-CD1 4.33Å; L272-F354 HydrophobicContact CB-CE1 3.77Å; V273-F354 HydrophobicContact CG2-CE1 4.34Å; V273-F354 HydrophobicContact CG2-CZ 3.98Å; L276-F354 HydrophobicContact CB-CZ 4.37Å; L276-F354 HydrophobicContact CD2-CD2 4.39Å; L276-F354 HydrophobicContact CD2-CE2 3.4Å; L276-F354 HydrophobicContact CD2-CZ 3.59Å; G350-F354 WeakPolarHBondContact O-CB 3.37Å; G350-F354 PolarHBondContact O-N 3.44Å; T351-F354 PolarHBondContact O-N 2.94Å; S352-F354 PolarHBondContact O-N 3.15Å; F354-G356 PolarHBondContact O-N 3.46Å; F354-F357 WeakPolarHBondContact O-CB 3.43Å; F354-F357 PolarHBondContact O-N 2.96Å; F354-V358 HydrophobicContact CD1-CG2 4.45Å; F354-V358 HydrophobicContact CE1-CG2 4.21Å; F354-V358 PolarHBondContact O-N 2.88Å
355	A	95.4	Very high	95.4	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-28.3	178.3	0	0	0	0	0	112.4	V75 T351 S352 F357 V358 V359	V75-A355 HydrophobicContact CB-CB 4.36Å; V75-A355 HydrophobicContact CG1-CB 4.38Å; V75-A355 HydrophobicContact CG2-CB 4.25Å; T351-A355 VanDerWaalsContact O-CB 3.31Å; T351-A355 WeakPolarHBondContact O-CB 3.34Å; T351-A355 PolarHBondContact O-N 3.32Å; S352-A355 PolarHBondContact O-N 2.88Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 3.39Å; A355-V358 WeakPolarHBondContact O-CB 3.48Å; A355-V358 PolarHBondContact O-N 2.97Å; A355-V358 VanDerWaalsContact O-N 3.13Å; A355-V359 PolarHBondContact O-N 2.93Å
356	G	94.9	Very high	95.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.8	-41.4	170.6	0	0	0	0	0	113.7	S352 F353 F354 V358 F360	S352-G356 PolarHBondContact O-N 2.84Å; F353-G356 PolarHBondContact O-N 2.74Å; F354-G356 PolarHBondContact O-N 3.46Å; G356-V358 PolarHBondContact O-N 2.89Å; G356-F360 WeakPolarHBondContact O-CB 3.33Å; G356-F360 WeakPolarHBondContact O-CD2 3.4Å; G356-F360 PolarHBondContact O-N 3.4Å
357	F	97.1	Very high	94.8	Very high	48 Å²	48	17.2 Å²	17.2	21%	0.211	9%	0.094	C	C	.	.	H	α-helix	trans	-65.4	-39.3	174.2	-69	-91.8	0	0	0	112.2	L276 I289 Y292 L293 F353 F354 A355 S361	L276-F357 HydrophobicContact CD1-CB 3.74Å; I289-F357 HydrophobicContact CG1-CD1 4.36Å; I289-F357 HydrophobicContact CG2-CD1 3.97Å; I289-F357 HydrophobicContact CG2-CE1 3.94Å; Y292-F357 HydrophobicContact CE1-CD2 4.06Å; Y292-F357 HydrophobicContact CE1-CE2 4.08Å; Y292-F357 HydrophobicContact CE1-CG 4.46Å; L293-F357 HydrophobicContact CD1-CE1 3.92Å; L293-F357 HydrophobicContact CD1-CZ 3.77Å; F353-F357 HydrophobicContact CD1-CE2 4.08Å; F353-F357 AromaticContact CE1-CE2 3.59Å; F353-F357 HydrophobicContact CE1-CE2 3.59Å; F353-F357 HydrophobicContact CE1-CZ 4.16Å; F353-F357 HydrophobicContact CE2-CE2 4.05Å; F353-F357 AromaticContact CZ-CE2 3.56Å; F353-F357 HydrophobicContact CZ-CE2 3.56Å; F353-F357 AromaticContact CZ-CZ 3.86Å; F353-F357 HydrophobicContact CZ-CZ 3.86Å; F353-F357 WeakPolarHBondContact O-CD2 3.21Å; F354-F357 WeakPolarHBondContact O-CB 3.43Å; F354-F357 PolarHBondContact O-N 2.96Å; A355-F357 VanDerWaalsContact C-N 3.32Å; A355-F357 PolarHBondContact O-N 3.39Å; F357-S361 WeakPolarHBondContact O-CB 3.42Å; F357-S361 PolarHBondContact O-N 2.9Å; F357-S361 PolarHBondContact O-OG 3.37Å
358	V	95.2	Very high	94.5	Very high	3 Å²	3	16.8 Å²	16.8	2%	0.018	10%	0.099	C	C	.	.	H	α-helix	trans	-61.4	-52.5	177.5	-174.7	0	0	0	0	110.4	L272 L275 L276 F354 A355 G356 S361 I362	L272-V358 HydrophobicContact CB-CG2 4.37Å; L272-V358 HydrophobicContact CD2-CB 4.48Å; L272-V358 HydrophobicContact CD2-CG1 4.35Å; L272-V358 HydrophobicContact CD2-CG2 4.2Å; L272-V358 WeakPolarHBondContact O-CG2 3.47Å; L275-V358 HydrophobicContact CB-CG1 3.58Å; L275-V358 HydrophobicContact CD1-CG1 4.4Å; L276-V358 HydrophobicContact CB-CG2 4.02Å; L276-V358 HydrophobicContact CD1-CG2 4.34Å; F354-V358 HydrophobicContact CD1-CG2 4.45Å; F354-V358 HydrophobicContact CE1-CG2 4.21Å; F354-V358 PolarHBondContact O-N 2.88Å; A355-V358 WeakPolarHBondContact O-CB 3.48Å; A355-V358 PolarHBondContact O-N 2.97Å; A355-V358 VanDerWaalsContact O-N 3.13Å; G356-V358 PolarHBondContact O-N 2.89Å; V358-S361 PolarHBondContact O-OG 3.14Å; V358-I362 HydrophobicContact CG1-CD1 4.39Å; V358-I362 WeakPolarHBondContact O-CG1 3.24Å; V358-I362 PolarHBondContact O-N 3.43Å
359	V	92.8	Very high	94	Very high	7 Å²	7	19.8 Å²	19.8	4%	0.042	11%	0.113	C	C	.	.	H	α-helix	trans	-65.1	-49.1	-177.7	172.2	0	0	0	0	111.1	V75 P79 A355 S361 I362 L363	V75-V359 WeakPolarHBondContact O-CG2 3.35Å; P79-V359 HydrophobicContact CB-CB 4.28Å; P79-V359 HydrophobicContact CB-CG1 4.37Å; P79-V359 HydrophobicContact CG-CB 4.41Å; P79-V359 HydrophobicContact CG-CG2 4.32Å; A355-V359 PolarHBondContact O-N 2.93Å; V359-S361 PolarHBondContact O-N 3.11Å; V359-I362 PolarHBondContact O-N 3.42Å; V359-L363 HydrophobicContact CG1-CD1 3.72Å; V359-L363 HydrophobicContact CG1-CG 4.1Å; V359-L363 WeakPolarHBondContact O-CG 3.24Å; V359-L363 PolarHBondContact O-N 2.96Å
360	F	93.6	Very high	93.3	Very high	1 Å²	1	19.9 Å²	19.9	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-74.1	-27.9	-174.4	-86	-85.3	0	0	0	114.3	P79 Y83 G288 Y291 Y292 G356 I362 L363 G364 I374	P79-F360 HydrophobicContact CB-CD2 4.04Å; P79-F360 HydrophobicContact CB-CE2 3.68Å; P79-F360 WeakPolarHBondContact O-CE2 3.22Å; Y83-F360 HydrophobicContact CD1-CE1 4.29Å; Y83-F360 HydrophobicContact CD1-CE2 4.27Å; Y83-F360 AromaticContact CD1-CZ 3.42Å; Y83-F360 HydrophobicContact CD1-CZ 3.42Å; Y83-F360 VanDerWaalsContact CD1-CZ 3.42Å; Y83-F360 HydrophobicContact CE1-CZ 4.2Å; Y83-F360 HydrophobicContact CG-CE1 4.33Å; Y83-F360 AromaticContact CG-CZ 3.79Å; Y83-F360 HydrophobicContact CG-CZ 3.79Å; G288-F360 WeakPolarHBondContact CA-O 3.4Å; G288-F360 WeakPolarHBondContact O-CB 3.1Å; G288-F360 WeakPolarHBondContact O-CD1 3.36Å; Y291-F360 HydrophobicContact CD1-CD1 4.34Å; Y291-F360 AromaticContact CD1-CE1 3.79Å; Y291-F360 HydrophobicContact CD1-CE1 3.79Å; Y291-F360 HydrophobicContact CE1-CE1 4.4Å; Y292-F360 AromaticContact CD2-CD2 3.73Å; Y292-F360 HydrophobicContact CD2-CD2 3.73Å; Y292-F360 AromaticContact CD2-CE2 3.89Å; Y292-F360 HydrophobicContact CD2-CE2 3.89Å; Y292-F360 HydrophobicContact CD2-CG 4.46Å; Y292-F360 HydrophobicContact CG-CB 4.4Å; Y292-F360 AromaticContact CG-CD2 3.79Å; Y292-F360 HydrophobicContact CG-CD2 3.79Å; Y292-F360 HydrophobicContact CG-CE2 4.36Å; Y292-F360 HydrophobicContact CG-CG 4.12Å; G356-F360 WeakPolarHBondContact O-CB 3.33Å; G356-F360 WeakPolarHBondContact O-CD2 3.4Å; G356-F360 PolarHBondContact O-N 3.4Å; F360-I362 VanDerWaalsContact C-N 3.3Å; F360-I362 PolarHBondContact O-N 2.84Å; F360-L363 HydrophobicContact CE1-CD1 4.4Å; F360-G364 PolarHBondContact O-N 3.45Å; F360-I374 HydrophobicContact CD1-CD1 3.73Å; F360-I374 HydrophobicContact CE1-CD1 4.1Å
361	S	95.4	Very high	92.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-39.6	170.4	59.9	0	0	0	0	111.7	A285 F357 V358 V359 F365	A285-S361 WeakPolarHBondContact CA-O 3.15Å; F357-S361 WeakPolarHBondContact O-CB 3.42Å; F357-S361 PolarHBondContact O-N 2.9Å; F357-S361 PolarHBondContact O-OG 3.37Å; V358-S361 PolarHBondContact O-OG 3.14Å; V359-S361 PolarHBondContact O-N 3.11Å; S361-F365 PolarHBondContact O-N 3.5Å
362	I	93.6	Very high	92	Very high	3 Å²	3	22 Å²	22	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-74.4	-40.6	177.6	-65.8	170.9	0	0	0	111.8	L275 V358 V359 F360 G364 F365 M366 Y389 A392	L275-I362 HydrophobicContact CB-CD1 4.45Å; V358-I362 HydrophobicContact CG1-CD1 4.39Å; V358-I362 WeakPolarHBondContact O-CG1 3.24Å; V358-I362 PolarHBondContact O-N 3.43Å; V359-I362 PolarHBondContact O-N 3.42Å; F360-I362 VanDerWaalsContact C-N 3.3Å; F360-I362 PolarHBondContact O-N 2.84Å; I362-G364 VanDerWaalsContact C-N 3.35Å; I362-F365 WeakPolarHBondContact O-CB 3.42Å; I362-F365 PolarHBondContact O-N 3.01Å; I362-M366 PolarHBondContact O-N 3.46Å; I362-Y389 HydrophobicContact CD1-CE2 3.56Å; I362-Y389 HydrophobicContact CG2-CD2 4.36Å; I362-Y389 HydrophobicContact CG2-CE2 4.16Å; I362-A392 HydrophobicContact CG2-CB 3.47Å; I362-A392 VanDerWaalsContact CG2-CB 3.47Å
363	L	91.1	Very high	91.6	Very high	7 Å²	7	27.6 Å²	27.6	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-66.8	-35.6	175.1	-69.4	-179.3	0	0	0	112.3	V359 F360 F365 M366 A367 I374 V377 A378 L384 A388	V359-L363 HydrophobicContact CG1-CD1 3.72Å; V359-L363 HydrophobicContact CG1-CG 4.1Å; V359-L363 WeakPolarHBondContact O-CG 3.24Å; V359-L363 PolarHBondContact O-N 2.96Å; F360-L363 HydrophobicContact CE1-CD1 4.4Å; L363-F365 VanDerWaalsContact C-N 3.31Å; L363-F365 PolarHBondContact O-N 3.46Å; L363-M366 HydrophobicContact CD2-SD 4.49Å; L363-M366 PolarHBondContact O-N 2.86Å; L363-A367 WeakPolarHBondContact O-CB 3.35Å; L363-A367 PolarHBondContact O-N 3.37Å; L363-I374 HydrophobicContact CB-CD1 4.2Å; L363-I374 HydrophobicContact CB-CG1 4.49Å; L363-V377 HydrophobicContact CB-CG2 4.34Å; L363-V377 HydrophobicContact CD2-CG2 4.41Å; L363-A378 HydrophobicContact CD1-CB 4.26Å; L363-L384 HydrophobicContact CD1-CD1 4.28Å; L363-A388 HydrophobicContact CD2-CB 4.41Å
364	G	94.1	Very high	91.1	Very high	2 Å²	2	24.2 Å²	24.2	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-42	172.6	0	0	0	0	0	111.9	G284 F360 I362 A367 A368	G284-G364 CarbonylContact O-C 3.39Å; G284-G364 WeakPolarHBondContact O-CA 3.32Å; F360-G364 PolarHBondContact O-N 3.45Å; I362-G364 VanDerWaalsContact C-N 3.35Å; G364-A367 PolarHBondContact O-N 3.17Å; G364-A368 WeakPolarHBondContact O-CB 3.46Å; G364-A368 PolarHBondContact O-N 3.03Å
365	F	93	Very high	90.4	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-48.2	171.5	167.3	-112.9	0	0	0	113.1	L282 P283 S361 I362 L363 A367 A368 E369 L395 M396	L282-F365 HydrophobicContact CB-CB 3.73Å; L282-F365 HydrophobicContact CB-CD2 3.84Å; L282-F365 HydrophobicContact CB-CG 3.78Å; L282-F365 HydrophobicContact CD1-CB 3.97Å; L282-F365 HydrophobicContact CD1-CD1 3.73Å; L282-F365 HydrophobicContact CD1-CD2 4.47Å; L282-F365 HydrophobicContact CD1-CE1 4.35Å; L282-F365 HydrophobicContact CD1-CG 3.78Å; L282-F365 HydrophobicContact CD2-CD1 4.42Å; L282-F365 HydrophobicContact CD2-CD2 4.19Å; L282-F365 HydrophobicContact CD2-CE1 4.41Å; L282-F365 HydrophobicContact CD2-CE2 4.22Å; L282-F365 HydrophobicContact CD2-CG 4.29Å; L282-F365 HydrophobicContact CD2-CZ 4.32Å; L282-F365 HydrophobicContact CG-CB 4.42Å; L282-F365 HydrophobicContact CG-CD1 4.46Å; L282-F365 HydrophobicContact CG-CD2 4.38Å; L282-F365 HydrophobicContact CG-CG 4.16Å; P283-F365 HydrophobicContact CG-CD2 3.81Å; P283-F365 HydrophobicContact CG-CE2 3.95Å; P283-F365 VanDerWaalsContact O-CA 3.22Å; P283-F365 WeakPolarHBondContact O-CA 3.21Å; P283-F365 WeakPolarHBondContact O-CB 3.32Å; S361-F365 PolarHBondContact O-N 3.5Å; I362-F365 WeakPolarHBondContact O-CB 3.42Å; I362-F365 PolarHBondContact O-N 3.01Å; L363-F365 VanDerWaalsContact C-N 3.31Å; L363-F365 PolarHBondContact O-N 3.46Å; F365-A367 VanDerWaalsContact C-N 3.26Å; F365-A367 PolarHBondContact O-N 3.02Å; F365-A368 PolarHBondContact O-N 3.03Å; F365-E369 HydrophobicContact CE2-CB 4.31Å; F365-E369 WeakPolarHBondContact O-CB 3.16Å; F365-E369 PolarHBondContact O-N 3.05Å; F365-L395 HydrophobicContact CE1-CB 3.65Å; F365-L395 HydrophobicContact CZ-CB 3.84Å; F365-M396 HydrophobicContact CD1-CG 4.42Å; F365-M396 HydrophobicContact CE1-CG 3.76Å; F365-M396 HydrophobicContact CZ-CG 4.47Å
366	M	90	Very high	89.8	Confident	14 Å²	14	31.8 Å²	31.8	7%	0.069	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-40.7	177.4	-179.9	178.9	159.4	0	0	111.9	I362 L363 Q370 V377 R391 A392 L395	I362-M366 PolarHBondContact O-N 3.46Å; L363-M366 HydrophobicContact CD2-SD 4.49Å; L363-M366 PolarHBondContact O-N 2.86Å; M366-Q370 WeakPolarHBondContact O-CB 3.39Å; M366-Q370 VanDerWaalsContact O-CG 3.28Å; M366-Q370 WeakPolarHBondContact O-CG 3.46Å; M366-Q370 PolarHBondContact O-N 3.23Å; M366-Q370 VanDerWaalsContact O-N 3.13Å; M366-V377 HydrophobicContact CE-CB 3.77Å; M366-V377 HydrophobicContact CE-CG1 3.77Å; M366-V377 HydrophobicContact CG-CB 4.38Å; M366-V377 HydrophobicContact CG-CG1 4.22Å; M366-V377 HydrophobicContact SD-CB 4.07Å; M366-V377 HydrophobicContact SD-CG1 4.39Å; M366-R391 HydrophobicContact CE-CB 4.15Å; M366-R391 HydrophobicContact CE-CG 3.73Å; M366-R391 HydrophobicContact SD-CB 4.31Å; M366-R391 HydrophobicContact SD-CG 4.18Å; M366-A392 HydrophobicContact CB-CB 4.1Å; M366-A392 HydrophobicContact SD-CB 4.19Å; M366-L395 HydrophobicContact CG-CD1 4.36Å
367	A	89.9	Confident	89.1	Confident	7 Å²	7	32 Å²	32	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-46.9	177.2	0	0	0	0	0	112.1	L363 G364 F365 Q370 G371 V372 I374 V377	L363-A367 WeakPolarHBondContact O-CB 3.35Å; L363-A367 PolarHBondContact O-N 3.37Å; G364-A367 PolarHBondContact O-N 3.17Å; F365-A367 VanDerWaalsContact C-N 3.26Å; F365-A367 PolarHBondContact O-N 3.02Å; A367-Q370 PolarHBondContact O-N 3.32Å; A367-G371 PolarHBondContact O-N 3.29Å; A367-V372 WeakPolarHBondContact CB-O 3.37Å; A367-V372 PolarHBondContact O-N 3.31Å; A367-V372 VanDerWaalsContact O-N 3.08Å; A367-I374 HydrophobicContact CB-CB 4.05Å; A367-V377 HydrophobicContact CB-CG2 4.09Å
368	A	90.9	Very high	87.9	Confident	44 Å²	44	30.1 Å²	30.1	36%	0.364	17%	0.172	S	C	.	.	H	α-helix	trans	-63.8	-42.6	178.4	0	0	0	0	0	112.5	G364 F365 Q370 G371	G364-A368 WeakPolarHBondContact O-CB 3.46Å; G364-A368 PolarHBondContact O-N 3.03Å; F365-A368 PolarHBondContact O-N 3.03Å; A368-Q370 VanDerWaalsContact C-N 3.29Å; A368-Q370 PolarHBondContact O-N 3.48Å; A368-G371 PolarHBondContact O-N 3.35Å
369	E	85.6	Confident	86.7	Confident	64 Å²	64	33.5 Å²	33.5	30%	0.299	19%	0.188	S	C	.	.	H	α-helix	trans	-68.1	-30.3	179.1	-165.8	57.4	-129.7	0	0	112.3	R186 F365 L395	R186-E369 IonicContact CZ-OE1 3.61Å; R186-E369 PolarHBondContact NE-O 3.15Å; R186-E369 PolarHBondContact NH1-O 3.06Å; R186-E369 IonicContact NH1-OE1 2.79Å; R186-E369 PolarHBondContact NH1-OE1 2.89Å; R186-E369 PolarHBondContact NH2-O 2.9Å; R186-E369 IonicContact NH2-OE1 3.74Å; F365-E369 HydrophobicContact CE2-CB 4.31Å; F365-E369 WeakPolarHBondContact O-CB 3.16Å; F365-E369 PolarHBondContact O-N 3.05Å; E369-L395 HydrophobicContact CB-CD1 4.05Å; E369-L395 HydrophobicContact CG-CB 4.49Å; E369-L395 HydrophobicContact CG-CD1 4.04Å; E369-L395 HydrophobicContact CG-CD2 4.2Å; E369-L395 HydrophobicContact CG-CG 4.47Å
370	Q	82.9	Confident	85.4	Confident	25 Å²	25	36.3 Å²	36.3	12%	0.117	21%	0.208	C	C	.	.	H	α-helix	trans	-87.8	-11.1	177.3	-70.1	177.5	6.1	0	0	113.7	M366 A367 A368 V372	M366-Q370 WeakPolarHBondContact O-CB 3.39Å; M366-Q370 VanDerWaalsContact O-CG 3.28Å; M366-Q370 WeakPolarHBondContact O-CG 3.46Å; M366-Q370 PolarHBondContact O-N 3.23Å; M366-Q370 VanDerWaalsContact O-N 3.13Å; A367-Q370 PolarHBondContact O-N 3.32Å; A368-Q370 VanDerWaalsContact C-N 3.29Å; A368-Q370 PolarHBondContact O-N 3.48Å; Q370-V372 VanDerWaalsContact C-N 3.26Å; Q370-V372 HydrophobicContact CB-CG1 4.34Å; Q370-V372 HydrophobicContact CB-CG2 3.88Å; Q370-V372 PolarHBondContact O-N 2.92Å
371	G	83	Confident	84	Confident	50 Å²	50	38.5 Å²	38.5	52%	0.515	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	29.5	-174.3	0	0	0	0	0	113	A367 A368	A367-G371 PolarHBondContact O-N 3.29Å; A368-G371 PolarHBondContact O-N 3.35Å
372	V	83.9	Confident	82.6	Confident	37 Å²	37	39.9 Å²	39.9	22%	0.224	24%	0.24	C	C	.	.	S	Bend	trans	-117	156.6	179.7	-59.3	0	0	0	0	111.1	A367 Q370 K376 V377	A367-V372 WeakPolarHBondContact CB-O 3.37Å; A367-V372 PolarHBondContact O-N 3.31Å; A367-V372 VanDerWaalsContact O-N 3.08Å; Q370-V372 VanDerWaalsContact C-N 3.26Å; Q370-V372 HydrophobicContact CB-CG1 4.34Å; Q370-V372 HydrophobicContact CB-CG2 3.88Å; Q370-V372 PolarHBondContact O-N 2.92Å; V372-K376 HydrophobicContact CG2-CB 4.42Å; V372-V377 HydrophobicContact CG2-CG1 3.67Å
373	H	86.8	Confident	81.6	Confident	117 Å²	117	40.3 Å²	40.3	54%	0.542	24%	0.244	S	C	.	.			trans	-68.2	140.4	173	-173.6	-97.9	0	0	0	110.7	Y291 S375 K376	Y291-H373 AromaticContact CE2-CE1 3.71Å; H373-S375 WeakPolarHBondContact ND1-CB 3.5Å; H373-S375 PolarHBondContact ND1-N 3.1Å; H373-S375 PolarHBondContact ND1-OG 3.28Å; H373-S375 PolarHBondContact O-N 2.9Å; H373-K376 WeakPolarHBondContact O-CB 3.43Å; H373-K376 PolarHBondContact O-N 3.14Å
374	I	85.9	Confident	80.9	Confident	11 Å²	11	40.2 Å²	40.2	6%	0.056	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-55.8	-28.3	-175.1	-174.7	166	0	0	0	114.5	G288 Y291 F360 L363 A367 K376 V377 A378	G288-I374 VanDerWaalsContact CA-CD1 3.4Å; Y291-I374 HydrophobicContact CD1-CB 4.42Å; Y291-I374 HydrophobicContact CD1-CD1 4.09Å; Y291-I374 HydrophobicContact CD1-CG1 4.14Å; Y291-I374 HydrophobicContact CD1-CG2 3.47Å; Y291-I374 VanDerWaalsContact CD1-CG2 3.47Å; Y291-I374 HydrophobicContact CD2-CG2 3.46Å; Y291-I374 VanDerWaalsContact CD2-CG2 3.46Å; Y291-I374 HydrophobicContact CE1-CG2 3.85Å; Y291-I374 HydrophobicContact CE2-CG2 3.87Å; Y291-I374 HydrophobicContact CG-CD1 4.39Å; Y291-I374 HydrophobicContact CG-CG2 3.25Å; F360-I374 HydrophobicContact CD1-CD1 3.73Å; F360-I374 HydrophobicContact CE1-CD1 4.1Å; L363-I374 HydrophobicContact CB-CD1 4.2Å; L363-I374 HydrophobicContact CB-CG1 4.49Å; A367-I374 HydrophobicContact CB-CB 4.05Å; I374-K376 PolarHBondContact O-N 3.06Å; I374-V377 HydrophobicContact CG1-CG2 4.06Å; I374-V377 VanDerWaalsContact O-CG2 3.28Å; I374-V377 WeakPolarHBondContact O-CG2 3.41Å; I374-V377 PolarHBondContact O-N 3.02Å; I374-A378 PolarHBondContact O-N 3.35Å
375	S	84.1	Confident	80.6	Confident	53 Å²	53	40.4 Å²	40.4	37%	0.371	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-61.5	-16.4	175.2	68.2	0	0	0	0	114	Y291 H373	Y291-S375 VanDerWaalsContact OH-CB 3.31Å; Y291-S375 WeakPolarHBondContact OH-CB 3.21Å; H373-S375 WeakPolarHBondContact ND1-CB 3.5Å; H373-S375 PolarHBondContact ND1-N 3.1Å; H373-S375 PolarHBondContact ND1-OG 3.28Å; H373-S375 PolarHBondContact O-N 2.9Å
376	K	81	Confident	80.5	Confident	166 Å²	166	40 Å²	40	72%	0.722	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-88	-15.8	176.9	-66.1	-67.1	-173.7	174.3	0	113.7	V372 H373 I374	V372-K376 HydrophobicContact CG2-CB 4.42Å; H373-K376 WeakPolarHBondContact O-CB 3.43Å; H373-K376 PolarHBondContact O-N 3.14Å; I374-K376 PolarHBondContact O-N 3.06Å
377	V	80.5	Confident	80.5	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.024	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-12.3	-178.6	-55.5	0	0	0	0	113.3	L363 M366 A367 V372 I374 E379	L363-V377 HydrophobicContact CB-CG2 4.34Å; L363-V377 HydrophobicContact CD2-CG2 4.41Å; M366-V377 HydrophobicContact CE-CB 3.77Å; M366-V377 HydrophobicContact CE-CG1 3.77Å; M366-V377 HydrophobicContact CG-CB 4.38Å; M366-V377 HydrophobicContact CG-CG1 4.22Å; M366-V377 HydrophobicContact SD-CB 4.07Å; M366-V377 HydrophobicContact SD-CG1 4.39Å; A367-V377 HydrophobicContact CB-CG2 4.09Å; V372-V377 HydrophobicContact CG2-CG1 3.67Å; I374-V377 HydrophobicContact CG1-CG2 4.06Å; I374-V377 VanDerWaalsContact O-CG2 3.28Å; I374-V377 WeakPolarHBondContact O-CG2 3.41Å; I374-V377 PolarHBondContact O-N 3.02Å; V377-E379 PolarHBondContact O-N 3.28Å; V377-E379 VanDerWaalsContact O-N 3.16Å
378	A	73	Confident	80.4	Confident	10 Å²	10	40 Å²	40	8%	0.083	24%	0.243	C	C	.	.			trans	-83.4	85.1	175.7	0	0	0	0	0	110.5	Y83 L363 I374	Y83-A378 HydrophobicContact CE1-CB 3.78Å; Y83-A378 HydrophobicContact CE2-CB 4.15Å; Y83-A378 WeakPolarHBondContact OH-CB 3.44Å; Y83-A378 PolarHBondContact OH-O 3.4Å; L363-A378 HydrophobicContact CD1-CB 4.26Å; I374-A378 PolarHBondContact O-N 3.35Å
379	E	68.5	Low	80.3	Confident	74 Å²	74	38.3 Å²	38.3	35%	0.346	23%	0.228	S	C	.	.			trans	-78.4	166.1	172	-69.7	-174.6	-176.4	0	0	112.2	Y80 V377 L384	Y80-E379 VanDerWaalsContact CD2-O 3.31Å; Y80-E379 WeakPolarHBondContact CD2-O 3.39Å; V377-E379 PolarHBondContact O-N 3.28Å; V377-E379 VanDerWaalsContact O-N 3.16Å; E379-L384 WeakPolarHBondContact O-CD1 3.46Å
380	S	65.5	Low	80.6	Confident	66 Å²	66	35.3 Å²	35.3	46%	0.462	21%	0.214	S	C	.	.			trans	-110.1	160.4	178.7	83.8	0	0	0	0	112.4
381	G	64.2	Low	80.9	Confident	47 Å²	47	35.3 Å²	35.3	49%	0.485	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	-152.8	172	0	0	0	0	0	114.1	G383 L384	G381-G383 PolarHBondContact O-N 3.17Å; G381-L384 WeakPolarHBondContact O-CB 3.5Å; G381-L384 PolarHBondContact O-N 3.14Å; G381-L384 VanDerWaalsContact O-N 3.1Å
382	P	66.4	Low	81.3	Confident	29 Å²	29	32.9 Å²	32.9	19%	0.188	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-29	178	-25.5	34.6	0	0	0	113.6	W214 L384 A385 F386 M467 F470	W214-P382 HydrophobicContact CZ2-CB 4.34Å; P382-L384 PolarHBondContact O-N 3.16Å; P382-A385 PolarHBondContact O-N 3.2Å; P382-A385 VanDerWaalsContact O-N 3.12Å; P382-F386 HydrophobicContact CB-CD2 4.17Å; P382-F386 WeakPolarHBondContact O-CD2 3.42Å; P382-F386 PolarHBondContact O-N 2.62Å; P382-M467 HydrophobicContact CG-CE 4.3Å; P382-F470 HydrophobicContact CG-CE1 4.43Å
383	G	73.2	Confident	81.7	Confident	11 Å²	11	31.2 Å²	31.2	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-56.6	-36.5	175.8	0	0	0	0	0	112.6	G381 A385 I387 A388	G381-G383 PolarHBondContact O-N 3.17Å; G383-A385 PolarHBondContact O-N 3.34Å; G383-I387 CarbonylContact O-C 3.6Å; G383-I387 VanDerWaalsContact O-CA 3.24Å; G383-I387 WeakPolarHBondContact O-CA 3.49Å; G383-I387 WeakPolarHBondContact O-CB 3.43Å; G383-I387 PolarHBondContact O-N 3.34Å; G383-A388 PolarHBondContact O-N 3.48Å
384	L	76.2	Confident	82	Confident	5 Å²	5	27 Å²	27	3%	0.026	16%	0.16	C	C	.	.	I	π-helix	trans	-61.9	-43	177.2	-171.7	68.4	0	0	0	112.4	W76 L363 E379 G381 P382 A388 Y389	W76-L384 HydrophobicContact CB-CD2 4.28Å; W76-L384 HydrophobicContact CE3-CB 4.34Å; W76-L384 HydrophobicContact CE3-CD2 3.87Å; W76-L384 HydrophobicContact CE3-CG 3.78Å; W76-L384 HydrophobicContact CZ3-CG 4.23Å; W76-L384 VanDerWaalsContact O-CD2 3.28Å; W76-L384 WeakPolarHBondContact O-CD2 3.21Å; L363-L384 HydrophobicContact CD1-CD1 4.28Å; E379-L384 WeakPolarHBondContact O-CD1 3.46Å; G381-L384 WeakPolarHBondContact O-CB 3.5Å; G381-L384 PolarHBondContact O-N 3.14Å; G381-L384 VanDerWaalsContact O-N 3.1Å; P382-L384 PolarHBondContact O-N 3.16Å; L384-A388 HydrophobicContact CD1-CB 3.93Å; L384-Y389 PolarHBondContact O-N 2.84Å
385	A	87.4	Confident	82.2	Confident	7 Å²	7	29 Å²	29	6%	0.058	17%	0.171	C	C	.	.	I	π-helix	trans	-81.4	-32.5	-176.8	0	0	0	0	0	113.5	W76 P382 G383 P390 L410	W76-A385 HydrophobicContact CD2-CB 3.83Å; W76-A385 HydrophobicContact CE3-CB 3.85Å; W76-A385 HydrophobicContact CG-CB 4.33Å; W76-A385 HydrophobicContact CZ3-CB 4.42Å; P382-A385 PolarHBondContact O-N 3.2Å; P382-A385 VanDerWaalsContact O-N 3.12Å; G383-A385 PolarHBondContact O-N 3.34Å; A385-P390 VanDerWaalsContact O-CD 3.26Å; A385-P390 WeakPolarHBondContact O-CD 3.06Å; A385-P390 WeakPolarHBondContact O-CG 3.43Å; A385-L410 HydrophobicContact CB-CD1 4.09Å
386	F	92.3	Very high	82.5	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-109.8	-8.5	-173.3	-61.7	-70.9	0	0	0	114.7	V151 W154 Y158 W214 P382 P390 F407 L410	V151-F386 HydrophobicContact CG1-CE2 3.94Å; V151-F386 HydrophobicContact CG1-CZ 3.97Å; W154-F386 HydrophobicContact CB-CD1 4.41Å; W154-F386 HydrophobicContact CB-CE1 3.78Å; W154-F386 HydrophobicContact CB-CE2 4.33Å; W154-F386 HydrophobicContact CB-CZ 3.73Å; W154-F386 HydrophobicContact CE3-CE2 4.11Å; Y158-F386 AromaticContact CD2-CD1 3.79Å; Y158-F386 HydrophobicContact CD2-CD1 3.79Å; Y158-F386 HydrophobicContact CD2-CE1 4.22Å; Y158-F386 HydrophobicContact CE2-CB 4.33Å; Y158-F386 AromaticContact CE2-CD1 3.68Å; Y158-F386 HydrophobicContact CE2-CD1 3.68Å; Y158-F386 HydrophobicContact CE2-CE1 4.49Å; Y158-F386 HydrophobicContact CE2-CG 4.38Å; Y158-F386 HydrophobicContact CG-CD1 4.34Å; Y158-F386 PolarHBondContact OH-O 2.82Å; W214-F386 HydrophobicContact CD2-CB 3.97Å; W214-F386 HydrophobicContact CE3-CB 3.53Å; W214-F386 HydrophobicContact CE3-CG 4.03Å; W214-F386 HydrophobicContact CH2-CB 3.99Å; W214-F386 AromaticContact CH2-CD2 3.63Å; W214-F386 HydrophobicContact CH2-CD2 3.63Å; W214-F386 HydrophobicContact CH2-CE2 4.26Å; W214-F386 AromaticContact CH2-CG 3.81Å; W214-F386 HydrophobicContact CH2-CG 3.81Å; W214-F386 HydrophobicContact CZ2-CB 4.4Å; W214-F386 HydrophobicContact CZ2-CD2 4.31Å; W214-F386 HydrophobicContact CZ3-CB 3.53Å; W214-F386 AromaticContact CZ3-CD1 3.94Å; W214-F386 HydrophobicContact CZ3-CD1 3.94Å; W214-F386 AromaticContact CZ3-CD2 3.82Å; W214-F386 HydrophobicContact CZ3-CD2 3.82Å; W214-F386 AromaticContact CZ3-CG 3.49Å; W214-F386 HydrophobicContact CZ3-CG 3.49Å; W214-F386 VanDerWaalsContact CZ3-CG 3.49Å; P382-F386 HydrophobicContact CB-CD2 4.17Å; P382-F386 WeakPolarHBondContact O-CD2 3.42Å; P382-F386 PolarHBondContact O-N 2.62Å; F386-P390 WeakPolarHBondContact O-CG 3.23Å; F386-F407 AromaticContact CD1-CE1 3.85Å; F386-F407 HydrophobicContact CD1-CE1 3.85Å; F386-F407 HydrophobicContact CE1-CD1 4.46Å; F386-F407 AromaticContact CE1-CE1 3.91Å; F386-F407 HydrophobicContact CE1-CE1 3.91Å; F386-L410 HydrophobicContact CE1-CD1 4.4Å; F386-L410 HydrophobicContact CZ-CD1 4.26Å; F386-L410 HydrophobicContact CZ-CD2 4.31Å
387	I	89.5	Confident	83	Confident	18 Å²	18	23 Å²	23	9%	0.092	15%	0.146	C	C	.	.	I	π-helix	trans	-120.4	-63.4	176	-56.1	171.4	0	0	0	110.9	V210 I211 W214 G383 P390 R391	V210-I387 HydrophobicContact CG1-CG2 4.29Å; V210-I387 WeakPolarHBondContact CG1-O 3.04Å; I211-I387 HydrophobicContact CG1-CD1 4.47Å; I211-I387 HydrophobicContact CG1-CG2 3.69Å; W214-I387 HydrophobicContact CB-CG1 4.08Å; W214-I387 HydrophobicContact CG-CD1 4.22Å; W214-I387 HydrophobicContact CG-CG1 4.03Å; G383-I387 CarbonylContact O-C 3.6Å; G383-I387 VanDerWaalsContact O-CA 3.24Å; G383-I387 WeakPolarHBondContact O-CA 3.49Å; G383-I387 WeakPolarHBondContact O-CB 3.43Å; G383-I387 PolarHBondContact O-N 3.34Å; I387-P390 WeakPolarHBondContact O-CD 3.36Å; I387-R391 VanDerWaalsContact O-CB 3.3Å; I387-R391 WeakPolarHBondContact O-CB 3.34Å; I387-R391 PolarHBondContact O-N 3.3Å
388	A	86.9	Confident	83.6	Confident	3 Å²	3	27.5 Å²	27.5	3%	0.025	17%	0.174	C	C	.	.	I	π-helix	trans	-65.5	-49.7	-172.6	0	0	0	0	0	112.6	L363 G383 L384 R391 A392	L363-A388 HydrophobicContact CD2-CB 4.41Å; G383-A388 PolarHBondContact O-N 3.48Å; L384-A388 HydrophobicContact CD1-CB 3.93Å; A388-R391 WeakPolarHBondContact O-CB 3.11Å; A388-R391 PolarHBondContact O-N 2.83Å; A388-A392 PolarHBondContact O-N 3.02Å
389	Y	88.9	Confident	84.7	Confident	8 Å²	8	27.7 Å²	27.7	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-66.1	-46.4	179.7	-167.9	-83	0	0	0	113.1	W76 L275 I362 L384 R391 A392 V393 F406	W76-Y389 AromaticContact CH2-CD2 3.62Å; W76-Y389 HydrophobicContact CH2-CD2 3.62Å; W76-Y389 HydrophobicContact CH2-CE2 4.24Å; W76-Y389 AromaticContact CH2-CG 3.91Å; W76-Y389 HydrophobicContact CH2-CG 3.91Å; W76-Y389 HydrophobicContact CZ3-CD2 4.05Å; W76-Y389 HydrophobicContact CZ3-CG 4.22Å; L275-Y389 VanDerWaalsContact CD1-OH 3.27Å; L275-Y389 WeakPolarHBondContact CD1-OH 3.45Å; L275-Y389 WeakPolarHBondContact CD2-OH 3.43Å; I362-Y389 HydrophobicContact CD1-CE2 3.56Å; I362-Y389 HydrophobicContact CG2-CD2 4.36Å; I362-Y389 HydrophobicContact CG2-CE2 4.16Å; L384-Y389 PolarHBondContact O-N 2.84Å; Y389-R391 PolarHBondContact O-N 3.04Å; Y389-A392 WeakPolarHBondContact O-CB 3.48Å; Y389-A392 PolarHBondContact O-N 3.37Å; Y389-V393 HydrophobicContact CD1-CG2 3.63Å; Y389-V393 HydrophobicContact CE1-CG2 3.2Å; Y389-V393 WeakPolarHBondContact O-CG2 3.35Å; Y389-V393 PolarHBondContact O-N 2.94Å; Y389-F406 HydrophobicContact CD1-CB 4.32Å; Y389-F406 AromaticContact CD1-CD1 3.5Å; Y389-F406 HydrophobicContact CD1-CD1 3.5Å; Y389-F406 AromaticContact CD1-CD2 3.52Å; Y389-F406 HydrophobicContact CD1-CD2 3.52Å; Y389-F406 AromaticContact CD1-CE1 3.51Å; Y389-F406 HydrophobicContact CD1-CE1 3.51Å; Y389-F406 AromaticContact CD1-CE2 3.46Å; Y389-F406 HydrophobicContact CD1-CE2 3.46Å; Y389-F406 VanDerWaalsContact CD1-CE2 3.46Å; Y389-F406 AromaticContact CD1-CG 3.49Å; Y389-F406 HydrophobicContact CD1-CG 3.49Å; Y389-F406 VanDerWaalsContact CD1-CG 3.49Å; Y389-F406 AromaticContact CD1-CZ 3.48Å; Y389-F406 HydrophobicContact CD1-CZ 3.48Å; Y389-F406 VanDerWaalsContact CD1-CZ 3.48Å; Y389-F406 HydrophobicContact CD2-CD2 4.3Å; Y389-F406 AromaticContact CD2-CE2 3.8Å; Y389-F406 HydrophobicContact CD2-CE2 3.8Å; Y389-F406 HydrophobicContact CD2-CZ 4.19Å; Y389-F406 HydrophobicContact CE1-CB 3.55Å; Y389-F406 AromaticContact CE1-CD1 3.64Å; Y389-F406 HydrophobicContact CE1-CD1 3.64Å; Y389-F406 AromaticContact CE1-CD2 3.07Å; Y389-F406 HydrophobicContact CE1-CD2 3.07Å; Y389-F406 HydrophobicContact CE1-CE1 4.07Å; Y389-F406 AromaticContact CE1-CE2 3.49Å; Y389-F406 HydrophobicContact CE1-CE2 3.49Å; Y389-F406 VanDerWaalsContact CE1-CE2 3.49Å; Y389-F406 AromaticContact CE1-CG 3.11Å; Y389-F406 HydrophobicContact CE1-CG 3.11Å; Y389-F406 AromaticContact CE1-CZ 3.99Å; Y389-F406 HydrophobicContact CE1-CZ 3.99Å; Y389-F406 AromaticContact CE2-CD2 3.9Å; Y389-F406 HydrophobicContact CE2-CD2 3.9Å; Y389-F406 AromaticContact CE2-CE2 3.79Å; Y389-F406 HydrophobicContact CE2-CE2 3.79Å; Y389-F406 HydrophobicContact CG-CD1 4.44Å; Y389-F406 HydrophobicContact CG-CD2 4.11Å; Y389-F406 HydrophobicContact CG-CE1 4.05Å; Y389-F406 AromaticContact CG-CE2 3.62Å; Y389-F406 HydrophobicContact CG-CE2 3.62Å; Y389-F406 HydrophobicContact CG-CG 4.45Å; Y389-F406 AromaticContact CG-CZ 3.6Å; Y389-F406 HydrophobicContact CG-CZ 3.6Å; Y389-F406 AromaticContact CZ-CD2 3.28Å; Y389-F406 AromaticContact CZ-CE2 3.65Å; Y389-F406 AromaticContact CZ-CG 3.81Å
390	P	92.5	Very high	86	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-35.7	175.7	-30.4	42.9	0	0	0	111.9	Y158 W169 V210 A385 F386 I387 V393 T394 F407	Y158-P390 HydrophobicContact CE1-CB 4.32Å; Y158-P390 HydrophobicContact CE1-CG 4.1Å; W169-P390 HydrophobicContact CG-CB 4.43Å; W169-P390 PolarHBondContact NE1-O 3.24Å; V210-P390 HydrophobicContact CG1-CB 4.06Å; A385-P390 VanDerWaalsContact O-CD 3.26Å; A385-P390 WeakPolarHBondContact O-CD 3.06Å; A385-P390 WeakPolarHBondContact O-CG 3.43Å; F386-P390 WeakPolarHBondContact O-CG 3.23Å; I387-P390 WeakPolarHBondContact O-CD 3.36Å; P390-V393 PolarHBondContact O-N 2.87Å; P390-T394 WeakPolarHBondContact O-CG2 3.38Å; P390-T394 PolarHBondContact O-N 2.98Å; P390-T394 VanDerWaalsContact O-N 3.13Å; P390-F407 HydrophobicContact CG-CE2 4.25Å; P390-F407 HydrophobicContact CG-CZ 3.6Å
391	R	90.1	Very high	87.5	Confident	24 Å²	24	26.7 Å²	26.7	9%	0.091	17%	0.169	C	C	.	.	H	α-helix	trans	-61.9	-50.1	171.3	-177.1	56.3	176.1	177.8	0.5	111.8	E183 V210 M366 I387 A388 Y389 V393 T394	E183-R391 PolarHBondContact O-NH2 3.48Å; V210-R391 HydrophobicContact CG2-CB 3.99Å; V210-R391 HydrophobicContact CG2-CG 4.48Å; M366-R391 HydrophobicContact CE-CB 4.15Å; M366-R391 HydrophobicContact CE-CG 3.73Å; M366-R391 HydrophobicContact SD-CB 4.31Å; M366-R391 HydrophobicContact SD-CG 4.18Å; I387-R391 VanDerWaalsContact O-CB 3.3Å; I387-R391 WeakPolarHBondContact O-CB 3.34Å; I387-R391 PolarHBondContact O-N 3.3Å; A388-R391 WeakPolarHBondContact O-CB 3.11Å; A388-R391 PolarHBondContact O-N 2.83Å; Y389-R391 PolarHBondContact O-N 3.04Å; R391-V393 PolarHBondContact O-N 3.35Å; R391-T394 PolarHBondContact O-N 3.26Å; R391-T394 VanDerWaalsContact O-N 3.11Å; R391-T394 PolarHBondContact O-OG1 3.45Å
392	A	90.4	Very high	89	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-37.6	178.1	0	0	0	0	0	112.4	I362 M366 A388 Y389 L395	I362-A392 HydrophobicContact CG2-CB 3.47Å; I362-A392 VanDerWaalsContact CG2-CB 3.47Å; M366-A392 HydrophobicContact CB-CB 4.1Å; M366-A392 HydrophobicContact SD-CB 4.19Å; A388-A392 PolarHBondContact O-N 3.02Å; Y389-A392 WeakPolarHBondContact O-CB 3.48Å; Y389-A392 PolarHBondContact O-N 3.37Å; A392-L395 PolarHBondContact O-N 3.41Å
393	V	93	Very high	90.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-65.9	-37.5	176.6	171.8	0	0	0	0	113.1	L167 Y389 P390 R391 L395 M396 A399 W402 A403	L167-V393 HydrophobicContact CD1-CG1 3.99Å; Y389-V393 HydrophobicContact CD1-CG2 3.63Å; Y389-V393 HydrophobicContact CE1-CG2 3.2Å; Y389-V393 WeakPolarHBondContact O-CG2 3.35Å; Y389-V393 PolarHBondContact O-N 2.94Å; P390-V393 PolarHBondContact O-N 2.87Å; R391-V393 PolarHBondContact O-N 3.35Å; V393-L395 PolarHBondContact O-N 3.3Å; V393-L395 VanDerWaalsContact O-N 3.13Å; V393-M396 HydrophobicContact CB-CE 4.17Å; V393-M396 HydrophobicContact CG2-CE 3.74Å; V393-M396 PolarHBondContact O-N 2.99Å; V393-A399 HydrophobicContact CG1-CB 4.05Å; V393-A399 WeakPolarHBondContact CG1-O 3.06Å; V393-A399 WeakPolarHBondContact O-CB 3.42Å; V393-W402 HydrophobicContact CG1-CB 3.87Å; V393-W402 HydrophobicContact CG2-CB 4.23Å; V393-A403 HydrophobicContact CG1-CB 3.91Å
394	T	92.6	Very high	91.6	Very high	30 Å²	30	25 Å²	25	18%	0.184	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-20.9	177.9	60.3	0	0	0	0	113.7	L167 W169 A170 P390 R391	L167-T394 HydrophobicContact CD1-CG2 4.22Å; W169-T394 VanDerWaalsContact CD1-CG2 3.47Å; A170-T394 HydrophobicContact CB-CG2 3.73Å; P390-T394 WeakPolarHBondContact O-CG2 3.38Å; P390-T394 PolarHBondContact O-N 2.98Å; P390-T394 VanDerWaalsContact O-N 3.13Å; R391-T394 PolarHBondContact O-N 3.26Å; R391-T394 VanDerWaalsContact O-N 3.11Å; R391-T394 PolarHBondContact O-OG1 3.45Å
395	L	89.7	Confident	92.5	Very high	52 Å²	52	26.8 Å²	26.8	27%	0.272	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-9	178.7	-58.3	173.1	0	0	0	112.8	F365 M366 E369 A392 V393	F365-L395 HydrophobicContact CE1-CB 3.65Å; F365-L395 HydrophobicContact CZ-CB 3.84Å; M366-L395 HydrophobicContact CG-CD1 4.36Å; E369-L395 HydrophobicContact CB-CD1 4.05Å; E369-L395 HydrophobicContact CG-CB 4.49Å; E369-L395 HydrophobicContact CG-CD1 4.04Å; E369-L395 HydrophobicContact CG-CD2 4.2Å; E369-L395 HydrophobicContact CG-CG 4.47Å; A392-L395 PolarHBondContact O-N 3.41Å; V393-L395 PolarHBondContact O-N 3.3Å; V393-L395 VanDerWaalsContact O-N 3.13Å
396	M	91	Very high	92.9	Very high	9 Å²	9	26.5 Å²	26.5	4%	0.044	15%	0.151	C	C	.	.	S	Bend	trans	-93.4	144.9	-179.2	-67.8	-168.1	-82.3	0	0	112	R278 L282 F365 V393 A399 W402	R278-M396 HydrophobicContact CG-SD 4.19Å; L282-M396 HydrophobicContact CD1-CG 4.35Å; L282-M396 HydrophobicContact CD1-SD 3.74Å; L282-M396 HydrophobicContact CD2-CG 4.45Å; F365-M396 HydrophobicContact CD1-CG 4.42Å; F365-M396 HydrophobicContact CE1-CG 3.76Å; F365-M396 HydrophobicContact CZ-CG 4.47Å; V393-M396 HydrophobicContact CB-CE 4.17Å; V393-M396 HydrophobicContact CG2-CE 3.74Å; V393-M396 PolarHBondContact O-N 2.99Å; M396-A399 PolarHBondContact O-N 3.17Å; M396-W402 HydrophobicContact CE-CB 3.99Å; M396-W402 HydrophobicContact CE-CG 4.01Å; M396-W402 HydrophobicContact SD-CG 4.42Å
397	P	90.6	Very high	93.1	Very high	83 Å²	83	26.5 Å²	26.5	54%	0.539	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	142.7	168.4	27.5	-35.2	0	0	0	110.3	A399 W402	P397-A399 VanDerWaalsContact C-N 3.29Å; P397-A399 PolarHBondContact O-N 2.94Å; P397-W402 PolarHBondContact O-NE1 3.49Å
398	V	93.9	Very high	93.4	Very high	99 Å²	99	28.7 Å²	28.7	60%	0.6	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	40.9	-175.5	-156	0	0	0	0	111.6	P400 L401	V398-P400 VanDerWaalsContact C-N 3.29Å; V398-P400 VanDerWaalsContact O-N 3.13Å; V398-L401 HydrophobicContact CB-CB 4.48Å; V398-L401 HydrophobicContact CG1-CB 3.76Å; V398-L401 HydrophobicContact CG1-CD2 4.38Å; V398-L401 WeakPolarHBondContact O-CB 3.4Å; V398-L401 PolarHBondContact O-N 2.91Å
399	A	95.1	Very high	93.8	Very high	14 Å²	14	28.6 Å²	28.6	12%	0.116	16%	0.159	C	C	.	.	H	α-helix	trans	-45	-42	179.8	0	0	0	0	0	115	L167 V393 M396 P397 L401 W402 A403	L167-A399 HydrophobicContact CD1-CB 3.68Å; L167-A399 HydrophobicContact CG-CB 4.41Å; V393-A399 HydrophobicContact CG1-CB 4.05Å; V393-A399 WeakPolarHBondContact CG1-O 3.06Å; V393-A399 WeakPolarHBondContact O-CB 3.42Å; M396-A399 PolarHBondContact O-N 3.17Å; P397-A399 VanDerWaalsContact C-N 3.29Å; P397-A399 PolarHBondContact O-N 2.94Å; A399-L401 VanDerWaalsContact C-N 3.28Å; A399-L401 PolarHBondContact O-N 3.07Å; A399-W402 PolarHBondContact O-N 3.4Å; A399-A403 PolarHBondContact O-N 3.23Å
400	P	97.2	Very high	94.1	Very high	32 Å²	32	28.3 Å²	28.3	21%	0.208	16%	0.158	C	C	.	.	H	α-helix	trans	-54.3	-38.7	175.9	-30.4	39	0	0	0	114.7	S162 T164 L167 V398 A404	S162-P400 WeakPolarHBondContact O-CB 3.34Å; T164-P400 WeakPolarHBondContact O-CB 3.31Å; T164-P400 WeakPolarHBondContact O-CG 3.39Å; L167-P400 HydrophobicContact CD2-CG 4.42Å; L167-P400 HydrophobicContact CG-CG 4.46Å; V398-P400 VanDerWaalsContact C-N 3.29Å; V398-P400 VanDerWaalsContact O-N 3.13Å; P400-A404 VanDerWaalsContact O-CB 3.3Å; P400-A404 WeakPolarHBondContact O-CB 3.35Å; P400-A404 PolarHBondContact O-N 3.12Å
401	L	96.1	Very high	94.3	Very high	87 Å²	87	28.6 Å²	28.6	46%	0.455	16%	0.159	S	C	.	.	H	α-helix	trans	-64.2	-48.7	178.9	173.8	64.4	0	0	0	111.1	V398 A399 A404 L405	V398-L401 HydrophobicContact CB-CB 4.48Å; V398-L401 HydrophobicContact CG1-CB 3.76Å; V398-L401 HydrophobicContact CG1-CD2 4.38Å; V398-L401 WeakPolarHBondContact O-CB 3.4Å; V398-L401 PolarHBondContact O-N 2.91Å; A399-L401 VanDerWaalsContact C-N 3.28Å; A399-L401 PolarHBondContact O-N 3.07Å; L401-A404 PolarHBondContact O-N 2.92Å; L401-L405 HydrophobicContact CD1-CD1 4.12Å; L401-L405 HydrophobicContact CD1-CG 4.3Å; L401-L405 HydrophobicContact CG-CD1 4.19Å; L401-L405 WeakPolarHBondContact O-CG 3.41Å; L401-L405 PolarHBondContact O-N 3.31Å
402	W	95.2	Very high	94.6	Very high	35 Å²	35	27.8 Å²	27.8	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-40.5	-178.6	-53.8	113.1	0	0	0	111.3	V274 L275 R278 V393 M396 P397 A399 L405 F406	V274-W402 HydrophobicContact CG1-CZ3 4.02Å; L275-W402 HydrophobicContact CD2-CE3 4.04Å; R278-W402 HydrophobicContact CB-CH2 3.84Å; R278-W402 HydrophobicContact CB-CZ3 3.89Å; R278-W402 HydrophobicContact CG-CD2 4.48Å; R278-W402 HydrophobicContact CG-CE3 4.31Å; R278-W402 HydrophobicContact CG-CH2 3.62Å; R278-W402 HydrophobicContact CG-CZ2 3.8Å; R278-W402 HydrophobicContact CG-CZ3 3.89Å; V393-W402 HydrophobicContact CG1-CB 3.87Å; V393-W402 HydrophobicContact CG2-CB 4.23Å; M396-W402 HydrophobicContact CE-CB 3.99Å; M396-W402 HydrophobicContact CE-CG 4.01Å; M396-W402 HydrophobicContact SD-CG 4.42Å; P397-W402 PolarHBondContact O-NE1 3.49Å; A399-W402 PolarHBondContact O-N 3.4Å; W402-L405 HydrophobicContact CE3-CD1 4.38Å; W402-F406 WeakPolarHBondContact O-CB 3.34Å; W402-F406 PolarHBondContact O-N 3.27Å
403	A	96.6	Very high	94.9	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-46	175.2	0	0	0	0	0	111.5	S162 L167 W169 V393 A399 F406 F407	S162-A403 WeakPolarHBondContact OG-CB 3.42Å; L167-A403 HydrophobicContact CD1-CB 4.03Å; L167-A403 HydrophobicContact CD2-CB 3.99Å; W169-A403 HydrophobicContact CZ2-CB 3.96Å; V393-A403 HydrophobicContact CG1-CB 3.91Å; A399-A403 PolarHBondContact O-N 3.23Å; A403-F406 WeakPolarHBondContact O-CB 3.37Å; A403-F406 PolarHBondContact O-N 3.27Å; A403-F407 HydrophobicContact CB-CD2 4.37Å; A403-F407 WeakPolarHBondContact O-CD2 3.2Å; A403-F407 PolarHBondContact O-N 2.82Å
404	A	97.5	Very high	95	Very high	16 Å²	16	27.9 Å²	27.9	13%	0.132	16%	0.157	C	C	.	.	H	α-helix	trans	-63.5	-47.2	179.3	0	0	0	0	0	112.1	L159 F163 P400 L401 F406 F408	L159-A404 HydrophobicContact CD1-CB 4.34Å; L159-A404 WeakPolarHBondContact CD1-O 3.37Å; F163-A404 HydrophobicContact CZ-CB 4.38Å; P400-A404 VanDerWaalsContact O-CB 3.3Å; P400-A404 WeakPolarHBondContact O-CB 3.35Å; P400-A404 PolarHBondContact O-N 3.12Å; L401-A404 PolarHBondContact O-N 2.92Å; A404-F406 VanDerWaalsContact C-N 3.27Å; A404-F406 PolarHBondContact O-N 3.04Å; A404-F408 WeakPolarHBondContact O-CB 3.44Å; A404-F408 PolarHBondContact O-N 3.23Å
405	L	96.1	Very high	95.1	Very high	43 Å²	43	27 Å²	27	23%	0.225	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-43.8	175.8	-74.2	173.3	0	0	0	111.4	V271 V274 L401 W402 M409	V271-L405 HydrophobicContact CG1-CB 4.25Å; V274-L405 HydrophobicContact CG1-CD1 4.45Å; L401-L405 HydrophobicContact CD1-CD1 4.12Å; L401-L405 HydrophobicContact CD1-CG 4.3Å; L401-L405 HydrophobicContact CG-CD1 4.19Å; L401-L405 WeakPolarHBondContact O-CG 3.41Å; L401-L405 PolarHBondContact O-N 3.31Å; W402-L405 HydrophobicContact CE3-CD1 4.38Å; L405-M409 WeakPolarHBondContact O-CB 3.34Å; L405-M409 PolarHBondContact O-N 2.93Å
406	F	94.9	Very high	95.4	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-56.8	-179.7	176	-105.9	0	0	0	113.5	W76 L275 Y389 W402 A403 A404 F408 M409 L410	W76-F406 AromaticContact CE2-CZ 3.95Å; W76-F406 HydrophobicContact CH2-CD2 4.32Å; W76-F406 HydrophobicContact CH2-CE1 4.44Å; W76-F406 AromaticContact CH2-CE2 3.02Å; W76-F406 HydrophobicContact CH2-CE2 3.02Å; W76-F406 AromaticContact CH2-CZ 3.09Å; W76-F406 HydrophobicContact CH2-CZ 3.09Å; W76-F406 HydrophobicContact CZ2-CD2 4.23Å; W76-F406 HydrophobicContact CZ2-CE1 4.44Å; W76-F406 AromaticContact CZ2-CE2 2.97Å; W76-F406 HydrophobicContact CZ2-CE2 2.97Å; W76-F406 AromaticContact CZ2-CZ 3.09Å; W76-F406 HydrophobicContact CZ2-CZ 3.09Å; W76-F406 HydrophobicContact CZ3-CE2 4.21Å; W76-F406 AromaticContact CZ3-CZ 3.93Å; W76-F406 HydrophobicContact CZ3-CZ 3.93Å; L275-F406 HydrophobicContact CD1-CD2 4.39Å; Y389-F406 HydrophobicContact CD1-CB 4.32Å; Y389-F406 AromaticContact CD1-CD1 3.5Å; Y389-F406 HydrophobicContact CD1-CD1 3.5Å; Y389-F406 AromaticContact CD1-CD2 3.52Å; Y389-F406 HydrophobicContact CD1-CD2 3.52Å; Y389-F406 AromaticContact CD1-CE1 3.51Å; Y389-F406 HydrophobicContact CD1-CE1 3.51Å; Y389-F406 AromaticContact CD1-CE2 3.46Å; Y389-F406 HydrophobicContact CD1-CE2 3.46Å; Y389-F406 VanDerWaalsContact CD1-CE2 3.46Å; Y389-F406 AromaticContact CD1-CG 3.49Å; Y389-F406 HydrophobicContact CD1-CG 3.49Å; Y389-F406 VanDerWaalsContact CD1-CG 3.49Å; Y389-F406 AromaticContact CD1-CZ 3.48Å; Y389-F406 HydrophobicContact CD1-CZ 3.48Å; Y389-F406 VanDerWaalsContact CD1-CZ 3.48Å; Y389-F406 HydrophobicContact CD2-CD2 4.3Å; Y389-F406 AromaticContact CD2-CE2 3.8Å; Y389-F406 HydrophobicContact CD2-CE2 3.8Å; Y389-F406 HydrophobicContact CD2-CZ 4.19Å; Y389-F406 HydrophobicContact CE1-CB 3.55Å; Y389-F406 AromaticContact CE1-CD1 3.64Å; Y389-F406 HydrophobicContact CE1-CD1 3.64Å; Y389-F406 AromaticContact CE1-CD2 3.07Å; Y389-F406 HydrophobicContact CE1-CD2 3.07Å; Y389-F406 HydrophobicContact CE1-CE1 4.07Å; Y389-F406 AromaticContact CE1-CE2 3.49Å; Y389-F406 HydrophobicContact CE1-CE2 3.49Å; Y389-F406 VanDerWaalsContact CE1-CE2 3.49Å; Y389-F406 AromaticContact CE1-CG 3.11Å; Y389-F406 HydrophobicContact CE1-CG 3.11Å; Y389-F406 AromaticContact CE1-CZ 3.99Å; Y389-F406 HydrophobicContact CE1-CZ 3.99Å; Y389-F406 AromaticContact CE2-CD2 3.9Å; Y389-F406 HydrophobicContact CE2-CD2 3.9Å; Y389-F406 AromaticContact CE2-CE2 3.79Å; Y389-F406 HydrophobicContact CE2-CE2 3.79Å; Y389-F406 HydrophobicContact CG-CD1 4.44Å; Y389-F406 HydrophobicContact CG-CD2 4.11Å; Y389-F406 HydrophobicContact CG-CE1 4.05Å; Y389-F406 AromaticContact CG-CE2 3.62Å; Y389-F406 HydrophobicContact CG-CE2 3.62Å; Y389-F406 HydrophobicContact CG-CG 4.45Å; Y389-F406 AromaticContact CG-CZ 3.6Å; Y389-F406 HydrophobicContact CG-CZ 3.6Å; Y389-F406 AromaticContact CZ-CD2 3.28Å; Y389-F406 AromaticContact CZ-CE2 3.65Å; Y389-F406 AromaticContact CZ-CG 3.81Å; W402-F406 WeakPolarHBondContact O-CB 3.34Å; W402-F406 PolarHBondContact O-N 3.27Å; A403-F406 WeakPolarHBondContact O-CB 3.37Å; A403-F406 PolarHBondContact O-N 3.27Å; A404-F406 VanDerWaalsContact C-N 3.27Å; A404-F406 PolarHBondContact O-N 3.04Å; F406-F408 VanDerWaalsContact C-N 3.27Å; F406-F408 PolarHBondContact O-N 3.48Å; F406-M409 HydrophobicContact CD2-CE 4.01Å; F406-M409 HydrophobicContact CE2-CE 4.19Å; F406-M409 WeakPolarHBondContact O-CB 3.4Å; F406-M409 PolarHBondContact O-N 2.56Å; F406-L410 HydrophobicContact CE1-CD1 4.03Å; F406-L410 HydrophobicContact CZ-CD1 4.19Å; F406-L410 WeakPolarHBondContact O-CB 3.38Å; F406-L410 PolarHBondContact O-N 3.16Å
407	F	96.6	Very high	95.6	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-71.1	-27	-176.7	-74.1	-64.4	0	0	0	112.1	Y158 L159 W169 F386 P390 A403 L410 L411	Y158-F407 VanDerWaalsContact CB-CE1 3.47Å; Y158-F407 VanDerWaalsContact CB-CZ 3.45Å; Y158-F407 HydrophobicContact CD1-CD2 4.41Å; Y158-F407 AromaticContact CD1-CE1 3.86Å; Y158-F407 HydrophobicContact CD1-CE1 3.86Å; Y158-F407 AromaticContact CD1-CE2 3.49Å; Y158-F407 HydrophobicContact CD1-CE2 3.49Å; Y158-F407 VanDerWaalsContact CD1-CE2 3.49Å; Y158-F407 AromaticContact CD1-CZ 3.12Å; Y158-F407 HydrophobicContact CD1-CZ 3.12Å; Y158-F407 HydrophobicContact CD2-CE1 4.42Å; Y158-F407 HydrophobicContact CD2-CZ 4.45Å; Y158-F407 HydrophobicContact CE1-CE2 4.47Å; Y158-F407 AromaticContact CE1-CZ 3.88Å; Y158-F407 HydrophobicContact CE1-CZ 3.88Å; Y158-F407 HydrophobicContact CG-CD1 4.29Å; Y158-F407 HydrophobicContact CG-CD2 4.47Å; Y158-F407 AromaticContact CG-CE1 3.69Å; Y158-F407 HydrophobicContact CG-CE1 3.69Å; Y158-F407 AromaticContact CG-CE2 3.91Å; Y158-F407 HydrophobicContact CG-CE2 3.91Å; Y158-F407 AromaticContact CG-CZ 3.45Å; Y158-F407 HydrophobicContact CG-CZ 3.45Å; Y158-F407 VanDerWaalsContact CG-CZ 3.45Å; L159-F407 HydrophobicContact CB-CB 3.88Å; L159-F407 HydrophobicContact CD1-CB 4.45Å; W169-F407 HydrophobicContact CH2-CE2 4.06Å; W169-F407 AromaticContact CZ2-CE2 3.97Å; W169-F407 HydrophobicContact CZ2-CE2 3.97Å; F386-F407 AromaticContact CD1-CE1 3.85Å; F386-F407 HydrophobicContact CD1-CE1 3.85Å; F386-F407 HydrophobicContact CE1-CD1 4.46Å; F386-F407 AromaticContact CE1-CE1 3.91Å; F386-F407 HydrophobicContact CE1-CE1 3.91Å; P390-F407 HydrophobicContact CG-CE2 4.25Å; P390-F407 HydrophobicContact CG-CZ 3.6Å; A403-F407 HydrophobicContact CB-CD2 4.37Å; A403-F407 WeakPolarHBondContact O-CD2 3.2Å; A403-F407 PolarHBondContact O-N 2.82Å; F407-L410 HydrophobicContact CD1-CD1 4.29Å; F407-L410 HydrophobicContact CE1-CD1 4.47Å; F407-L411 VanDerWaalsContact O-CB 3.32Å; F407-L411 WeakPolarHBondContact O-CB 3.37Å; F407-L411 PolarHBondContact O-N 3.32Å
408	F	97.1	Very high	95.9	Very high	64 Å²	64	20.9 Å²	20.9	28%	0.281	12%	0.115	S	C	.	.	H	α-helix	trans	-67.6	-45.5	169.9	-172.5	-124.4	0	0	0	111.4	L159 F263 F267 A404 F406 L410 L411 L412	L159-F408 HydrophobicContact CD1-CB 4Å; L159-F408 HydrophobicContact CD2-CB 4.24Å; L159-F408 HydrophobicContact CD2-CD2 3.93Å; F263-F408 HydrophobicContact CE1-CE1 4.45Å; F263-F408 HydrophobicContact CE1-CZ 4.09Å; F263-F408 HydrophobicContact CZ-CE1 4.11Å; F263-F408 HydrophobicContact CZ-CZ 4.12Å; F267-F408 HydrophobicContact CD1-CD1 4.01Å; F267-F408 AromaticContact CD1-CE1 3.91Å; F267-F408 HydrophobicContact CD1-CE1 3.91Å; F267-F408 AromaticContact CE1-CD1 3.33Å; F267-F408 HydrophobicContact CE1-CD1 3.33Å; F267-F408 AromaticContact CE1-CE1 3.53Å; F267-F408 HydrophobicContact CE1-CE1 3.53Å; F267-F408 AromaticContact CZ-CD1 3.86Å; F267-F408 HydrophobicContact CZ-CD1 3.86Å; F267-F408 AromaticContact CZ-CE1 3.87Å; F267-F408 HydrophobicContact CZ-CE1 3.87Å; A404-F408 WeakPolarHBondContact O-CB 3.44Å; A404-F408 PolarHBondContact O-N 3.23Å; F406-F408 VanDerWaalsContact C-N 3.27Å; F406-F408 PolarHBondContact O-N 3.48Å; F408-L410 VanDerWaalsContact C-N 3.35Å; F408-L410 PolarHBondContact O-N 2.85Å; F408-L411 PolarHBondContact O-N 3.36Å; F408-L412 HydrophobicContact CD1-CD1 4.37Å; F408-L412 HydrophobicContact CE1-CD1 3.89Å; F408-L412 HydrophobicContact CE2-CD1 4.5Å; F408-L412 HydrophobicContact CE2-CD2 4.2Å; F408-L412 HydrophobicContact CE2-CG 4.33Å; F408-L412 HydrophobicContact CZ-CD1 3.97Å; F408-L412 HydrophobicContact CZ-CD2 4.26Å; F408-L412 HydrophobicContact CZ-CG 4.28Å; F408-L412 WeakPolarHBondContact O-CG 3.34Å; F408-L412 PolarHBondContact O-N 2.94Å
409	M	95.8	Very high	95.9	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-57.5	-46.8	171.4	171.7	-174.5	75.3	0	0	111.8	V75 P268 V271 L272 L275 L405 F406 L411 L412 L413	V75-M409 HydrophobicContact CG1-CE 4.4Å; P268-M409 HydrophobicContact CB-CG 3.87Å; P268-M409 HydrophobicContact CG-CG 4.43Å; V271-M409 HydrophobicContact CB-CB 4Å; V271-M409 HydrophobicContact CB-CG 4.24Å; V271-M409 HydrophobicContact CB-SD 3.81Å; V271-M409 HydrophobicContact CG1-CB 3.84Å; V271-M409 HydrophobicContact CG1-CE 4.38Å; V271-M409 HydrophobicContact CG1-CG 4.29Å; V271-M409 HydrophobicContact CG1-SD 3.65Å; V271-M409 HydrophobicContact CG2-CB 4.16Å; L272-M409 HydrophobicContact CD2-CE 4.18Å; L272-M409 HydrophobicContact CD2-SD 3.75Å; L272-M409 HydrophobicContact CG-SD 3.77Å; L275-M409 HydrophobicContact CD1-CE 4.22Å; L405-M409 WeakPolarHBondContact O-CB 3.34Å; L405-M409 PolarHBondContact O-N 2.93Å; F406-M409 HydrophobicContact CD2-CE 4.01Å; F406-M409 HydrophobicContact CE2-CE 4.19Å; F406-M409 WeakPolarHBondContact O-CB 3.4Å; F406-M409 PolarHBondContact O-N 2.56Å; M409-L411 VanDerWaalsContact C-N 3.3Å; M409-L411 PolarHBondContact O-N 3.08Å; M409-L412 PolarHBondContact O-N 3.18Å; M409-L413 HydrophobicContact CG-CD1 3.9Å; M409-L413 HydrophobicContact CG-CG 4.32Å; M409-L413 WeakPolarHBondContact O-CG 3.47Å; M409-L413 PolarHBondContact O-N 3.48Å
410	L	94.5	Very high	96	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-57.4	-45.5	178.4	-169.7	156.4	0	0	0	110.9	L72 V151 A385 F386 F406 F407 F408 G414	L72-L410 HydrophobicContact CD2-CD2 4.15Å; L72-L410 HydrophobicContact CD2-CG 3.71Å; V151-L410 HydrophobicContact CG1-CD2 4.37Å; A385-L410 HydrophobicContact CB-CD1 4.09Å; F386-L410 HydrophobicContact CE1-CD1 4.4Å; F386-L410 HydrophobicContact CZ-CD1 4.26Å; F386-L410 HydrophobicContact CZ-CD2 4.31Å; F406-L410 HydrophobicContact CE1-CD1 4.03Å; F406-L410 HydrophobicContact CZ-CD1 4.19Å; F406-L410 WeakPolarHBondContact O-CB 3.38Å; F406-L410 PolarHBondContact O-N 3.16Å; F407-L410 HydrophobicContact CD1-CD1 4.29Å; F407-L410 HydrophobicContact CE1-CD1 4.47Å; F408-L410 VanDerWaalsContact C-N 3.35Å; F408-L410 PolarHBondContact O-N 2.85Å; L410-G414 PolarHBondContact O-N 3.4Å
411	L	96.5	Very high	95.9	Very high	7 Å²	7	14.2 Å²	14.2	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-61.3	-44.6	176.8	-178.5	63.4	0	0	0	111.7	L152 F156 L159 F407 F408 M409 G414 L415	L152-L411 HydrophobicContact CB-CD1 3.95Å; L152-L411 HydrophobicContact CG-CD1 4.24Å; F156-L411 HydrophobicContact CB-CD1 4.32Å; F156-L411 HydrophobicContact CD2-CD1 4.12Å; F156-L411 HydrophobicContact CD2-CD2 3.79Å; F156-L411 HydrophobicContact CE2-CD2 4.23Å; F156-L411 HydrophobicContact CG-CD2 4.35Å; L159-L411 HydrophobicContact CD2-CD2 4.08Å; F407-L411 VanDerWaalsContact O-CB 3.32Å; F407-L411 WeakPolarHBondContact O-CB 3.37Å; F407-L411 PolarHBondContact O-N 3.32Å; F408-L411 PolarHBondContact O-N 3.36Å; M409-L411 VanDerWaalsContact C-N 3.3Å; M409-L411 PolarHBondContact O-N 3.08Å; L411-G414 PolarHBondContact O-N 3.42Å; L411-L415 HydrophobicContact CD1-CD1 4.22Å; L411-L415 HydrophobicContact CD1-CG 4.24Å; L411-L415 HydrophobicContact CG-CD1 3.9Å; L411-L415 HydrophobicContact CG-CG 4.35Å; L411-L415 VanDerWaalsContact O-CB 3.32Å; L411-L415 WeakPolarHBondContact O-CB 3.34Å; L411-L415 WeakPolarHBondContact O-CG 3.35Å; L411-L415 PolarHBondContact O-N 3.36Å
412	L	96.9	Very high	96	Very high	7 Å²	7	10 Å²	10	4%	0.037	5%	0.051	C	C	.	.	H	α-helix	trans	-66.3	-45.3	179.7	-65.9	-173.3	0	0	0	112.7	F263 T264 F267 P268 F408 M409 G414 L415 D416	F263-L412 HydrophobicContact CE1-CD1 3.93Å; F263-L412 HydrophobicContact CZ-CD1 4.38Å; T264-L412 HydrophobicContact CG2-CD2 3.84Å; F267-L412 HydrophobicContact CB-CD1 3.91Å; F267-L412 HydrophobicContact CD1-CD1 3.6Å; F267-L412 HydrophobicContact CE1-CD1 4.49Å; F267-L412 HydrophobicContact CG-CD1 4.03Å; P268-L412 HydrophobicContact CG-CB 4.18Å; F408-L412 HydrophobicContact CD1-CD1 4.37Å; F408-L412 HydrophobicContact CE1-CD1 3.89Å; F408-L412 HydrophobicContact CE2-CD1 4.5Å; F408-L412 HydrophobicContact CE2-CD2 4.2Å; F408-L412 HydrophobicContact CE2-CG 4.33Å; F408-L412 HydrophobicContact CZ-CD1 3.97Å; F408-L412 HydrophobicContact CZ-CD2 4.26Å; F408-L412 HydrophobicContact CZ-CG 4.28Å; F408-L412 WeakPolarHBondContact O-CG 3.34Å; F408-L412 PolarHBondContact O-N 2.94Å; M409-L412 PolarHBondContact O-N 3.18Å; L412-G414 VanDerWaalsContact C-N 3.27Å; L412-G414 PolarHBondContact O-N 3.49Å; L412-L415 HydrophobicContact CD2-CD1 4.31Å; L412-L415 PolarHBondContact O-N 2.69Å; L412-L415 VanDerWaalsContact O-N 3.16Å; L412-D416 PolarHBondContact O-N 3.42Å
413	L	95.6	Very high	96	Very high	4 Å²	4	8.5 Å²	8.5	2%	0.021	5%	0.046	C	C	.	.	H	α-helix	trans	-57.9	-42.4	174.6	-71.6	172.6	0	0	0	111.4	V70 L72 V75 P268 M409 S417	V70-L413 HydrophobicContact CG1-CD2 4.27Å; L72-L413 HydrophobicContact CD2-CB 4.24Å; V75-L413 HydrophobicContact CG2-CD1 3.72Å; P268-L413 HydrophobicContact CB-CD1 4.43Å; P268-L413 HydrophobicContact CB-CD2 3.61Å; P268-L413 HydrophobicContact CB-CG 3.9Å; P268-L413 HydrophobicContact CG-CD2 3.74Å; P268-L413 HydrophobicContact CG-CG 3.9Å; M409-L413 HydrophobicContact CG-CD1 3.9Å; M409-L413 HydrophobicContact CG-CG 4.32Å; M409-L413 WeakPolarHBondContact O-CG 3.47Å; M409-L413 PolarHBondContact O-N 3.48Å; L413-S417 PolarHBondContact O-N 2.91Å; L413-S417 PolarHBondContact O-OG 3.03Å
414	G	95.2	Very high	96	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-65.1	-44.6	174.7	0	0	0	0	0	112.9	Y148 L152 L410 L411 L412 D416 S417 Q418	Y148-G414 WeakPolarHBondContact CE1-O 3.48Å; L152-G414 VanDerWaalsContact CD1-CA 3.45Å; L410-G414 PolarHBondContact O-N 3.4Å; L411-G414 PolarHBondContact O-N 3.42Å; L412-G414 VanDerWaalsContact C-N 3.27Å; L412-G414 PolarHBondContact O-N 3.49Å; G414-D416 PolarHBondContact O-N 3.47Å; G414-S417 PolarHBondContact O-N 3.01Å; G414-Q418 WeakPolarHBondContact O-CB 3.46Å; G414-Q418 WeakPolarHBondContact O-CG 3.48Å; G414-Q418 PolarHBondContact O-N 2.87Å
415	L	96.1	Very high	96	Very high	10 Å²	10	9.1 Å²	9.1	5%	0.052	5%	0.046	C	C	.	.	H	α-helix	trans	-62.5	-42.3	-178.5	-81.2	172.3	0	0	0	111.9	L152 L245 V246 L411 L412 S417 Q418 F419	L152-L415 HydrophobicContact CD2-CB 4.38Å; L152-L415 HydrophobicContact CD2-CD2 3.67Å; L152-L415 HydrophobicContact CD2-CG 3.81Å; L245-L415 HydrophobicContact CB-CD2 4.23Å; L245-L415 HydrophobicContact CD1-CD1 4.32Å; V246-L415 HydrophobicContact CG2-CD2 4.06Å; L411-L415 HydrophobicContact CD1-CD1 4.22Å; L411-L415 HydrophobicContact CD1-CG 4.24Å; L411-L415 HydrophobicContact CG-CD1 3.9Å; L411-L415 HydrophobicContact CG-CG 4.35Å; L411-L415 VanDerWaalsContact O-CB 3.32Å; L411-L415 WeakPolarHBondContact O-CB 3.34Å; L411-L415 WeakPolarHBondContact O-CG 3.35Å; L411-L415 PolarHBondContact O-N 3.36Å; L412-L415 HydrophobicContact CD2-CD1 4.31Å; L412-L415 PolarHBondContact O-N 2.69Å; L412-L415 VanDerWaalsContact O-N 3.16Å; L415-S417 PolarHBondContact O-N 3.17Å; L415-Q418 WeakPolarHBondContact O-CB 3.2Å; L415-Q418 PolarHBondContact O-N 3.07Å; L415-F419 HydrophobicContact CB-CE1 3.98Å; L415-F419 HydrophobicContact CB-CE2 4.11Å; L415-F419 HydrophobicContact CB-CZ 3.63Å; L415-F419 HydrophobicContact CD1-CZ 4.39Å; L415-F419 HydrophobicContact CD2-CE1 3.72Å; L415-F419 HydrophobicContact CD2-CZ 3.95Å; L415-F419 HydrophobicContact CG-CE1 4.39Å; L415-F419 HydrophobicContact CG-CZ 4.19Å; L415-F419 WeakPolarHBondContact O-CD1 3.32Å; L415-F419 WeakPolarHBondContact O-CD2 3.22Å; L415-F419 WeakPolarHBondContact O-CG 3.4Å; L415-F419 PolarHBondContact O-N 3.05Å
416	D	95.6	Very high	96	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	4%	0.035	C	C	.	.	H	α-helix	trans	-62.5	-44.5	178.7	-76.3	-28.5	0	0	0	112.4	G67 T264 A265 L412 G414 Q418 F419 V420	G67-D416 VanDerWaalsContact O-CB 3.26Å; G67-D416 WeakPolarHBondContact O-CB 3.03Å; T264-D416 WeakPolarHBondContact CB-OD1 3.31Å; T264-D416 VanDerWaalsContact O-OD2 3.13Å; T264-D416 PolarHBondContact OG1-OD1 3.42Å; T264-D416 PolarHBondContact OG1-OD2 2.91Å; A265-D416 WeakPolarHBondContact CA-OD2 3.27Å; A265-D416 PolarHBondContact N-OD2 3.48Å; L412-D416 PolarHBondContact O-N 3.42Å; G414-D416 PolarHBondContact O-N 3.47Å; D416-Q418 VanDerWaalsContact C-N 3.29Å; D416-Q418 PolarHBondContact O-N 3.43Å; D416-F419 PolarHBondContact O-N 3.24Å; D416-V420 PolarHBondContact O-N 3.06Å
417	S	94.9	Very high	96	Very high	14 Å²	14	7.1 Å²	7.1	10%	0.098	4%	0.035	C	C	.	.	H	α-helix	trans	-64.1	-39.1	176.9	-37.5	0	0	0	0	111.5	G67 Y148 L413 G414 L415 G421	G67-S417 PolarHBondContact O-N 3.16Å; Y148-S417 PolarHBondContact OH-OG 3.25Å; L413-S417 PolarHBondContact O-N 2.91Å; L413-S417 PolarHBondContact O-OG 3.03Å; G414-S417 PolarHBondContact O-N 3.01Å; L415-S417 PolarHBondContact O-N 3.17Å; S417-G421 PolarHBondContact O-N 2.94Å
418	Q	96.1	Very high	96	Very high	1 Å²	1	7 Å²	7	1%	0.005	4%	0.035	C	C	.	.	H	α-helix	trans	-62.9	-43.7	175.3	-79.3	-67.5	-12.2	0	0	113	N145 Y148 I149 L152 V246 G414 L415 D416 V420 G421 V422	N145-Q418 PolarHBondContact O-NE2 3.22Å; N145-Q418 PolarHBondContact O-OE1 3.32Å; Y148-Q418 HydrophobicContact CD1-CG 3.74Å; Y148-Q418 VanDerWaalsContact CD1-NE2 3.27Å; Y148-Q418 HydrophobicContact CE1-CG 4.1Å; I149-Q418 VanDerWaalsContact CA-NE2 3.33Å; I149-Q418 HydrophobicContact CG1-CG 4.31Å; L152-Q418 HydrophobicContact CD1-CG 4.23Å; L152-Q418 HydrophobicContact CD2-CB 4.43Å; L152-Q418 HydrophobicContact CD2-CG 3.82Å; V246-Q418 HydrophobicContact CG2-CB 4.03Å; G414-Q418 WeakPolarHBondContact O-CB 3.46Å; G414-Q418 WeakPolarHBondContact O-CG 3.48Å; G414-Q418 PolarHBondContact O-N 2.87Å; L415-Q418 WeakPolarHBondContact O-CB 3.2Å; L415-Q418 PolarHBondContact O-N 3.07Å; D416-Q418 VanDerWaalsContact C-N 3.29Å; D416-Q418 PolarHBondContact O-N 3.43Å; Q418-V420 VanDerWaalsContact C-N 3.31Å; Q418-V420 PolarHBondContact O-N 3.34Å; Q418-G421 PolarHBondContact O-N 3.35Å; Q418-V422 WeakPolarHBondContact O-CG2 3.14Å; Q418-V422 PolarHBondContact O-N 2.78Å
419	F	95.1	Very high	95.9	Very high	2 Å²	2	7 Å²	7	1%	0.009	4%	0.037	C	C	.	.	H	α-helix	trans	-59.1	-46	-179.8	-61.6	-18.2	0	0	0	111.2	V246 C249 V250 T257 I260 L415 D416 E423	V246-F419 HydrophobicContact CB-CD1 4.41Å; V246-F419 HydrophobicContact CB-CE1 4.4Å; V246-F419 HydrophobicContact CG1-CD1 4.45Å; V246-F419 HydrophobicContact CG2-CD1 4.08Å; V246-F419 HydrophobicContact CG2-CE1 3.95Å; C249-F419 HydrophobicContact CB-CD1 3.74Å; C249-F419 HydrophobicContact CB-CD2 4.1Å; C249-F419 HydrophobicContact CB-CE1 3.51Å; C249-F419 HydrophobicContact CB-CE2 3.88Å; C249-F419 HydrophobicContact CB-CG 4.04Å; C249-F419 HydrophobicContact CB-CZ 3.58Å; C249-F419 WeakPolarHBondContact SG-CZ 3.23Å; V250-F419 HydrophobicContact CG2-CB 4.01Å; V250-F419 HydrophobicContact CG2-CD1 4.31Å; V250-F419 HydrophobicContact CG2-CG 4.45Å; V250-F419 WeakPolarHBondContact CG2-O 3.03Å; T257-F419 HydrophobicContact CG2-CB 4.21Å; I260-F419 HydrophobicContact CG2-CE2 3.95Å; L415-F419 HydrophobicContact CB-CE1 3.98Å; L415-F419 HydrophobicContact CB-CE2 4.11Å; L415-F419 HydrophobicContact CB-CZ 3.63Å; L415-F419 HydrophobicContact CD1-CZ 4.39Å; L415-F419 HydrophobicContact CD2-CE1 3.72Å; L415-F419 HydrophobicContact CD2-CZ 3.95Å; L415-F419 HydrophobicContact CG-CE1 4.39Å; L415-F419 HydrophobicContact CG-CZ 4.19Å; L415-F419 WeakPolarHBondContact O-CD1 3.32Å; L415-F419 WeakPolarHBondContact O-CD2 3.22Å; L415-F419 WeakPolarHBondContact O-CG 3.4Å; L415-F419 PolarHBondContact O-N 3.05Å; D416-F419 PolarHBondContact O-N 3.24Å; F419-E423 VanDerWaalsContact O-CB 3.29Å; F419-E423 WeakPolarHBondContact O-CB 3.42Å; F419-E423 PolarHBondContact O-N 2.91Å
420	V	95.7	Very high	95.8	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.006	5%	0.046	C	C	.	.	H	α-helix	trans	-74	-37.5	-178.4	172.6	0	0	0	0	111.9	F68 A323 L327 D416 Q418 E423 G424	F68-V420 HydrophobicContact CB-CB 3.87Å; F68-V420 HydrophobicContact CB-CG1 3.76Å; F68-V420 HydrophobicContact CB-CG2 4.01Å; F68-V420 HydrophobicContact CD1-CG1 3.74Å; F68-V420 HydrophobicContact CD2-CB 3.53Å; F68-V420 HydrophobicContact CD2-CG1 3.48Å; F68-V420 VanDerWaalsContact CD2-CG1 3.48Å; F68-V420 HydrophobicContact CE1-CG1 4.14Å; F68-V420 HydrophobicContact CE2-CB 4.19Å; F68-V420 HydrophobicContact CE2-CG1 3.94Å; F68-V420 HydrophobicContact CG-CB 3.77Å; F68-V420 HydrophobicContact CG-CG1 3.38Å; F68-V420 HydrophobicContact CG-CG2 4.46Å; F68-V420 HydrophobicContact CZ-CG1 4.25Å; A323-V420 HydrophobicContact CB-CG1 4.1Å; L327-V420 HydrophobicContact CD1-CG1 3.59Å; L327-V420 HydrophobicContact CD1-CG2 4.35Å; L327-V420 HydrophobicContact CD2-CG1 4.07Å; L327-V420 HydrophobicContact CD2-CG2 4.4Å; L327-V420 HydrophobicContact CG-CG1 3.91Å; D416-V420 PolarHBondContact O-N 3.06Å; Q418-V420 VanDerWaalsContact C-N 3.31Å; Q418-V420 PolarHBondContact O-N 3.34Å; V420-E423 PolarHBondContact O-N 3.27Å; V420-G424 PolarHBondContact O-N 2.84Å
421	G	96.2	Very high	95.7	Very high	2 Å²	2	10 Å²	10	2%	0.021	5%	0.053	C	C	.	.	H	α-helix	trans	-60.9	-44.7	174	0	0	0	0	0	112.4	V141 N145 S417 Q418 G424 F425	V141-G421 WeakPolarHBondContact CG2-O 2.9Å; N145-G421 PolarHBondContact ND2-O 3.49Å; N145-G421 VanDerWaalsContact ND2-O 3.09Å; N145-G421 VanDerWaalsContact OD1-CA 3.25Å; N145-G421 WeakPolarHBondContact OD1-CA 3.39Å; S417-G421 PolarHBondContact O-N 2.94Å; Q418-G421 PolarHBondContact O-N 3.35Å; G421-G424 PolarHBondContact O-N 3.24Å; G421-F425 PolarHBondContact O-N 3.23Å; G421-F425 VanDerWaalsContact O-N 3.12Å
422	V	97.3	Very high	95.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-68.9	-41.3	175.3	176.5	0	0	0	0	111.3	N145 W243 V246 V250 Q418 G424 F425 I426 V447	N145-V422 HydrophobicContact CB-CG2 4.35Å; N145-V422 PolarHBondContact ND2-N 3.27Å; N145-V422 PolarHBondContact OD1-N 3.15Å; W243-V422 HydrophobicContact CZ3-CG2 4.13Å; V246-V422 HydrophobicContact CG1-CB 4.32Å; V246-V422 HydrophobicContact CG1-CG2 3.89Å; V250-V422 HydrophobicContact CG1-CG1 4.23Å; V250-V422 HydrophobicContact CG2-CB 4.49Å; Q418-V422 WeakPolarHBondContact O-CG2 3.14Å; Q418-V422 PolarHBondContact O-N 2.78Å; V422-G424 VanDerWaalsContact C-N 3.3Å; V422-G424 PolarHBondContact O-N 3.34Å; V422-F425 PolarHBondContact O-N 2.92Å; V422-I426 HydrophobicContact CG1-CG1 4.07Å; V422-I426 WeakPolarHBondContact O-CB 3.45Å; V422-I426 VanDerWaalsContact O-CG1 3.24Å; V422-I426 WeakPolarHBondContact O-CG1 3.48Å; V422-I426 PolarHBondContact O-N 3.11Å; V422-V447 HydrophobicContact CG1-CG1 4.37Å
423	E	95.9	Very high	95.1	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.009	9%	0.086	C	C	.	.	H	α-helix	trans	-57	-44.5	173.9	-176	69.4	-127.3	0	0	111.6	V250 V254 Y330 F419 V420 I426 T427 R443	V250-E423 HydrophobicContact CG1-CB 4.43Å; V254-E423 HydrophobicContact CG1-CG 4.33Å; Y330-E423 PolarHBondContact OH-OE1 2.81Å; F419-E423 VanDerWaalsContact O-CB 3.29Å; F419-E423 WeakPolarHBondContact O-CB 3.42Å; F419-E423 PolarHBondContact O-N 2.91Å; V420-E423 PolarHBondContact O-N 3.27Å; E423-I426 PolarHBondContact O-N 3.17Å; E423-T427 VanDerWaalsContact O-CB 3.26Å; E423-T427 WeakPolarHBondContact O-CB 3.26Å; E423-T427 PolarHBondContact O-N 2.88Å; E423-T427 PolarHBondContact O-OG1 2.94Å; E423-T427 PolarHBondContact OE1-OG1 3.36Å; E423-R443 IonicContact OE1-CZ 2.7Å; E423-R443 IonicContact OE1-NE 2.84Å; E423-R443 IonicContact OE1-NH2 2.85Å; E423-R443 PolarHBondContact OE1-NH2 2.82Å; E423-R443 IonicContact OE2-CZ 3.17Å; E423-R443 IonicContact OE2-NH2 3.13Å; E423-R443 PolarHBondContact OE2-NH2 3.41Å
424	G	96.4	Very high	94.4	Very high	1 Å²	1	19.3 Å²	19.3	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-60	-49.1	178.4	0	0	0	0	0	112	V420 G421 V422 T427 G428	V420-G424 PolarHBondContact O-N 2.84Å; G421-G424 PolarHBondContact O-N 3.24Å; V422-G424 VanDerWaalsContact C-N 3.3Å; V422-G424 PolarHBondContact O-N 3.34Å; G424-T427 PolarHBondContact O-N 3.23Å; G424-G428 PolarHBondContact O-N 3.39Å
425	F	97.5	Very high	93.5	Very high	29 Å²	29	22 Å²	22	13%	0.127	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-50.4	176.3	-175.3	-100.1	0	0	0	112.1	M138 V141 F142 G421 V422 T427 G428 L429 C450	M138-F425 HydrophobicContact CE-CD2 3.33Å; M138-F425 HydrophobicContact CE-CE2 3.44Å; M138-F425 VanDerWaalsContact CE-CE2 3.44Å; M138-F425 HydrophobicContact CE-CG 3.93Å; M138-F425 HydrophobicContact CE-CZ 4.13Å; M138-F425 VanDerWaalsContact CE-O 3.23Å; M138-F425 WeakPolarHBondContact CE-O 3.47Å; M138-F425 HydrophobicContact SD-CD2 3.97Å; V141-F425 HydrophobicContact CG1-CB 3.95Å; V141-F425 HydrophobicContact CG1-CD2 3.86Å; V141-F425 HydrophobicContact CG1-CG 4.4Å; F142-F425 HydrophobicContact CB-CD2 4.08Å; F142-F425 HydrophobicContact CB-CE2 3.79Å; F142-F425 HydrophobicContact CD2-CE1 4.41Å; F142-F425 HydrophobicContact CD2-CE2 4.02Å; F142-F425 AromaticContact CD2-CZ 3.9Å; F142-F425 HydrophobicContact CD2-CZ 3.9Å; F142-F425 HydrophobicContact CG-CE2 4.27Å; G421-F425 PolarHBondContact O-N 3.23Å; G421-F425 VanDerWaalsContact O-N 3.12Å; V422-F425 PolarHBondContact O-N 2.92Å; F425-T427 VanDerWaalsContact C-N 3.3Å; F425-T427 PolarHBondContact O-N 3.37Å; F425-G428 PolarHBondContact O-N 3.35Å; F425-L429 HydrophobicContact CE1-CD2 4.47Å; F425-L429 PolarHBondContact O-N 3.1Å; F425-C450 HydrophobicContact CE1-CB 4.5Å
426	I	96.5	Very high	92.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-38.9	-179	-66.4	-62.6	0	0	0	111.3	V422 E423 L429 L430 R443 S446 V447 C450	V422-I426 HydrophobicContact CG1-CG1 4.07Å; V422-I426 WeakPolarHBondContact O-CB 3.45Å; V422-I426 VanDerWaalsContact O-CG1 3.24Å; V422-I426 WeakPolarHBondContact O-CG1 3.48Å; V422-I426 PolarHBondContact O-N 3.11Å; E423-I426 PolarHBondContact O-N 3.17Å; I426-L429 PolarHBondContact O-N 2.78Å; I426-L430 HydrophobicContact CG2-CD1 3.76Å; I426-L430 HydrophobicContact CG2-CG 4.08Å; I426-L430 WeakPolarHBondContact O-CB 3.47Å; I426-L430 VanDerWaalsContact O-CG 3.28Å; I426-L430 WeakPolarHBondContact O-CG 3.33Å; I426-L430 PolarHBondContact O-N 3.44Å; I426-R443 HydrophobicContact CG2-CG 4.35Å; I426-S446 WeakPolarHBondContact CD1-O 3.36Å; I426-V447 HydrophobicContact CB-CG2 4.46Å; I426-V447 HydrophobicContact CD1-CG2 4.17Å; I426-V447 HydrophobicContact CG1-CG2 3.85Å; I426-V447 HydrophobicContact CG2-CG2 4Å; I426-C450 HydrophobicContact CD1-CB 3.82Å
427	T	95.5	Very high	91.7	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-47.6	175.3	-58.8	0	0	0	0	110.8	A326 Y330 E423 G424 F425 L429 D431	A326-T427 HydrophobicContact CB-CG2 4.06Å; Y330-T427 HydrophobicContact CE2-CG2 4Å; Y330-T427 WeakPolarHBondContact CE2-OG1 3.35Å; Y330-T427 WeakPolarHBondContact OH-CG2 3.23Å; Y330-T427 PolarHBondContact OH-OG1 3.14Å; E423-T427 VanDerWaalsContact O-CB 3.26Å; E423-T427 WeakPolarHBondContact O-CB 3.26Å; E423-T427 PolarHBondContact O-N 2.88Å; E423-T427 PolarHBondContact O-OG1 2.94Å; E423-T427 PolarHBondContact OE1-OG1 3.36Å; G424-T427 PolarHBondContact O-N 3.23Å; F425-T427 VanDerWaalsContact C-N 3.3Å; F425-T427 PolarHBondContact O-N 3.37Å; T427-L429 VanDerWaalsContact C-N 3.32Å; T427-L429 PolarHBondContact O-N 2.88Å; T427-D431 WeakPolarHBondContact O-CB 3.37Å; T427-D431 PolarHBondContact O-N 2.87Å; T427-D431 VanDerWaalsContact O-N 3.11Å
428	G	95.7	Very high	91	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-38.1	176.8	0	0	0	0	0	113.3	G424 F425	G424-G428 PolarHBondContact O-N 3.39Å; F425-G428 PolarHBondContact O-N 3.35Å
429	L	95	Very high	90.5	Very high	62 Å²	62	43.8 Å²	43.8	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-69.6	-47.9	178.4	-178.6	63.1	0	0	0	112.4	M138 F425 I426 T427 D431 L432	M138-L429 HydrophobicContact CE-CB 4.31Å; F425-L429 HydrophobicContact CE1-CD2 4.47Å; F425-L429 PolarHBondContact O-N 3.1Å; I426-L429 PolarHBondContact O-N 2.78Å; T427-L429 VanDerWaalsContact C-N 3.32Å; T427-L429 PolarHBondContact O-N 2.88Å; L429-D431 VanDerWaalsContact C-N 3.27Å; L429-D431 PolarHBondContact O-N 2.92Å; L429-L432 WeakPolarHBondContact O-CB 3.49Å; L429-L432 PolarHBondContact O-N 3.45Å
430	L	93.8	Very high	89.9	Confident	35 Å²	35	53.3 Å²	53.3	18%	0.183	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-32.2	-178.7	-69.4	-179.3	0	0	0	112.2	I426 L432 L433 Q442 R443	I426-L430 HydrophobicContact CG2-CD1 3.76Å; I426-L430 HydrophobicContact CG2-CG 4.08Å; I426-L430 WeakPolarHBondContact O-CB 3.47Å; I426-L430 VanDerWaalsContact O-CG 3.28Å; I426-L430 WeakPolarHBondContact O-CG 3.33Å; I426-L430 PolarHBondContact O-N 3.44Å; L430-L432 PolarHBondContact O-N 3.11Å; L430-L433 HydrophobicContact CD2-CD1 3.89Å; L430-L433 WeakPolarHBondContact O-CB 3.26Å; L430-L433 PolarHBondContact O-N 3.35Å; L430-L433 VanDerWaalsContact O-N 3.12Å; L430-Q442 HydrophobicContact CD2-CG 3.81Å; L430-R443 HydrophobicContact CD1-CB 4.02Å; L430-R443 HydrophobicContact CD1-CG 3.87Å
431	D	92.3	Very high	89.5	Confident	31 Å²	31	58.2 Å²	58.2	17%	0.166	29%	0.285	C	S	.	.	H	α-helix	trans	-63.9	-27	175.9	-83.2	13.8	0	0	0	113.3	R52 A118 G119 N122 T427 L429 L433	R52-D431 IonicContact CZ-OD1 2.66Å; R52-D431 IonicContact CZ-OD2 2.9Å; R52-D431 IonicContact NH1-OD1 3.95Å; R52-D431 PolarHBondContact NH1-OD1 2.84Å; R52-D431 IonicContact NH2-OD1 2.76Å; R52-D431 PolarHBondContact NH2-OD1 3.23Å; R52-D431 IonicContact NH2-OD2 2.65Å; R52-D431 PolarHBondContact NH2-OD2 3.29Å; A118-D431 WeakPolarHBondContact CA-OD2 3.5Å; G119-D431 PolarHBondContact N-OD2 2.87Å; N122-D431 HydrophobicContact CB-CB 4.39Å; N122-D431 PolarHBondContact ND2-O 3.46Å; T427-D431 WeakPolarHBondContact O-CB 3.37Å; T427-D431 PolarHBondContact O-N 2.87Å; T427-D431 VanDerWaalsContact O-N 3.11Å; L429-D431 VanDerWaalsContact C-N 3.27Å; L429-D431 PolarHBondContact O-N 2.92Å; D431-L433 VanDerWaalsContact C-N 3.31Å
432	L	91.3	Very high	89.3	Confident	73 Å²	73	59.1 Å²	59.1	38%	0.382	29%	0.288	S	S	.	.	H	α-helix	trans	-75.5	-21.8	175.2	-71.8	-179.4	0	0	0	113.2	I121 L429 L430	I121-L432 HydrophobicContact CB-CD2 4.27Å; I121-L432 HydrophobicContact CD1-CD1 3.52Å; I121-L432 HydrophobicContact CD1-CD2 4.12Å; I121-L432 HydrophobicContact CD1-CG 3.91Å; I121-L432 HydrophobicContact CG2-CD2 3.89Å; L429-L432 WeakPolarHBondContact O-CB 3.49Å; L429-L432 PolarHBondContact O-N 3.45Å; L430-L432 PolarHBondContact O-N 3.11Å
433	L	88.7	Confident	89.1	Confident	71 Å²	71	60.9 Å²	60.9	37%	0.372	30%	0.295	S	S	.	.	S	Bend	trans	-75.6	128.2	-173.4	-64.1	174.8	0	0	0	109.7	L430 D431 Q442	L430-L433 HydrophobicContact CD2-CD1 3.89Å; L430-L433 WeakPolarHBondContact O-CB 3.26Å; L430-L433 PolarHBondContact O-N 3.35Å; L430-L433 VanDerWaalsContact O-N 3.12Å; D431-L433 VanDerWaalsContact C-N 3.31Å; L433-Q442 HydrophobicContact CD1-CG 4.41Å
434	P	80.9	Confident	89.1	Confident	70 Å²	70	62 Å²	62	46%	0.455	30%	0.3	S	S	.	.			trans	-62.4	146.2	179.2	-17.2	27	0	0	0	111.1	S436 Y437	P434-S436 PolarHBondContact O-N 2.9Å; P434-Y437 HydrophobicContact CB-CD2 3.8Å; P434-Y437 HydrophobicContact CB-CE2 4.22Å; P434-Y437 HydrophobicContact CG-CD2 3.69Å; P434-Y437 HydrophobicContact CG-CE2 3.85Å; P434-Y437 WeakPolarHBondContact O-CB 3.5Å; P434-Y437 PolarHBondContact O-N 3.22Å
435	A	76.9	Confident	89	Confident	55 Å²	55	65.8 Å²	65.8	46%	0.455	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-45.3	-36.2	177.2	0	0	0	0	0	114.6	V49 Y437 Y438	V49-A435 HydrophobicContact CG2-CB 3.18Å; A435-Y437 PolarHBondContact O-N 3.3Å; A435-Y438 WeakPolarHBondContact O-CB 3.2Å; A435-Y438 PolarHBondContact O-N 3.5Å
436	S	76.4	Confident	89	Confident	100 Å²	100	65.1 Å²	65.1	70%	0.699	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-71	-15.8	-178.6	80.2	0	0	0	0	114	P434 Y438	P434-S436 PolarHBondContact O-N 2.9Å; S436-Y438 VanDerWaalsContact C-N 3.31Å
437	Y	78.7	Confident	89	Confident	153 Å²	153	65.1 Å²	65.1	60%	0.6	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-92	8.7	176.1	-68.1	-87.3	0	0	0	112.2	P434 A435 F439	P434-Y437 HydrophobicContact CB-CD2 3.8Å; P434-Y437 HydrophobicContact CB-CE2 4.22Å; P434-Y437 HydrophobicContact CG-CD2 3.69Å; P434-Y437 HydrophobicContact CG-CE2 3.85Å; P434-Y437 WeakPolarHBondContact O-CB 3.5Å; P434-Y437 PolarHBondContact O-N 3.22Å; A435-Y437 PolarHBondContact O-N 3.3Å; Y437-F439 WeakPolarHBondContact O-CD1 3.39Å; Y437-F439 PolarHBondContact O-N 2.92Å
438	Y	78.7	Confident	89.1	Confident	134 Å²	134	66.9 Å²	66.9	53%	0.525	33%	0.333	S	S	.	.			trans	-62.4	126.3	175.6	-179.9	-97.8	0	0	0	111	P50 A435 S436	P50-Y438 HydrophobicContact CG-CE2 4.31Å; A435-Y438 WeakPolarHBondContact O-CB 3.2Å; A435-Y438 PolarHBondContact O-N 3.5Å; S436-Y438 VanDerWaalsContact C-N 3.31Å
439	F	85.6	Confident	89.2	Confident	98 Å²	98	72.2 Å²	72.2	43%	0.43	36%	0.361	S	S	.	.			trans	-140.8	155.4	170.5	68.4	-90	0	0	0	111.2	Y437 F441 Q442 I445	Y437-F439 WeakPolarHBondContact O-CD1 3.39Å; Y437-F439 PolarHBondContact O-N 2.92Å; F439-F441 VanDerWaalsContact C-N 3.29Å; F439-F441 HydrophobicContact CE2-CB 4.42Å; F439-F441 PolarHBondContact O-N 3.09Å; F439-F441 VanDerWaalsContact O-N 3.11Å; F439-Q442 HydrophobicContact CD1-CB 3.77Å; F439-Q442 HydrophobicContact CD1-CG 4.02Å; F439-Q442 HydrophobicContact CD2-CB 4.01Å; F439-Q442 HydrophobicContact CE1-CB 3.62Å; F439-Q442 HydrophobicContact CE1-CG 3.62Å; F439-Q442 HydrophobicContact CE2-CB 3.86Å; F439-Q442 HydrophobicContact CG-CB 3.97Å; F439-Q442 HydrophobicContact CZ-CB 3.69Å; F439-Q442 HydrophobicContact CZ-CG 3.99Å; F439-Q442 WeakPolarHBondContact O-CB 3.43Å; F439-Q442 PolarHBondContact O-N 3.03Å; F439-Q442 VanDerWaalsContact O-N 3.08Å; F439-I445 HydrophobicContact CE2-CD1 3.79Å; F439-I445 HydrophobicContact CZ-CD1 4.22Å
440	R	83.3	Confident	89.4	Confident	201 Å²	201	69.6 Å²	69.6	76%	0.758	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-36.6	-166.4	-176.9	177.7	179.9	175.8	0.4	115.3
441	F	87.4	Confident	89.6	Confident	105 Å²	105	68.4 Å²	68.4	46%	0.461	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	17.2	-176.2	-58.9	-64.8	0	0	0	113.3	F439 R443 E444 I445	F439-F441 VanDerWaalsContact C-N 3.29Å; F439-F441 HydrophobicContact CE2-CB 4.42Å; F439-F441 PolarHBondContact O-N 3.09Å; F439-F441 VanDerWaalsContact O-N 3.11Å; F441-R443 PolarHBondContact O-N 3.03Å; F441-E444 VanDerWaalsContact CA-OE2 3.27Å; F441-E444 WeakPolarHBondContact CA-OE2 3.49Å; F441-E444 PolarHBondContact O-N 3.42Å; F441-I445 HydrophobicContact CB-CD1 4.5Å; F441-I445 HydrophobicContact CB-CG1 4.47Å; F441-I445 WeakPolarHBondContact O-CG1 3.34Å; F441-I445 PolarHBondContact O-N 3.06Å
442	Q	91.7	Very high	89.9	Confident	20 Å²	20	69.5 Å²	69.5	9%	0.093	36%	0.356	C	S	.	.	H	α-helix	trans	-57.2	-40.2	-173.4	-177.4	-179.6	9.2	0	0	112.5	L430 L433 F439 S446	L430-Q442 HydrophobicContact CD2-CG 3.81Å; L433-Q442 HydrophobicContact CD1-CG 4.41Å; F439-Q442 HydrophobicContact CD1-CB 3.77Å; F439-Q442 HydrophobicContact CD1-CG 4.02Å; F439-Q442 HydrophobicContact CD2-CB 4.01Å; F439-Q442 HydrophobicContact CE1-CB 3.62Å; F439-Q442 HydrophobicContact CE1-CG 3.62Å; F439-Q442 HydrophobicContact CE2-CB 3.86Å; F439-Q442 HydrophobicContact CG-CB 3.97Å; F439-Q442 HydrophobicContact CZ-CB 3.69Å; F439-Q442 HydrophobicContact CZ-CG 3.99Å; F439-Q442 WeakPolarHBondContact O-CB 3.43Å; F439-Q442 PolarHBondContact O-N 3.03Å; F439-Q442 VanDerWaalsContact O-N 3.08Å; Q442-S446 VanDerWaalsContact O-CB 3.31Å; Q442-S446 WeakPolarHBondContact O-CB 3.47Å; Q442-S446 PolarHBondContact O-N 2.88Å; Q442-S446 PolarHBondContact O-OG 3.14Å
443	R	92.8	Very high	90.2	Very high	37 Å²	37	70.5 Å²	70.5	14%	0.14	36%	0.361	C	S	.	.	H	α-helix	trans	-71.7	-48.1	-179.1	-173.4	171.9	-172.3	-60.9	-6.3	111.6	V250 W251 G253 E423 I426 L430 F441 I445 S446 V447	V250-R443 VanDerWaalsContact O-CZ 3.28Å; V250-R443 PolarHBondContact O-NH1 3.31Å; V250-R443 PolarHBondContact O-NH2 3.13Å; V250-R443 VanDerWaalsContact O-NH2 3.16Å; W251-R443 PolarHBondContact O-NH1 2.98Å; G253-R443 VanDerWaalsContact CA-NH2 3.34Å; E423-R443 IonicContact OE1-CZ 2.7Å; E423-R443 IonicContact OE1-NE 2.84Å; E423-R443 IonicContact OE1-NH2 2.85Å; E423-R443 PolarHBondContact OE1-NH2 2.82Å; E423-R443 IonicContact OE2-CZ 3.17Å; E423-R443 IonicContact OE2-NH2 3.13Å; E423-R443 PolarHBondContact OE2-NH2 3.41Å; I426-R443 HydrophobicContact CG2-CG 4.35Å; L430-R443 HydrophobicContact CD1-CB 4.02Å; L430-R443 HydrophobicContact CD1-CG 3.87Å; F441-R443 PolarHBondContact O-N 3.03Å; R443-I445 VanDerWaalsContact C-N 3.3Å; R443-I445 PolarHBondContact O-N 3.45Å; R443-S446 PolarHBondContact O-N 3.17Å; R443-S446 VanDerWaalsContact O-N 3.17Å; R443-V447 HydrophobicContact CG-CG2 4.43Å; R443-V447 WeakPolarHBondContact O-CG2 3.25Å; R443-V447 PolarHBondContact O-N 2.84Å
444	E	95.6	Very high	90.7	Very high	25 Å²	25	67.1 Å²	67.1	12%	0.117	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-41.5	178.5	-64.8	90	151.1	0	0	111.7	Y247 W251 K252 F441 A448	Y247-E444 WeakPolarHBondContact CE2-O 3.48Å; W251-E444 HydrophobicContact CB-CG 4.29Å; W251-E444 HydrophobicContact CE3-CG 4.44Å; K252-E444 IonicContact NZ-OE1 2.71Å; K252-E444 PolarHBondContact NZ-OE1 2.97Å; F441-E444 VanDerWaalsContact CA-OE2 3.27Å; F441-E444 WeakPolarHBondContact CA-OE2 3.49Å; F441-E444 PolarHBondContact O-N 3.42Å; E444-A448 WeakPolarHBondContact O-CB 3.48Å; E444-A448 PolarHBondContact O-N 3.07Å
445	I	95.8	Very high	91.5	Very high	81 Å²	81	65.9 Å²	65.9	42%	0.415	33%	0.331	S	S	.	.	H	α-helix	trans	-68.3	-42.8	176.1	-64.9	-177.5	0	0	0	110.8	F439 F441 R443 V447 A448 L449	F439-I445 HydrophobicContact CE2-CD1 3.79Å; F439-I445 HydrophobicContact CZ-CD1 4.22Å; F441-I445 HydrophobicContact CB-CD1 4.5Å; F441-I445 HydrophobicContact CB-CG1 4.47Å; F441-I445 WeakPolarHBondContact O-CG1 3.34Å; F441-I445 PolarHBondContact O-N 3.06Å; R443-I445 VanDerWaalsContact C-N 3.3Å; R443-I445 PolarHBondContact O-N 3.45Å; I445-V447 VanDerWaalsContact C-N 3.33Å; I445-V447 PolarHBondContact O-N 3.28Å; I445-A448 PolarHBondContact O-N 3.36Å; I445-L449 HydrophobicContact CG2-CD1 3.85Å; I445-L449 HydrophobicContact CG2-CG 4.16Å; I445-L449 WeakPolarHBondContact O-CB 3.4Å; I445-L449 VanDerWaalsContact O-CG 3.32Å; I445-L449 WeakPolarHBondContact O-CG 3.47Å; I445-L449 PolarHBondContact O-N 3.34Å
446	S	96	Very high	92.5	Very high	16 Å²	16	67.7 Å²	67.7	11%	0.112	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-41.7	179.3	-59.2	0	0	0	0	111.9	I426 Q442 R443 C450	I426-S446 WeakPolarHBondContact CD1-O 3.36Å; Q442-S446 VanDerWaalsContact O-CB 3.31Å; Q442-S446 WeakPolarHBondContact O-CB 3.47Å; Q442-S446 PolarHBondContact O-N 2.88Å; Q442-S446 PolarHBondContact O-OG 3.14Å; R443-S446 PolarHBondContact O-N 3.17Å; R443-S446 VanDerWaalsContact O-N 3.17Å; S446-C450 WeakPolarHBondContact O-CB 3.21Å; S446-C450 PolarHBondContact O-N 2.98Å
447	V	97.3	Very high	93.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.9	-45.3	175.9	-177.2	0	0	0	0	110	Y247 V250 V422 I426 R443 I445 L449 C450 C451	Y247-V447 HydrophobicContact CD2-CB 4.26Å; Y247-V447 HydrophobicContact CD2-CG1 3.82Å; Y247-V447 HydrophobicContact CE2-CB 4.36Å; Y247-V447 HydrophobicContact CE2-CG1 4.39Å; V250-V447 HydrophobicContact CB-CG1 4.32Å; V250-V447 HydrophobicContact CG1-CG1 4.34Å; V250-V447 HydrophobicContact CG1-CG2 4.25Å; V422-V447 HydrophobicContact CG1-CG1 4.37Å; I426-V447 HydrophobicContact CB-CG2 4.46Å; I426-V447 HydrophobicContact CD1-CG2 4.17Å; I426-V447 HydrophobicContact CG1-CG2 3.85Å; I426-V447 HydrophobicContact CG2-CG2 4Å; R443-V447 HydrophobicContact CG-CG2 4.43Å; R443-V447 WeakPolarHBondContact O-CG2 3.25Å; R443-V447 PolarHBondContact O-N 2.84Å; I445-V447 VanDerWaalsContact C-N 3.33Å; I445-V447 PolarHBondContact O-N 3.28Å; V447-L449 PolarHBondContact O-N 3.26Å; V447-C450 WeakPolarHBondContact O-CB 3.45Å; V447-C450 PolarHBondContact O-N 3.25Å; V447-C451 PolarHBondContact O-N 3.03Å; V447-C451 PolarHBondContact O-SG 3.48Å
448	A	98	Very high	94.5	Very high	37 Å²	37	57.9 Å²	57.9	31%	0.306	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-44.5	177.8	0	0	0	0	0	112.4	Y247 E444 I445 C451 A452	Y247-A448 HydrophobicContact CD2-CB 4.19Å; Y247-A448 HydrophobicContact CE2-CB 3.61Å; E444-A448 WeakPolarHBondContact O-CB 3.48Å; E444-A448 PolarHBondContact O-N 3.07Å; I445-A448 PolarHBondContact O-N 3.36Å; A448-C451 PolarHBondContact O-N 3.46Å; A448-A452 VanDerWaalsContact O-CB 3.24Å; A448-A452 WeakPolarHBondContact O-CB 3.47Å; A448-A452 PolarHBondContact O-N 2.97Å
449	L	97.6	Very high	95.4	Very high	113 Å²	113	53.9 Å²	53.9	59%	0.592	27%	0.273	S	S	*	.	H	α-helix	trans	-65.7	-40.9	177.7	-70.2	175.3	0	0	0	111.9	I445 V447 A452 L453	I445-L449 HydrophobicContact CG2-CD1 3.85Å; I445-L449 HydrophobicContact CG2-CG 4.16Å; I445-L449 WeakPolarHBondContact O-CB 3.4Å; I445-L449 VanDerWaalsContact O-CG 3.32Å; I445-L449 WeakPolarHBondContact O-CG 3.47Å; I445-L449 PolarHBondContact O-N 3.34Å; V447-L449 PolarHBondContact O-N 3.26Å; L449-A452 PolarHBondContact O-N 3.43Å; L449-L453 VanDerWaalsContact O-CB 3.29Å; L449-L453 WeakPolarHBondContact O-CB 3.31Å; L449-L453 PolarHBondContact O-N 2.97Å
450	C	97.9	Very high	95.9	Very high	7 Å²	7	51.4 Å²	51.4	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-53.6	174.4	-177.6	0	0	0	0	110.8	F425 I426 S446 V447 A452 L453 C454	F425-C450 HydrophobicContact CE1-CB 4.5Å; I426-C450 HydrophobicContact CD1-CB 3.82Å; S446-C450 WeakPolarHBondContact O-CB 3.21Å; S446-C450 PolarHBondContact O-N 2.98Å; V447-C450 WeakPolarHBondContact O-CB 3.45Å; V447-C450 PolarHBondContact O-N 3.25Å; C450-A452 VanDerWaalsContact C-N 3.33Å; C450-A452 PolarHBondContact O-N 3.31Å; C450-L453 PolarHBondContact O-N 3.5Å; C450-C454 PolarHBondContact O-N 2.93Å; C450-C454 PolarHBondContact O-SG 3.16Å
451	C	98.4	Very high	96.6	Very high	9 Å²	9	42 Å²	42	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-42.1	178.5	-63.6	0	0	0	0	112.2	W243 V447 A448 F455	W243-C451 HydrophobicContact CD2-CB 4.21Å; W243-C451 HydrophobicContact CE3-CB 3.56Å; W243-C451 HydrophobicContact CZ3-CB 4.1Å; V447-C451 PolarHBondContact O-N 3.03Å; V447-C451 PolarHBondContact O-SG 3.48Å; A448-C451 PolarHBondContact O-N 3.46Å; C451-F455 WeakPolarHBondContact O-CB 3.22Å; C451-F455 PolarHBondContact O-N 2.72Å
452	A	98.4	Very high	97.1	Very high	54 Å²	54	37.2 Å²	37.2	45%	0.446	21%	0.212	S	C	.	.	H	α-helix	trans	-66.6	-40.5	178.6	0	0	0	0	0	112.4	A448 L449 C450 V456	A448-A452 VanDerWaalsContact O-CB 3.24Å; A448-A452 WeakPolarHBondContact O-CB 3.47Å; A448-A452 PolarHBondContact O-N 2.97Å; L449-A452 PolarHBondContact O-N 3.43Å; C450-A452 VanDerWaalsContact C-N 3.33Å; C450-A452 PolarHBondContact O-N 3.31Å; A452-V456 WeakPolarHBondContact O-CG2 3.32Å; A452-V456 PolarHBondContact O-N 3.19Å; A452-V456 VanDerWaalsContact O-N 3.1Å
453	L	98.2	Very high	97.4	Very high	95 Å²	95	37.3 Å²	37.3	50%	0.497	21%	0.214	S	C	.	.	H	α-helix	trans	-66.3	-47.8	177.2	179.9	62.9	0	0	0	111.2	F142 L449 C450 V456 I457	F142-L453 HydrophobicContact CE2-CD2 4.03Å; F142-L453 HydrophobicContact CE2-CG 4.47Å; F142-L453 HydrophobicContact CZ-CD2 3.92Å; F142-L453 HydrophobicContact CZ-CG 4.2Å; L449-L453 VanDerWaalsContact O-CB 3.29Å; L449-L453 WeakPolarHBondContact O-CB 3.31Å; L449-L453 PolarHBondContact O-N 2.97Å; C450-L453 PolarHBondContact O-N 3.5Å; L453-V456 PolarHBondContact O-N 3.46Å; L453-I457 HydrophobicContact CG-CD1 4.42Å; L453-I457 WeakPolarHBondContact O-CG1 3.09Å; L453-I457 PolarHBondContact O-N 3.45Å
454	C	98.2	Very high	97.6	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-45.7	176.2	-63.3	0	0	0	0	110.9	F142 W243 C450 V456 I457 D458	F142-C454 VanDerWaalsContact CE2-SG 3.59Å; W243-C454 HydrophobicContact CH2-CB 3.48Å; W243-C454 VanDerWaalsContact CH2-CB 3.48Å; W243-C454 HydrophobicContact CZ2-CB 3.18Å; W243-C454 HydrophobicContact CZ3-CB 4.39Å; C450-C454 PolarHBondContact O-N 2.93Å; C450-C454 PolarHBondContact O-SG 3.16Å; C454-V456 VanDerWaalsContact C-N 3.29Å; C454-V456 PolarHBondContact O-N 3.33Å; C454-I457 CarbonylContact O-C 3.59Å; C454-I457 WeakPolarHBondContact O-CA 3.37Å; C454-I457 WeakPolarHBondContact O-CB 3.41Å; C454-I457 PolarHBondContact O-N 3.02Å; C454-D458 PolarHBondContact O-N 3.32Å
455	F	98.5	Very high	97.7	Very high	44 Å²	44	35.9 Å²	35.9	19%	0.193	21%	0.21	C	C	.	.	H	α-helix	trans	-54.2	-42.8	176	175.9	-95.6	0	0	0	112.7	T236 L239 L240 W243 C451 I457 D458 L459	T236-F455 HydrophobicContact CG2-CZ 4.32Å; L239-F455 HydrophobicContact CD2-CD2 3.96Å; L239-F455 HydrophobicContact CD2-CE2 3.91Å; L239-F455 HydrophobicContact CG-CD2 3.89Å; L239-F455 HydrophobicContact CG-CE2 3.94Å; L240-F455 HydrophobicContact CB-CE2 3.91Å; L240-F455 HydrophobicContact CB-CZ 4.43Å; L240-F455 HydrophobicContact CD1-CE2 4.14Å; L240-F455 HydrophobicContact CD1-CZ 4.34Å; W243-F455 AromaticContact CD1-CD2 3.78Å; W243-F455 HydrophobicContact CG-CB 4.37Å; C451-F455 WeakPolarHBondContact O-CB 3.22Å; C451-F455 PolarHBondContact O-N 2.72Å; F455-I457 VanDerWaalsContact C-N 3.33Å; F455-I457 PolarHBondContact O-N 3.39Å; F455-D458 PolarHBondContact O-N 2.88Å; F455-L459 HydrophobicContact CE1-CD1 4.4Å; F455-L459 HydrophobicContact CE1-CD2 4.06Å; F455-L459 HydrophobicContact CE1-CG 4.35Å; F455-L459 HydrophobicContact CZ-CD2 3.94Å; F455-L459 WeakPolarHBondContact O-CG 3.18Å; F455-L459 PolarHBondContact O-N 3.26Å; F455-L459 VanDerWaalsContact O-N 3.11Å
456	V	98.4	Very high	97.7	Very high	92 Å²	92	32 Å²	32	56%	0.558	19%	0.19	S	C	*	.	H	α-helix	trans	-65	-37.1	177.4	169.8	0	0	0	0	111.8	A452 L453 C454 L459	A452-V456 WeakPolarHBondContact O-CG2 3.32Å; A452-V456 PolarHBondContact O-N 3.19Å; A452-V456 VanDerWaalsContact O-N 3.1Å; L453-V456 PolarHBondContact O-N 3.46Å; C454-V456 VanDerWaalsContact C-N 3.29Å; C454-V456 PolarHBondContact O-N 3.33Å; V456-L459 WeakPolarHBondContact O-CB 3.39Å; V456-L459 PolarHBondContact O-N 3.37Å
457	I	97.7	Very high	97.7	Very high	48 Å²	48	31.6 Å²	31.6	25%	0.246	19%	0.187	C	C	.	.	H	α-helix	trans	-69.3	-41.9	175.2	-61.5	166.3	0	0	0	110.1	F142 T146 L453 C454 F455 L459 S460 F473	F142-I457 HydrophobicContact CE1-CD1 3.93Å; F142-I457 HydrophobicContact CZ-CD1 3.67Å; T146-I457 HydrophobicContact CG2-CB 3.81Å; T146-I457 HydrophobicContact CG2-CG2 3.54Å; L453-I457 HydrophobicContact CG-CD1 4.42Å; L453-I457 WeakPolarHBondContact O-CG1 3.09Å; L453-I457 PolarHBondContact O-N 3.45Å; C454-I457 CarbonylContact O-C 3.59Å; C454-I457 WeakPolarHBondContact O-CA 3.37Å; C454-I457 WeakPolarHBondContact O-CB 3.41Å; C454-I457 PolarHBondContact O-N 3.02Å; F455-I457 VanDerWaalsContact C-N 3.33Å; F455-I457 PolarHBondContact O-N 3.39Å; I457-L459 PolarHBondContact O-N 3.37Å; I457-S460 WeakPolarHBondContact O-CB 3.24Å; I457-S460 PolarHBondContact O-N 3.48Å; I457-S460 PolarHBondContact O-OG 3.18Å; I457-F473 HydrophobicContact CG2-CZ 4.17Å
458	D	98.3	Very high	97.6	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-23	178.2	-62.9	-26.5	0	0	0	112.6	T146 I149 M150 L239 W243 C454 F455 S460 M461 V462	T146-D458 VanDerWaalsContact C-OD1 3.3Å; T146-D458 WeakPolarHBondContact CG2-OD1 3.49Å; I149-D458 WeakPolarHBondContact CG2-OD2 3.47Å; M150-D458 HydrophobicContact SD-CB 4.31Å; L239-D458 HydrophobicContact CD1-CB 3.99Å; L239-D458 HydrophobicContact CD2-CB 3.57Å; L239-D458 HydrophobicContact CG-CB 4.37Å; W243-D458 PolarHBondContact NE1-OD2 3.14Å; C454-D458 PolarHBondContact O-N 3.32Å; F455-D458 PolarHBondContact O-N 2.88Å; D458-S460 PolarHBondContact O-N 2.91Å; D458-S460 VanDerWaalsContact O-N 3.14Å; D458-M461 WeakPolarHBondContact O-CA 3.33Å; D458-M461 WeakPolarHBondContact O-CB 3.4Å; D458-M461 PolarHBondContact O-N 3.45Å; D458-V462 PolarHBondContact O-N 2.82Å
459	L	98.2	Very high	97.5	Very high	50 Å²	50	31.8 Å²	31.8	26%	0.262	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.9	171.8	-67.4	-176.4	0	0	0	112.4	L231 T236 F455 V456 I457 M461 V462 T463	L231-L459 HydrophobicContact CD2-CB 4.39Å; L231-L459 VanDerWaalsContact CD2-O 3.23Å; L231-L459 WeakPolarHBondContact CD2-O 3.44Å; T236-L459 HydrophobicContact CG2-CD2 3.94Å; F455-L459 HydrophobicContact CE1-CD1 4.4Å; F455-L459 HydrophobicContact CE1-CD2 4.06Å; F455-L459 HydrophobicContact CE1-CG 4.35Å; F455-L459 HydrophobicContact CZ-CD2 3.94Å; F455-L459 WeakPolarHBondContact O-CG 3.18Å; F455-L459 PolarHBondContact O-N 3.26Å; F455-L459 VanDerWaalsContact O-N 3.11Å; V456-L459 WeakPolarHBondContact O-CB 3.39Å; V456-L459 PolarHBondContact O-N 3.37Å; I457-L459 PolarHBondContact O-N 3.37Å; L459-M461 VanDerWaalsContact C-N 3.25Å; L459-M461 PolarHBondContact O-N 2.95Å; L459-V462 HydrophobicContact CD2-CG2 4.19Å; L459-V462 VanDerWaalsContact O-CG2 3.25Å; L459-V462 WeakPolarHBondContact O-CG2 3.18Å; L459-T463 WeakPolarHBondContact O-CG2 3.25Å
460	S	96.9	Very high	97.4	Very high	45 Å²	45	26.6 Å²	26.6	32%	0.315	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.6	173.7	69.5	0	0	0	0	114.2	I457 D458 T463 G466	I457-S460 WeakPolarHBondContact O-CB 3.24Å; I457-S460 PolarHBondContact O-N 3.48Å; I457-S460 PolarHBondContact O-OG 3.18Å; D458-S460 PolarHBondContact O-N 2.91Å; D458-S460 VanDerWaalsContact O-N 3.14Å; S460-T463 PolarHBondContact O-OG1 2.95Å; S460-G466 VanDerWaalsContact O-CA 3.28Å; S460-G466 WeakPolarHBondContact O-CA 3.49Å
461	M	97.5	Very high	97.2	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.02	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-11.3	-178.3	-58.4	-177.6	-164.8	0	0	113.1	T146 M150 D458 L459 V469 F470 F473	T146-M461 HydrophobicContact CG2-CE 4.24Å; M150-M461 HydrophobicContact CE-CB 3.95Å; M150-M461 WeakPolarHBondContact CE-O 3.26Å; M150-M461 HydrophobicContact CG-CB 3.8Å; M150-M461 HydrophobicContact CG-CG 4.46Å; M150-M461 HydrophobicContact CG-SD 3.81Å; M150-M461 HydrophobicContact SD-CB 3.8Å; D458-M461 WeakPolarHBondContact O-CA 3.33Å; D458-M461 WeakPolarHBondContact O-CB 3.4Å; D458-M461 PolarHBondContact O-N 3.45Å; L459-M461 VanDerWaalsContact C-N 3.25Å; L459-M461 PolarHBondContact O-N 2.95Å; M461-V469 HydrophobicContact CE-CG1 4.42Å; M461-V469 HydrophobicContact CG-CB 4.31Å; M461-V469 HydrophobicContact CG-CG1 4.04Å; M461-F470 HydrophobicContact CG-CB 4.41Å; M461-F470 HydrophobicContact SD-CB 4.26Å; M461-F470 HydrophobicContact SD-CD2 4.34Å; M461-F473 HydrophobicContact CE-CB 4.25Å; M461-F473 HydrophobicContact CE-CD1 4.12Å; M461-F473 HydrophobicContact CE-CD2 3.34Å; M461-F473 HydrophobicContact CE-CE1 4.29Å; M461-F473 HydrophobicContact CE-CE2 3.53Å; M461-F473 HydrophobicContact CE-CG 3.65Å; M461-F473 HydrophobicContact CE-CZ 4.01Å
462	V	97.9	Very high	97.1	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.03	16%	0.157	C	C	.	.	S	Bend	trans	-97.2	3	173.6	-66.4	0	0	0	0	113.3	M150 L231 N232 V235 L239 D458 L459	M150-V462 HydrophobicContact CE-CG1 3.53Å; M150-V462 HydrophobicContact SD-CG1 3.86Å; L231-V462 HydrophobicContact CD2-CG2 3.7Å; N232-V462 WeakPolarHBondContact CB-O 3.11Å; N232-V462 PolarHBondContact N-O 3.38Å; V235-V462 HydrophobicContact CG1-CG1 3.94Å; L239-V462 HydrophobicContact CD2-CG1 3.83Å; D458-V462 PolarHBondContact O-N 2.82Å; L459-V462 HydrophobicContact CD2-CG2 4.19Å; L459-V462 VanDerWaalsContact O-CG2 3.25Å; L459-V462 WeakPolarHBondContact O-CG2 3.18Å
463	T	98	Very high	96.9	Very high	21 Å²	21	25.4 Å²	25.4	13%	0.129	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-78.5	167.6	171.6	63.2	0	0	0	0	111.5	P228 A230 L231 L459 S460 G465 G466	P228-T463 WeakPolarHBondContact O-CB 3.49Å; P228-T463 PolarHBondContact O-OG1 3.23Å; A230-T463 CarbonylContact O-C 3.54Å; A230-T463 WeakPolarHBondContact O-CA 3.41Å; L231-T463 HydrophobicContact CD2-CG2 3.54Å; L231-T463 HydrophobicContact CG-CG2 4.13Å; L459-T463 WeakPolarHBondContact O-CG2 3.25Å; S460-T463 PolarHBondContact O-OG1 2.95Å; T463-G465 VanDerWaalsContact C-N 3.25Å; T463-G465 PolarHBondContact O-N 3.37Å; T463-G466 WeakPolarHBondContact O-CA 3.14Å; T463-G466 PolarHBondContact O-N 2.97Å; T463-G466 PolarHBondContact OG1-N 3.45Å
464	D	97.4	Very high	96.5	Very high	31 Å²	31	23.4 Å²	23.4	17%	0.166	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-38.7	174.9	-60.4	-17.8	0	0	0	112.8	R220 L221 S222 P228 G229 A230 G466	R220-D464 HydrophobicContact CB-CB 4.5Å; R220-D464 WeakPolarHBondContact CB-OD1 3.32Å; R220-D464 VanDerWaalsContact O-CA 3.23Å; R220-D464 WeakPolarHBondContact O-CA 3.27Å; R220-D464 WeakPolarHBondContact O-CB 3.25Å; L221-D464 WeakPolarHBondContact CA-O 3.5Å; S222-D464 PolarHBondContact N-O 2.93Å; P228-D464 PolarHBondContact O-N 3.19Å; G229-D464 WeakPolarHBondContact CA-OD2 3.4Å; A230-D464 PolarHBondContact N-OD2 3.33Å; A230-D464 PolarHBondContact O-N 3.13Å; D464-G466 VanDerWaalsContact C-N 3.33Å
465	G	96.2	Very high	96.2	Very high	2 Å²	2	27.7 Å²	27.7	2%	0.021	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	4.7	172.3	0	0	0	0	0	114.8	S222 P228 T463 M467 Y468	S222-G465 WeakPolarHBondContact OG-CA 3.37Å; S222-G465 PolarHBondContact OG-N 2.97Å; P228-G465 PolarHBondContact O-N 2.97Å; T463-G465 VanDerWaalsContact C-N 3.25Å; T463-G465 PolarHBondContact O-N 3.37Å; G465-M467 VanDerWaalsContact C-N 3.3Å; G465-M467 PolarHBondContact O-N 3.32Å; G465-Y468 WeakPolarHBondContact O-CD2 3.33Å; G465-Y468 PolarHBondContact O-N 3.23Å
466	G	96.8	Very high	95.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-69.1	-25.6	-168.9	0	0	0	0	0	114.2	S460 T463 D464 Y468 V469 F470	S460-G466 VanDerWaalsContact O-CA 3.28Å; S460-G466 WeakPolarHBondContact O-CA 3.49Å; T463-G466 WeakPolarHBondContact O-CA 3.14Å; T463-G466 PolarHBondContact O-N 2.97Å; T463-G466 PolarHBondContact OG1-N 3.45Å; D464-G466 VanDerWaalsContact C-N 3.33Å; G466-Y468 PolarHBondContact O-N 3.34Å; G466-V469 PolarHBondContact O-N 3.04Å; G466-F470 PolarHBondContact O-N 2.94Å
467	M	95	Very high	95.6	Very high	6 Å²	6	21.6 Å²	21.6	3%	0.03	11%	0.111	C	C	.	.	H	α-helix	trans	-61.1	-34.8	174.4	-170.6	63.7	-157	0	0	112	W154 L219 L221 P382 G465 F470 Q471 Y547	W154-M467 HydrophobicContact CH2-CE 4.45Å; W154-M467 HydrophobicContact CH2-SD 3.69Å; W154-M467 HydrophobicContact CZ2-SD 4.08Å; L219-M467 HydrophobicContact CD1-CB 4.15Å; L219-M467 HydrophobicContact CD1-CG 3.89Å; L219-M467 HydrophobicContact CD1-SD 3.98Å; L219-M467 HydrophobicContact CD2-CB 4.46Å; L219-M467 HydrophobicContact CD2-SD 4.05Å; L221-M467 HydrophobicContact CD1-CB 3.79Å; L221-M467 HydrophobicContact CD1-CG 4.36Å; P382-M467 HydrophobicContact CG-CE 4.3Å; G465-M467 VanDerWaalsContact C-N 3.3Å; G465-M467 PolarHBondContact O-N 3.32Å; M467-F470 HydrophobicContact CE-CD1 3.85Å; M467-F470 HydrophobicContact CE-CE1 4.19Å; M467-F470 HydrophobicContact SD-CD1 4.26Å; M467-Q471 HydrophobicContact CE-CG 3.94Å; M467-Q471 VanDerWaalsContact O-CG 3.23Å; M467-Q471 WeakPolarHBondContact O-CG 3.24Å; M467-Q471 PolarHBondContact O-N 3.14Å; M467-Q471 VanDerWaalsContact O-N 3.09Å; M467-Y547 HydrophobicContact CE-CE2 3.89Å; M467-Y547 HydrophobicContact CG-CE2 3.66Å
468	Y	95.8	Very high	95	Very high	10 Å²	10	19.4 Å²	19.4	4%	0.039	10%	0.1	C	C	.	.	H	α-helix	trans	-70.1	-38.7	176.9	-56.9	-71.9	0	0	0	111.7	L221 S222 G224 L225 G465 G466 Q471 L472 Y547 Y551 Y553	L221-Y468 HydrophobicContact CD1-CE2 3.9Å; L221-Y468 HydrophobicContact CG-CE2 4.5Å; S222-Y468 PolarHBondContact O-OH 3.4Å; S222-Y468 VanDerWaalsContact O-OH 3.08Å; G224-Y468 VanDerWaalsContact C-CD2 3.44Å; L225-Y468 HydrophobicContact CB-CG 4.45Å; G465-Y468 WeakPolarHBondContact O-CD2 3.33Å; G465-Y468 PolarHBondContact O-N 3.23Å; G466-Y468 PolarHBondContact O-N 3.34Å; Y468-Q471 PolarHBondContact O-N 3.08Å; Y468-L472 PolarHBondContact O-N 2.98Å; Y468-Y547 HydrophobicContact CD1-CD1 4.41Å; Y468-Y547 HydrophobicContact CD1-CG 4.39Å; Y468-Y547 AromaticContact CE1-CD1 3.71Å; Y468-Y547 HydrophobicContact CE1-CD1 3.71Å; Y468-Y547 HydrophobicContact CE1-CE1 4.36Å; Y468-Y547 HydrophobicContact CE1-CG 4.1Å; Y468-Y551 AromaticContact CD1-CD1 3.65Å; Y468-Y551 HydrophobicContact CD1-CD1 3.65Å; Y468-Y551 AromaticContact CD1-CE1 3.58Å; Y468-Y551 HydrophobicContact CD1-CE1 3.58Å; Y468-Y551 HydrophobicContact CD1-CG 4.31Å; Y468-Y551 AromaticContact CE1-CD1 3.43Å; Y468-Y551 HydrophobicContact CE1-CD1 3.43Å; Y468-Y551 VanDerWaalsContact CE1-CD1 3.43Å; Y468-Y551 HydrophobicContact CE1-CD2 4.06Å; Y468-Y551 AromaticContact CE1-CE1 3.71Å; Y468-Y551 HydrophobicContact CE1-CE1 3.71Å; Y468-Y551 HydrophobicContact CE1-CE2 4.3Å; Y468-Y551 AromaticContact CE1-CG 3.62Å; Y468-Y551 HydrophobicContact CE1-CG 3.62Å; Y468-Y551 HydrophobicContact CG-CE1 4.38Å; Y468-Y553 VanDerWaalsContact CA-OH 3.26Å; Y468-Y553 WeakPolarHBondContact CA-OH 3.27Å; Y468-Y553 PolarHBondContact O-OH 3.24Å; Y468-Y553 VanDerWaalsContact O-OH 3.14Å
469	V	96.6	Very high	94	Very high	32 Å²	32	20.1 Å²	20.1	19%	0.194	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-47.1	174.7	-176.5	0	0	0	0	110.4	L225 M461 G466 Q471 L472 F473	L225-V469 HydrophobicContact CD1-CG2 3.69Å; M461-V469 HydrophobicContact CE-CG1 4.42Å; M461-V469 HydrophobicContact CG-CB 4.31Å; M461-V469 HydrophobicContact CG-CG1 4.04Å; G466-V469 PolarHBondContact O-N 3.04Å; V469-Q471 VanDerWaalsContact C-N 3.28Å; V469-Q471 PolarHBondContact O-N 3.3Å; V469-L472 WeakPolarHBondContact O-CB 3.39Å; V469-L472 PolarHBondContact O-N 2.81Å; V469-L472 VanDerWaalsContact O-N 3.15Å; V469-F473 HydrophobicContact CG1-CD2 4.24Å; V469-F473 HydrophobicContact CG1-CE2 4.12Å; V469-F473 WeakPolarHBondContact O-CD2 3.4Å; V469-F473 PolarHBondContact O-N 3.38Å
470	F	95.8	Very high	93.1	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-53.1	-46.2	175.7	170.5	-87.5	0	0	0	111.8	Y147 M150 V151 W154 P382 M461 G466 M467 L472 F473 D474	Y147-F470 HydrophobicContact CD2-CD2 4.16Å; Y147-F470 AromaticContact CD2-CE2 3.67Å; Y147-F470 HydrophobicContact CD2-CE2 3.67Å; Y147-F470 HydrophobicContact CD2-CZ 4.04Å; Y147-F470 HydrophobicContact CE2-CE2 4.47Å; Y147-F470 HydrophobicContact CE2-CZ 4.44Å; Y147-F470 VanDerWaalsContact O-CE2 3.3Å; Y147-F470 WeakPolarHBondContact O-CE2 3.18Å; M150-F470 HydrophobicContact CB-CD2 3.77Å; M150-F470 HydrophobicContact CB-CE2 3.91Å; M150-F470 HydrophobicContact CG-CD2 4.17Å; V151-F470 HydrophobicContact CG2-CE2 3.98Å; V151-F470 HydrophobicContact CG2-CZ 3.86Å; W154-F470 HydrophobicContact CH2-CB 4.48Å; W154-F470 HydrophobicContact CH2-CD1 4.01Å; W154-F470 AromaticContact CH2-CD2 3.77Å; W154-F470 HydrophobicContact CH2-CD2 3.77Å; W154-F470 HydrophobicContact CH2-CE1 4.2Å; W154-F470 AromaticContact CH2-CE2 3.92Å; W154-F470 HydrophobicContact CH2-CE2 3.92Å; W154-F470 AromaticContact CH2-CG 3.82Å; W154-F470 HydrophobicContact CH2-CG 3.82Å; W154-F470 HydrophobicContact CH2-CZ 4.15Å; W154-F470 HydrophobicContact CZ3-CD2 4.29Å; W154-F470 HydrophobicContact CZ3-CE1 4.26Å; W154-F470 AromaticContact CZ3-CE2 3.95Å; W154-F470 HydrophobicContact CZ3-CE2 3.95Å; W154-F470 AromaticContact CZ3-CZ 3.96Å; W154-F470 HydrophobicContact CZ3-CZ 3.96Å; P382-F470 HydrophobicContact CG-CE1 4.43Å; M461-F470 HydrophobicContact CG-CB 4.41Å; M461-F470 HydrophobicContact SD-CB 4.26Å; M461-F470 HydrophobicContact SD-CD2 4.34Å; G466-F470 PolarHBondContact O-N 2.94Å; M467-F470 HydrophobicContact CE-CD1 3.85Å; M467-F470 HydrophobicContact CE-CE1 4.19Å; M467-F470 HydrophobicContact SD-CD1 4.26Å; F470-L472 PolarHBondContact O-N 2.96Å; F470-F473 PolarHBondContact O-N 2.75Å; F470-D474 HydrophobicContact CE1-CB 4.26Å; F470-D474 PolarHBondContact O-N 3.45Å
471	Q	93.7	Very high	92.6	Very high	28 Å²	28	18.1 Å²	18.1	13%	0.131	10%	0.097	C	C	.	.	H	α-helix	trans	-66.1	-33.6	-179.6	-73	-71.6	-4.4	0	0	113.1	M467 Y468 V469 F473 D474 Y475 L545 Y547 Y553	M467-Q471 HydrophobicContact CE-CG 3.94Å; M467-Q471 VanDerWaalsContact O-CG 3.23Å; M467-Q471 WeakPolarHBondContact O-CG 3.24Å; M467-Q471 PolarHBondContact O-N 3.14Å; M467-Q471 VanDerWaalsContact O-N 3.09Å; Y468-Q471 PolarHBondContact O-N 3.08Å; V469-Q471 VanDerWaalsContact C-N 3.28Å; V469-Q471 PolarHBondContact O-N 3.3Å; Q471-F473 VanDerWaalsContact C-N 3.33Å; Q471-D474 PolarHBondContact O-N 3.23Å; Q471-Y475 WeakPolarHBondContact O-CB 3.31Å; Q471-Y475 PolarHBondContact O-N 3.17Å; Q471-L545 HydrophobicContact CB-CD2 4.16Å; Q471-Y547 HydrophobicContact CG-CD2 4.02Å; Q471-Y547 HydrophobicContact CG-CE2 4.46Å; Q471-Y553 VanDerWaalsContact CB-OH 3.26Å; Q471-Y553 WeakPolarHBondContact CB-OH 3.37Å
472	L	94.7	Very high	92.4	Very high	2 Å²	2	18 Å²	18	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-62.6	-41.8	172.5	-73.6	173.4	0	0	0	111.8	L225 Y468 V469 F470 Y476 L545 Y553 G557 F564	L225-L472 HydrophobicContact CD1-CD1 4.13Å; L225-L472 HydrophobicContact CD2-CD1 3.78Å; Y468-L472 PolarHBondContact O-N 2.98Å; V469-L472 WeakPolarHBondContact O-CB 3.39Å; V469-L472 PolarHBondContact O-N 2.81Å; V469-L472 VanDerWaalsContact O-N 3.15Å; F470-L472 PolarHBondContact O-N 2.96Å; L472-Y476 HydrophobicContact CD2-CD2 4.17Å; L472-Y476 HydrophobicContact CD2-CE2 4Å; L472-Y476 WeakPolarHBondContact O-CB 3.39Å; L472-Y476 WeakPolarHBondContact O-CD2 3.22Å; L472-Y476 PolarHBondContact O-N 3.08Å; L472-L545 HydrophobicContact CD2-CD2 4.04Å; L472-Y553 HydrophobicContact CD1-CD1 4.4Å; L472-Y553 HydrophobicContact CD1-CE1 4.22Å; L472-Y553 HydrophobicContact CD2-CD1 3.86Å; L472-Y553 HydrophobicContact CD2-CE1 3.91Å; L472-Y553 HydrophobicContact CG-CD1 4.13Å; L472-Y553 HydrophobicContact CG-CE1 3.75Å; L472-G557 VanDerWaalsContact CD2-O 3.3Å; L472-G557 WeakPolarHBondContact CD2-O 3.08Å; L472-F564 HydrophobicContact CB-CE2 4.34Å
473	F	94.3	Very high	92.1	Very high	15 Å²	15	17.8 Å²	17.8	7%	0.066	10%	0.095	C	C	.	.	I	π-helix	trans	-65.9	-52.5	174.9	-84.5	-100.1	0	0	0	111.2	Y143 Y147 I457 M461 V469 F470 Q471 Y475 S477 F564	Y143-F473 HydrophobicContact CD1-CD1 4.28Å; Y143-F473 AromaticContact CD1-CE1 3.73Å; Y143-F473 HydrophobicContact CD1-CE1 3.73Å; Y143-F473 HydrophobicContact CE1-CE1 4.32Å; Y143-F473 HydrophobicContact CG-CD1 4.45Å; Y143-F473 HydrophobicContact CG-CE1 4.35Å; Y147-F473 HydrophobicContact CD1-CB 3.83Å; Y147-F473 HydrophobicContact CG-CB 3.78Å; I457-F473 HydrophobicContact CG2-CZ 4.17Å; M461-F473 HydrophobicContact CE-CB 4.25Å; M461-F473 HydrophobicContact CE-CD1 4.12Å; M461-F473 HydrophobicContact CE-CD2 3.34Å; M461-F473 HydrophobicContact CE-CE1 4.29Å; M461-F473 HydrophobicContact CE-CE2 3.53Å; M461-F473 HydrophobicContact CE-CG 3.65Å; M461-F473 HydrophobicContact CE-CZ 4.01Å; V469-F473 HydrophobicContact CG1-CD2 4.24Å; V469-F473 HydrophobicContact CG1-CE2 4.12Å; V469-F473 WeakPolarHBondContact O-CD2 3.4Å; V469-F473 PolarHBondContact O-N 3.38Å; F470-F473 PolarHBondContact O-N 2.75Å; Q471-F473 VanDerWaalsContact C-N 3.33Å; F473-Y475 VanDerWaalsContact C-N 3.34Å; F473-Y475 PolarHBondContact O-N 3.02Å; F473-S477 VanDerWaalsContact O-CB 3.27Å; F473-S477 WeakPolarHBondContact O-CB 3.4Å; F473-S477 PolarHBondContact O-N 3.06Å; F473-S477 PolarHBondContact O-OG 2.87Å; F473-F564 AromaticContact CD2-CE2 3.87Å; F473-F564 HydrophobicContact CD2-CE2 3.87Å; F473-F564 HydrophobicContact CD2-CZ 4.24Å; F473-F564 HydrophobicContact CE1-CZ 4.39Å; F473-F564 AromaticContact CE2-CE2 3.75Å; F473-F564 HydrophobicContact CE2-CE2 3.75Å; F473-F564 AromaticContact CE2-CZ 3.63Å; F473-F564 HydrophobicContact CE2-CZ 3.63Å; F473-F564 HydrophobicContact CG-CE2 4.38Å; F473-F564 HydrophobicContact CZ-CE1 4.21Å; F473-F564 HydrophobicContact CZ-CE2 4.15Å; F473-F564 AromaticContact CZ-CZ 3.72Å; F473-F564 HydrophobicContact CZ-CZ 3.72Å
474	D	91.1	Very high	91.8	Very high	52 Å²	52	16.9 Å²	16.9	28%	0.278	9%	0.09	S	C	.	.	I	π-helix	trans	-60.2	-42.5	-176.7	-172.3	46.2	0	0	0	112.3	Y147 F470 Q471	Y147-D474 HydrophobicContact CD2-CB 3.96Å; Y147-D474 HydrophobicContact CE2-CB 3.57Å; Y147-D474 WeakPolarHBondContact CE2-OD1 3.28Å; Y147-D474 VanDerWaalsContact CZ-OD1 3.29Å; Y147-D474 PolarHBondContact OH-OD1 3.03Å; F470-D474 HydrophobicContact CE1-CB 4.26Å; F470-D474 PolarHBondContact O-N 3.45Å; Q471-D474 PolarHBondContact O-N 3.23Å
475	Y	91.2	Very high	91.7	Very high	90 Å²	90	17.6 Å²	17.6	35%	0.353	9%	0.09	S	C	.	.	I	π-helix	trans	-77.9	-35.9	-175.3	-168.8	-88.7	0	0	0	113.9	Q471 F473 S479 Y542 E543 L545	Q471-Y475 WeakPolarHBondContact O-CB 3.31Å; Q471-Y475 PolarHBondContact O-N 3.17Å; F473-Y475 VanDerWaalsContact C-N 3.34Å; F473-Y475 PolarHBondContact O-N 3.02Å; Y475-S479 WeakPolarHBondContact O-CB 3.48Å; Y475-Y542 HydrophobicContact CE1-CE2 4.4Å; Y475-E543 PolarHBondContact OH-O 3.2Å; Y475-L545 HydrophobicContact CD1-CB 4.24Å; Y475-L545 HydrophobicContact CD2-CD1 3.71Å; Y475-L545 HydrophobicContact CE1-CB 4.46Å; Y475-L545 HydrophobicContact CE2-CD1 4.33Å; Y475-L545 HydrophobicContact CG-CB 4.37Å; Y475-L545 HydrophobicContact CG-CD1 3.8Å; Y475-L545 HydrophobicContact CG-CG 4.44Å
476	Y	92.8	Very high	91.6	Very high	8 Å²	8	17.6 Å²	17.6	3%	0.031	9%	0.089	C	C	.	.	I	π-helix	trans	-109	-34.1	-171.9	-67.9	-84.9	0	0	0	115.1	L472 S479 Y542 L545 G561 A565	L472-Y476 HydrophobicContact CD2-CD2 4.17Å; L472-Y476 HydrophobicContact CD2-CE2 4Å; L472-Y476 WeakPolarHBondContact O-CB 3.39Å; L472-Y476 WeakPolarHBondContact O-CD2 3.22Å; L472-Y476 PolarHBondContact O-N 3.08Å; Y476-S479 PolarHBondContact O-OG 3.05Å; Y476-Y542 HydrophobicContact CE1-CE2 4.18Å; Y476-Y542 PolarHBondContact OH-OH 2.88Å; Y476-L545 HydrophobicContact CE2-CB 4.06Å; Y476-L545 HydrophobicContact CE2-CD2 4.07Å; Y476-G561 WeakPolarHBondContact CB-O 3.1Å; Y476-G561 VanDerWaalsContact CD2-CA 3.44Å; Y476-G561 VanDerWaalsContact CG-C 3.47Å; Y476-G561 VanDerWaalsContact CG-CA 3.41Å; Y476-A565 WeakPolarHBondContact O-CB 3.46Å
477	S	91.6	Very high	91.6	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	I	π-helix	trans	-82.3	-68	-164.3	75.2	0	0	0	0	113.4	Y143 F473 S479 T482	Y143-S477 WeakPolarHBondContact CB-OG 3.33Å; F473-S477 VanDerWaalsContact O-CB 3.27Å; F473-S477 WeakPolarHBondContact O-CB 3.4Å; F473-S477 PolarHBondContact O-N 3.06Å; F473-S477 PolarHBondContact O-OG 2.87Å; S477-S479 VanDerWaalsContact C-N 3.3Å; S477-S479 PolarHBondContact O-N 3.32Å; S477-T482 WeakPolarHBondContact O-CG2 3.44Å; S477-T482 PolarHBondContact O-OG1 3Å
478	A	84.4	Confident	91.7	Very high	2 Å²	2	19 Å²	19	2%	0.017	10%	0.096	C	C	.	.	S	Bend	trans	-99.5	46.4	172.1	0	0	0	0	0	111	I140 C144 Y147	I140-A478 HydrophobicContact CG2-CB 3.74Å; C144-A478 HydrophobicContact CB-CB 3.79Å; Y147-A478 HydrophobicContact CE1-CB 4.1Å
479	S	78.8	Confident	91.8	Very high	15 Å²	15	21.2 Å²	21.2	11%	0.105	10%	0.104	C	C	.	.			trans	-81.9	165.5	-177	72.6	0	0	0	0	112.2	Y475 Y476 S477 T481 T482 L483	Y475-S479 WeakPolarHBondContact O-CB 3.48Å; Y476-S479 PolarHBondContact O-OG 3.05Å; S477-S479 VanDerWaalsContact C-N 3.3Å; S477-S479 PolarHBondContact O-N 3.32Å; S479-T481 PolarHBondContact O-N 3.42Å; S479-T481 VanDerWaalsContact O-N 3.14Å; S479-T481 PolarHBondContact OG-N 2.86Å; S479-T482 PolarHBondContact N-OG1 3.37Å; S479-T482 PolarHBondContact O-N 2.83Å; S479-T482 PolarHBondContact O-OG1 3.02Å; S479-T482 VanDerWaalsContact O-OG1 3.13Å; S479-L483 WeakPolarHBondContact O-CG 3.39Å; S479-L483 PolarHBondContact O-N 2.83Å
480	G	78.4	Confident	91.8	Very high	18 Å²	18	19.9 Å²	19.9	19%	0.186	10%	0.095	C	C	.	.	H	α-helix	trans	-53.7	-35.5	173.7	0	0	0	0	0	112.6	L484	G480-L484 WeakPolarHBondContact O-CB 3.41Å; G480-L484 VanDerWaalsContact O-CD1 3.29Å; G480-L484 WeakPolarHBondContact O-CD1 3.39Å; G480-L484 WeakPolarHBondContact O-CG 3.37Å; G480-L484 PolarHBondContact O-N 3.47Å
481	T	86.8	Confident	91.9	Very high	36 Å²	36	19.7 Å²	19.7	22%	0.221	10%	0.095	C	C	.	.	H	α-helix	trans	-68.1	-43.3	-178.6	-58.4	0	0	0	0	112.8	S479 L484 W485 F535 N538	S479-T481 PolarHBondContact O-N 3.42Å; S479-T481 VanDerWaalsContact O-N 3.14Å; S479-T481 PolarHBondContact OG-N 2.86Å; T481-L484 PolarHBondContact O-N 3.41Å; T481-W485 PolarHBondContact O-N 2.98Å; T481-F535 HydrophobicContact CG2-CD2 3.59Å; T481-F535 HydrophobicContact CG2-CE2 3.49Å; T481-F535 VanDerWaalsContact CG2-CE2 3.49Å; T481-N538 PolarHBondContact OG1-ND2 2.94Å
482	T	92.2	Very high	92.1	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-70.2	-36.2	178.4	58.7	0	0	0	0	111.6	S477 S479 W485 Q486 A565 M569	S477-T482 WeakPolarHBondContact O-CG2 3.44Å; S477-T482 PolarHBondContact O-OG1 3Å; S479-T482 PolarHBondContact N-OG1 3.37Å; S479-T482 PolarHBondContact O-N 2.83Å; S479-T482 PolarHBondContact O-OG1 3.02Å; S479-T482 VanDerWaalsContact O-OG1 3.13Å; T482-W485 PolarHBondContact O-N 3.16Å; T482-Q486 PolarHBondContact O-N 3.39Å; T482-A565 HydrophobicContact CG2-CB 4.1Å; T482-M569 HydrophobicContact CG2-CG 4.1Å; T482-M569 HydrophobicContact CG2-SD 4.11Å
483	L	92.2	Very high	92.3	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-67.2	-41.1	174.4	-61	-178.3	0	0	0	112.5	I140 F315 I319 L321 S479 W485 Q486 A487	I140-L483 HydrophobicContact CG2-CD2 3.86Å; F315-L483 HydrophobicContact CD2-CD1 4.08Å; I319-L483 WeakPolarHBondContact O-CD2 3.31Å; L321-L483 HydrophobicContact CD2-CD2 3.77Å; L321-L483 HydrophobicContact CG-CD2 4.17Å; S479-L483 WeakPolarHBondContact O-CG 3.39Å; S479-L483 PolarHBondContact O-N 2.83Å; L483-W485 VanDerWaalsContact C-N 3.35Å; L483-Q486 WeakPolarHBondContact O-CB 3.12Å; L483-Q486 PolarHBondContact O-N 2.94Å; L483-A487 VanDerWaalsContact O-CB 3.28Å; L483-A487 WeakPolarHBondContact O-CB 3.37Å; L483-A487 PolarHBondContact O-N 3.36Å
484	L	92.6	Very high	92.5	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-63.8	-40.4	175.5	-72	163.3	0	0	0	111.8	T311 F314 G480 T481 Q486 F488 C531 I534	T311-L484 HydrophobicContact CG2-CD1 4.3Å; F314-L484 HydrophobicContact CD1-CD2 3.99Å; F314-L484 HydrophobicContact CD2-CD2 4.48Å; F314-L484 HydrophobicContact CE1-CD2 4.05Å; F314-L484 HydrophobicContact CG-CD2 4.21Å; F314-L484 HydrophobicContact CZ-CD2 4.32Å; G480-L484 WeakPolarHBondContact O-CB 3.41Å; G480-L484 VanDerWaalsContact O-CD1 3.29Å; G480-L484 WeakPolarHBondContact O-CD1 3.39Å; G480-L484 WeakPolarHBondContact O-CG 3.37Å; G480-L484 PolarHBondContact O-N 3.47Å; T481-L484 PolarHBondContact O-N 3.41Å; L484-Q486 VanDerWaalsContact C-N 3.32Å; L484-Q486 PolarHBondContact O-N 2.91Å; L484-F488 WeakPolarHBondContact O-CB 3.13Å; L484-F488 PolarHBondContact O-N 2.51Å; L484-C531 HydrophobicContact CD2-CB 4.36Å; L484-I534 HydrophobicContact CD1-CB 3.88Å; L484-I534 HydrophobicContact CD1-CG2 3.37Å; L484-I534 HydrophobicContact CD2-CB 4.43Å; L484-I534 HydrophobicContact CD2-CD1 4.46Å
485	W	94	Very high	92.8	Very high	47 Å²	47	16.8 Å²	16.8	18%	0.178	8%	0.083	C	C	.	.	H	α-helix	trans	-59.4	-45	173.8	176.9	-99.9	0	0	0	111.6	T481 T482 L483 W489 F535 M569	T481-W485 PolarHBondContact O-N 2.98Å; T482-W485 PolarHBondContact O-N 3.16Å; L483-W485 VanDerWaalsContact C-N 3.35Å; W485-W489 AromaticContact CD2-CD1 3.94Å; W485-W489 AromaticContact CD2-NE1 3.87Å; W485-W489 AromaticContact CE2-CD1 3.55Å; W485-W489 AromaticContact CE2-NE1 3.27Å; W485-W489 VanDerWaalsContact CE2-NE1 3.27Å; W485-W489 HydrophobicContact CH2-CZ2 4.5Å; W485-W489 AromaticContact CH2-NE1 3.44Å; W485-W489 AromaticContact CZ2-CD1 3.84Å; W485-W489 AromaticContact CZ2-NE1 3.06Å; W485-W489 AromaticContact CZ3-NE1 3.98Å; W485-W489 AromaticContact NE1-CD1 3.69Å; W485-W489 AromaticContact NE1-NE1 3.82Å; W485-W489 PolarHBondContact O-N 3.15Å; W485-F535 HydrophobicContact CB-CD2 4.37Å; W485-F535 HydrophobicContact CB-CE2 4.21Å; W485-F535 HydrophobicContact CE3-CE1 4.25Å; W485-F535 HydrophobicContact CE3-CE2 4.03Å; W485-F535 AromaticContact CE3-CZ 3.88Å; W485-F535 HydrophobicContact CE3-CZ 3.88Å; W485-F535 HydrophobicContact CZ3-CE1 4.41Å; W485-F535 HydrophobicContact CZ3-CZ 4.31Å; W485-M569 HydrophobicContact CB-CE 4.41Å; W485-M569 HydrophobicContact CB-CG 4.33Å; W485-M569 HydrophobicContact CD2-CE 4.06Å; W485-M569 HydrophobicContact CE3-CE 4.26Å; W485-M569 HydrophobicContact CG-CB 4.4Å; W485-M569 HydrophobicContact CG-CE 4.14Å; W485-M569 HydrophobicContact CG-CG 4Å; W485-M569 PolarHBondContact NE1-O 3.4Å
486	Q	95.5	Very high	93.1	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-63.5	-54.8	178	-173.1	70.3	-8.6	0	0	111.4	L133 S137 T482 L483 L484 F488 W489 E490	L133-Q486 HydrophobicContact CD2-CG 4.48Å; L133-Q486 VanDerWaalsContact CD2-OE1 3.26Å; L133-Q486 PolarHBondContact O-NE2 2.98Å; S137-Q486 PolarHBondContact OG-NE2 3.44Å; T482-Q486 PolarHBondContact O-N 3.39Å; L483-Q486 WeakPolarHBondContact O-CB 3.12Å; L483-Q486 PolarHBondContact O-N 2.94Å; L484-Q486 VanDerWaalsContact C-N 3.32Å; L484-Q486 PolarHBondContact O-N 2.91Å; Q486-F488 VanDerWaalsContact C-N 3.25Å; Q486-F488 PolarHBondContact O-N 2.77Å; Q486-W489 PolarHBondContact O-N 2.83Å; Q486-E490 HydrophobicContact CG-CG 4.38Å; Q486-E490 WeakPolarHBondContact O-CG 3.14Å; Q486-E490 PolarHBondContact O-N 3.12Å
487	A	95.6	Very high	93.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-52.4	-40.5	178.1	0	0	0	0	0	113.7	I105 F314 I319 L483 C491	I105-A487 HydrophobicContact CD1-CB 3.48Å; I105-A487 VanDerWaalsContact CD1-CB 3.48Å; F314-A487 HydrophobicContact CD1-CB 3.96Å; F314-A487 HydrophobicContact CE1-CB 3.61Å; I319-A487 HydrophobicContact CG2-CB 4.26Å; L483-A487 VanDerWaalsContact O-CB 3.28Å; L483-A487 WeakPolarHBondContact O-CB 3.37Å; L483-A487 PolarHBondContact O-N 3.36Å; A487-C491 PolarHBondContact O-N 3.34Å; A487-C491 VanDerWaalsContact O-N 3.16Å; A487-C491 PolarHBondContact O-SG 2.71Å
488	F	96.7	Very high	93.6	Very high	37 Å²	37	21.4 Å²	21.4	16%	0.162	10%	0.103	C	C	.	.	H	α-helix	trans	-58.5	-52.8	174.5	168.7	-98.5	0	0	0	111.4	L484 Q486 C491 V492 P528 C531 M532	L484-F488 WeakPolarHBondContact O-CB 3.13Å; L484-F488 PolarHBondContact O-N 2.51Å; Q486-F488 VanDerWaalsContact C-N 3.25Å; Q486-F488 PolarHBondContact O-N 2.77Å; F488-C491 PolarHBondContact O-N 2.9Å; F488-V492 HydrophobicContact CD1-CG2 4.43Å; F488-V492 HydrophobicContact CD2-CG2 4.32Å; F488-V492 HydrophobicContact CE1-CG2 3.98Å; F488-V492 HydrophobicContact CE2-CG2 3.87Å; F488-V492 HydrophobicContact CZ-CG2 3.68Å; F488-V492 WeakPolarHBondContact O-CG2 3.31Å; F488-V492 PolarHBondContact O-N 3.36Å; F488-P528 HydrophobicContact CD2-CB 3.68Å; F488-P528 HydrophobicContact CE2-CB 3.95Å; F488-C531 HydrophobicContact CB-CB 3.92Å; F488-M532 HydrophobicContact CD1-CE 3.66Å; F488-M532 HydrophobicContact CD2-CB 4.08Å; F488-M532 HydrophobicContact CD2-CE 3.75Å; F488-M532 HydrophobicContact CE1-CE 3.58Å; F488-M532 HydrophobicContact CE2-CB 4.23Å; F488-M532 HydrophobicContact CE2-CE 3.67Å; F488-M532 HydrophobicContact CG-CE 3.75Å; F488-M532 HydrophobicContact CZ-CE 3.58Å
489	W	97.8	Very high	94.3	Very high	56 Å²	56	22.3 Å²	22.3	21%	0.212	11%	0.113	C	C	.	.	H	α-helix	trans	-68.7	-34.8	-177.2	-80.6	112.7	0	0	0	112.7	F130 L133 W485 Q486 C491 V492 V493 V572	F130-W489 HydrophobicContact CD1-CE3 4.44Å; F130-W489 AromaticContact CE1-CE3 3.97Å; F130-W489 HydrophobicContact CE1-CE3 3.97Å; F130-W489 AromaticContact CE1-CZ3 3.81Å; F130-W489 HydrophobicContact CE1-CZ3 3.81Å; L133-W489 HydrophobicContact CD1-CB 4.35Å; L133-W489 HydrophobicContact CD2-CB 3.5Å; L133-W489 HydrophobicContact CG-CB 4.29Å; W485-W489 AromaticContact CD2-CD1 3.94Å; W485-W489 AromaticContact CD2-NE1 3.87Å; W485-W489 AromaticContact CE2-CD1 3.55Å; W485-W489 AromaticContact CE2-NE1 3.27Å; W485-W489 VanDerWaalsContact CE2-NE1 3.27Å; W485-W489 HydrophobicContact CH2-CZ2 4.5Å; W485-W489 AromaticContact CH2-NE1 3.44Å; W485-W489 AromaticContact CZ2-CD1 3.84Å; W485-W489 AromaticContact CZ2-NE1 3.06Å; W485-W489 AromaticContact CZ3-NE1 3.98Å; W485-W489 AromaticContact NE1-CD1 3.69Å; W485-W489 AromaticContact NE1-NE1 3.82Å; W485-W489 PolarHBondContact O-N 3.15Å; Q486-W489 PolarHBondContact O-N 2.83Å; W489-C491 VanDerWaalsContact C-N 3.35Å; W489-C491 PolarHBondContact O-N 2.93Å; W489-V492 HydrophobicContact CE3-CB 4.37Å; W489-V492 HydrophobicContact CE3-CG1 4.24Å; W489-V492 HydrophobicContact CZ3-CG1 4.23Å; W489-V492 PolarHBondContact O-N 3.1Å; W489-V493 WeakPolarHBondContact O-CB 3.4Å; W489-V493 VanDerWaalsContact O-CG2 3.24Å; W489-V493 WeakPolarHBondContact O-CG2 3.43Å; W489-V493 PolarHBondContact O-N 2.78Å; W489-V572 HydrophobicContact CD2-CG1 3.99Å; W489-V572 HydrophobicContact CE3-CG1 4.47Å; W489-V572 HydrophobicContact CG-CG1 4Å
490	E	97.7	Very high	95.2	Very high	3 Å²	3	21.9 Å²	21.9	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-58.8	-47.2	173.3	-66	-174.9	172.8	0	0	111.6	L108 W124 L133 Q486 V493 V494	L108-E490 HydrophobicContact CD2-CB 4.38Å; W124-E490 HydrophobicContact CH2-CB 3.95Å; W124-E490 HydrophobicContact CH2-CG 3.68Å; W124-E490 HydrophobicContact CZ2-CB 4.46Å; W124-E490 HydrophobicContact CZ2-CG 3.69Å; L133-E490 HydrophobicContact CD2-CG 4.11Å; Q486-E490 HydrophobicContact CG-CG 4.38Å; Q486-E490 WeakPolarHBondContact O-CG 3.14Å; Q486-E490 PolarHBondContact O-N 3.12Å; E490-V493 PolarHBondContact O-N 3.19Å; E490-V494 WeakPolarHBondContact O-CB 3.4Å; E490-V494 WeakPolarHBondContact O-CG2 3.32Å; E490-V494 PolarHBondContact O-N 2.75Å
491	C	98.2	Very high	96.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.8	-48.2	175.8	-70.9	0	0	0	0	111.7	A487 F488 W489 V493 A495 W523 T527 P528	A487-C491 PolarHBondContact O-N 3.34Å; A487-C491 VanDerWaalsContact O-N 3.16Å; A487-C491 PolarHBondContact O-SG 2.71Å; F488-C491 PolarHBondContact O-N 2.9Å; W489-C491 VanDerWaalsContact C-N 3.35Å; W489-C491 PolarHBondContact O-N 2.93Å; C491-V493 PolarHBondContact O-N 3.49Å; C491-A495 WeakPolarHBondContact O-CB 3.2Å; C491-A495 PolarHBondContact O-N 3.27Å; C491-W523 WeakPolarHBondContact CB-O 3.4Å; C491-T527 VanDerWaalsContact SG-CG2 3.51Å; C491-P528 HydrophobicContact CB-CB 4.29Å; C491-P528 HydrophobicContact CB-CG 4.32Å
492	V	97.9	Very high	96.5	Very high	29 Å²	29	29 Å²	29	18%	0.176	13%	0.133	C	C	.	.	H	α-helix	trans	-59.5	-47	179.9	169.8	0	0	0	0	111.2	F488 W489 W496 V497	F488-V492 HydrophobicContact CD1-CG2 4.43Å; F488-V492 HydrophobicContact CD2-CG2 4.32Å; F488-V492 HydrophobicContact CE1-CG2 3.98Å; F488-V492 HydrophobicContact CE2-CG2 3.87Å; F488-V492 HydrophobicContact CZ-CG2 3.68Å; F488-V492 WeakPolarHBondContact O-CG2 3.31Å; F488-V492 PolarHBondContact O-N 3.36Å; W489-V492 HydrophobicContact CE3-CB 4.37Å; W489-V492 HydrophobicContact CE3-CG1 4.24Å; W489-V492 HydrophobicContact CZ3-CG1 4.23Å; W489-V492 PolarHBondContact O-N 3.1Å; V492-W496 WeakPolarHBondContact O-CA 3.44Å; V492-W496 WeakPolarHBondContact O-CB 3.44Å; V492-W496 PolarHBondContact O-N 2.98Å; V492-V497 PolarHBondContact O-N 3.28Å
493	V	98.1	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	I	π-helix	trans	-66.7	-48.4	-177.2	173.1	0	0	0	0	111.2	W124 C127 F130 L133 W489 E490 C491 V497 Y498	W124-V493 HydrophobicContact CE3-CG1 4.07Å; W124-V493 HydrophobicContact CZ3-CB 4.13Å; W124-V493 HydrophobicContact CZ3-CG1 3.82Å; C127-V493 HydrophobicContact CB-CG1 3.71Å; F130-V493 HydrophobicContact CB-CG1 4.1Å; F130-V493 HydrophobicContact CB-CG2 3.69Å; F130-V493 HydrophobicContact CD1-CG2 3.32Å; F130-V493 HydrophobicContact CD2-CG1 4.29Å; F130-V493 HydrophobicContact CD2-CG2 3.81Å; F130-V493 HydrophobicContact CE1-CG2 3.78Å; F130-V493 HydrophobicContact CE2-CG2 4.23Å; F130-V493 HydrophobicContact CG-CB 4.46Å; F130-V493 HydrophobicContact CG-CG1 4.25Å; F130-V493 HydrophobicContact CG-CG2 3.33Å; F130-V493 HydrophobicContact CZ-CG2 4.2Å; L133-V493 HydrophobicContact CD1-CB 4.24Å; L133-V493 HydrophobicContact CD1-CG2 3.82Å; W489-V493 WeakPolarHBondContact O-CB 3.4Å; W489-V493 VanDerWaalsContact O-CG2 3.24Å; W489-V493 WeakPolarHBondContact O-CG2 3.43Å; W489-V493 PolarHBondContact O-N 2.78Å; E490-V493 PolarHBondContact O-N 3.19Å; C491-V493 PolarHBondContact O-N 3.49Å; V493-V497 WeakPolarHBondContact O-CB 3.19Å; V493-V497 PolarHBondContact O-N 3.23Å; V493-Y498 PolarHBondContact O-N 3.32Å
494	V	98.2	Very high	97	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.134	C	C	.	.	I	π-helix	trans	-68.2	-45.1	-178.7	173.2	0	0	0	0	111.2	L108 W124 E490 G499 F503	L108-V494 HydrophobicContact CD1-CB 4.04Å; L108-V494 HydrophobicContact CD1-CG1 4.15Å; L108-V494 HydrophobicContact CD1-CG2 4.14Å; L108-V494 HydrophobicContact CD2-CG2 4.15Å; L108-V494 HydrophobicContact CG-CG1 4.49Å; L108-V494 HydrophobicContact CG-CG2 4.31Å; W124-V494 HydrophobicContact CZ3-CG2 4.3Å; E490-V494 WeakPolarHBondContact O-CB 3.4Å; E490-V494 WeakPolarHBondContact O-CG2 3.32Å; E490-V494 PolarHBondContact O-N 2.75Å; V494-G499 CarbonylContact O-C 3Å; V494-G499 PolarHBondContact O-N 3.18Å; V494-F503 HydrophobicContact CG1-CB 4.07Å; V494-F503 HydrophobicContact CG1-CD1 3.36Å; V494-F503 HydrophobicContact CG1-CD2 4.31Å; V494-F503 HydrophobicContact CG1-CE1 3.8Å; V494-F503 HydrophobicContact CG1-CG 3.66Å; V494-F503 HydrophobicContact CG1-CZ 4.45Å
495	A	98.1	Very high	97.2	Very high	8 Å²	8	32.6 Å²	32.6	7%	0.066	15%	0.152	C	C	.	.	I	π-helix	trans	-80.1	-41.9	-172.7	0	0	0	0	0	113.7	C491 G499 A500 W523	C491-A495 WeakPolarHBondContact O-CB 3.2Å; C491-A495 PolarHBondContact O-N 3.27Å; A495-G499 CarbonylContact O-C 3.49Å; A495-G499 WeakPolarHBondContact O-CA 3.47Å; A495-A500 HydrophobicContact CB-CB 4.08Å; A495-A500 PolarHBondContact O-N 2.64Å; A495-W523 HydrophobicContact CB-CB 4.11Å
496	W	97.9	Very high	97.3	Very high	155 Å²	155	31.1 Å²	31.1	59%	0.587	15%	0.148	S	C	*	.	I	π-helix	trans	-106.5	-30.6	-170	-66.8	94	0	0	0	114.4	V492 S524 F525	V492-W496 WeakPolarHBondContact O-CA 3.44Å; V492-W496 WeakPolarHBondContact O-CB 3.44Å; V492-W496 PolarHBondContact O-N 2.98Å; W496-S524 PolarHBondContact NE1-O 3.16Å; W496-F525 AromaticContact CH2-CE1 3.76Å; W496-F525 HydrophobicContact CH2-CE1 3.76Å; W496-F525 AromaticContact CH2-CZ 3.93Å; W496-F525 HydrophobicContact CH2-CZ 3.93Å; W496-F525 HydrophobicContact CZ2-CD1 4.05Å; W496-F525 AromaticContact CZ2-CE1 3.43Å; W496-F525 HydrophobicContact CZ2-CE1 3.43Å; W496-F525 VanDerWaalsContact CZ2-CE1 3.43Å; W496-F525 AromaticContact CZ2-CZ 3.77Å; W496-F525 HydrophobicContact CZ2-CZ 3.77Å
497	V	97.4	Very high	97.3	Very high	34 Å²	34	31.1 Å²	31.1	21%	0.206	15%	0.148	C	C	.	.	I	π-helix	trans	-91.5	-54	-180	-172.8	0	0	0	0	110.8	C127 F130 V492 V493 W591 T595	C127-V497 WeakPolarHBondContact SG-CG1 3.29Å; F130-V497 HydrophobicContact CE2-CG1 4.11Å; F130-V497 HydrophobicContact CE2-CG2 3.96Å; F130-V497 HydrophobicContact CZ-CG2 4.2Å; V492-V497 PolarHBondContact O-N 3.28Å; V493-V497 WeakPolarHBondContact O-CB 3.19Å; V493-V497 PolarHBondContact O-N 3.23Å; V497-W591 HydrophobicContact CG1-CZ2 4.28Å; V497-W591 HydrophobicContact CG2-CZ2 4.45Å; V497-T595 HydrophobicContact CG1-CG2 3.56Å
498	Y	97.6	Very high	97.3	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.02	16%	0.156	C	C	.	.	I	π-helix	trans	-74.8	-40.9	176.6	-178.6	-108	0	0	0	112.1	I126 V493 R502 F503 D506 P597 W599	I126-Y498 HydrophobicContact CD1-CD1 3.89Å; I126-Y498 HydrophobicContact CD1-CD2 4.14Å; I126-Y498 HydrophobicContact CD1-CE1 3.73Å; I126-Y498 HydrophobicContact CD1-CE2 3.99Å; I126-Y498 HydrophobicContact CD1-CG 4.08Å; I126-Y498 HydrophobicContact CG1-CD1 4.24Å; I126-Y498 HydrophobicContact CG1-CD2 3.55Å; I126-Y498 HydrophobicContact CG1-CE1 4.18Å; I126-Y498 HydrophobicContact CG1-CE2 3.49Å; I126-Y498 VanDerWaalsContact CG1-CE2 3.49Å; I126-Y498 HydrophobicContact CG1-CG 3.93Å; V493-Y498 PolarHBondContact O-N 3.32Å; Y498-R502 HydrophobicContact CE1-CB 4.16Å; Y498-R502 HydrophobicContact CE1-CG 3.81Å; Y498-R502 PolarHBondContact O-NH1 3Å; Y498-R502 WeakPolarHBondContact OH-CD 3.32Å; Y498-F503 HydrophobicContact CD1-CB 3.97Å; Y498-F503 HydrophobicContact CD1-CD2 4.35Å; Y498-F503 HydrophobicContact CE1-CB 3.96Å; Y498-F503 HydrophobicContact CE1-CD2 4.08Å; Y498-D506 VanDerWaalsContact CE1-OD2 3.27Å; Y498-D506 WeakPolarHBondContact CE1-OD2 3.49Å; Y498-D506 VanDerWaalsContact CZ-OD2 3.26Å; Y498-D506 PolarHBondContact OH-OD2 3.45Å; Y498-P597 HydrophobicContact CD2-CG 3.95Å; Y498-P597 HydrophobicContact CE2-CB 4.45Å; Y498-P597 HydrophobicContact CE2-CG 3.57Å; Y498-W599 HydrophobicContact CE2-CH2 4.06Å; Y498-W599 HydrophobicContact CE2-CZ2 4.46Å; Y498-W599 WeakPolarHBondContact OH-CH2 3.34Å
499	G	97.7	Very high	97.2	Very high	22 Å²	22	33.9 Å²	33.9	23%	0.227	17%	0.172	C	C	.	.	I	π-helix	trans	108.8	117.9	176.6	0	0	0	0	0	112.1	V494 A495 D501 R502 F503	V494-G499 CarbonylContact O-C 3Å; V494-G499 PolarHBondContact O-N 3.18Å; A495-G499 CarbonylContact O-C 3.49Å; A495-G499 WeakPolarHBondContact O-CA 3.47Å; G499-D501 PolarHBondContact O-N 3.5Å; G499-R502 WeakPolarHBondContact O-CB 3.35Å; G499-R502 PolarHBondContact O-N 2.83Å; G499-F503 PolarHBondContact O-N 2.84Å
500	A	97.6	Very high	97	Very high	5 Å²	5	31.3 Å²	31.3	4%	0.041	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-37.7	-175.7	0	0	0	0	0	113.6	A495 F503 M504 K520	A495-A500 HydrophobicContact CB-CB 4.08Å; A495-A500 PolarHBondContact O-N 2.64Å; A500-F503 PolarHBondContact O-N 3.24Å; A500-M504 WeakPolarHBondContact O-CB 2.91Å; A500-M504 WeakPolarHBondContact O-CG 3.24Å; A500-M504 PolarHBondContact O-N 2.9Å; A500-K520 HydrophobicContact CB-CD 4.4Å; A500-K520 HydrophobicContact CB-CG 3.78Å
501	D	97.3	Very high	96.9	Very high	72 Å²	72	32 Å²	32	39%	0.385	17%	0.166	S	C	.	.	H	α-helix	trans	-64.2	-45	175.5	-76.5	-59.4	0	0	0	111.7	G499 F503 M504 D505 R514 K520	G499-D501 PolarHBondContact O-N 3.5Å; D501-F503 VanDerWaalsContact C-N 3.3Å; D501-F503 PolarHBondContact O-N 3.21Å; D501-M504 PolarHBondContact O-N 3.32Å; D501-D505 PolarHBondContact O-N 2.93Å; D501-R514 IonicContact OD1-NH2 3.75Å; D501-R514 PolarHBondContact OD1-NH2 3.45Å; D501-R514 VanDerWaalsContact OD1-NH2 3.17Å; D501-K520 WeakPolarHBondContact OD1-CE 3.41Å; D501-K520 IonicContact OD1-NZ 2.64Å; D501-K520 PolarHBondContact OD1-NZ 3.4Å; D501-K520 WeakPolarHBondContact OD2-CE 3.38Å; D501-K520 IonicContact OD2-NZ 3.87Å; D501-K520 PolarHBondContact OD2-NZ 3.45Å
502	R	96.3	Very high	96.8	Very high	133 Å²	133	35.3 Å²	35.3	50%	0.502	20%	0.2	S	C	.	.	H	α-helix	trans	-58.8	-45.9	177	-175.6	-175.6	-68	164.5	-0.7	110.4	Y498 G499 D505 D506	Y498-R502 HydrophobicContact CE1-CB 4.16Å; Y498-R502 HydrophobicContact CE1-CG 3.81Å; Y498-R502 PolarHBondContact O-NH1 3Å; Y498-R502 WeakPolarHBondContact OH-CD 3.32Å; G499-R502 WeakPolarHBondContact O-CB 3.35Å; G499-R502 PolarHBondContact O-N 2.83Å; R502-D505 PolarHBondContact O-N 2.85Å; R502-D506 VanDerWaalsContact O-CG 3.29Å; R502-D506 PolarHBondContact O-N 2.83Å; R502-D506 VanDerWaalsContact O-OD2 3.1Å
503	F	97.5	Very high	96.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-39.6	178.1	-167	-121.9	0	0	0	113	L108 S111 L112 I126 V494 Y498 G499 A500 D501 D505 D506 I507 W523	L108-F503 HydrophobicContact CG-CE1 4.45Å; S111-F503 WeakPolarHBondContact OG-CZ 3.37Å; L112-F503 HydrophobicContact CB-CE2 4.45Å; L112-F503 HydrophobicContact CB-CZ 3.98Å; L112-F503 HydrophobicContact CD1-CE2 3.9Å; L112-F503 HydrophobicContact CD1-CZ 4.21Å; I126-F503 HydrophobicContact CD1-CD2 4.16Å; I126-F503 HydrophobicContact CD1-CE2 4.26Å; V494-F503 HydrophobicContact CG1-CB 4.07Å; V494-F503 HydrophobicContact CG1-CD1 3.36Å; V494-F503 HydrophobicContact CG1-CD2 4.31Å; V494-F503 HydrophobicContact CG1-CE1 3.8Å; V494-F503 HydrophobicContact CG1-CG 3.66Å; V494-F503 HydrophobicContact CG1-CZ 4.45Å; Y498-F503 HydrophobicContact CD1-CB 3.97Å; Y498-F503 HydrophobicContact CD1-CD2 4.35Å; Y498-F503 HydrophobicContact CE1-CB 3.96Å; Y498-F503 HydrophobicContact CE1-CD2 4.08Å; G499-F503 PolarHBondContact O-N 2.84Å; A500-F503 PolarHBondContact O-N 3.24Å; D501-F503 VanDerWaalsContact C-N 3.3Å; D501-F503 PolarHBondContact O-N 3.21Å; F503-D505 VanDerWaalsContact C-N 3.26Å; F503-D505 PolarHBondContact O-N 3.08Å; F503-D506 PolarHBondContact O-N 3.45Å; F503-I507 HydrophobicContact CD1-CD1 3.8Å; F503-I507 HydrophobicContact CE1-CD1 3.64Å; F503-I507 HydrophobicContact CE1-CG1 4.43Å; F503-I507 HydrophobicContact CG-CD1 4.42Å; F503-I507 HydrophobicContact CZ-CD1 4.11Å; F503-I507 HydrophobicContact CZ-CG1 4.46Å; F503-I507 VanDerWaalsContact O-CG1 3.26Å; F503-I507 WeakPolarHBondContact O-CG1 3.39Å; F503-I507 PolarHBondContact O-N 2.79Å; F503-W523 HydrophobicContact CD1-CE3 4.41Å; F503-W523 HydrophobicContact CD1-CH2 4.07Å; F503-W523 AromaticContact CD1-CZ3 3.78Å; F503-W523 HydrophobicContact CD1-CZ3 3.78Å; F503-W523 HydrophobicContact CE1-CH2 4.07Å; F503-W523 HydrophobicContact CE1-CZ3 4.23Å
504	M	97.6	Very high	96.6	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.02	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-34.4	173.8	-72.9	-73.6	-73.2	0	0	112.3	A500 D501 A508 R514 P515 K520 W523	A500-M504 WeakPolarHBondContact O-CB 2.91Å; A500-M504 WeakPolarHBondContact O-CG 3.24Å; A500-M504 PolarHBondContact O-N 2.9Å; D501-M504 PolarHBondContact O-N 3.32Å; M504-A508 WeakPolarHBondContact O-CB 3.2Å; M504-A508 PolarHBondContact O-N 3.4Å; M504-R514 HydrophobicContact CE-CG 4.4Å; M504-P515 HydrophobicContact CE-CB 3.72Å; M504-P515 HydrophobicContact CE-CG 4.07Å; M504-P515 WeakPolarHBondContact CE-O 3.14Å; M504-P515 HydrophobicContact SD-CB 4.18Å; M504-P515 HydrophobicContact SD-CG 4.14Å; M504-K520 HydrophobicContact CG-CB 4.28Å; M504-W523 HydrophobicContact CG-CZ3 4.15Å; M504-W523 HydrophobicContact SD-CH2 4.08Å; M504-W523 HydrophobicContact SD-CZ3 3.66Å
505	D	96.2	Very high	96.5	Very high	74 Å²	74	44.7 Å²	44.7	40%	0.396	23%	0.234	S	C	.	.	H	α-helix	trans	-74	-40.8	177.1	-60.8	-14.5	0	0	0	111	D501 R502 F503 I507 A508 C509 R514	D501-D505 PolarHBondContact O-N 2.93Å; R502-D505 PolarHBondContact O-N 2.85Å; F503-D505 VanDerWaalsContact C-N 3.26Å; F503-D505 PolarHBondContact O-N 3.08Å; D505-I507 VanDerWaalsContact C-N 3.28Å; D505-I507 PolarHBondContact O-N 3.4Å; D505-A508 WeakPolarHBondContact O-CA 3.37Å; D505-A508 WeakPolarHBondContact O-CB 3.47Å; D505-A508 PolarHBondContact O-N 2.71Å; D505-C509 PolarHBondContact O-N 3.18Å; D505-C509 PolarHBondContact O-SG 2.9Å; D505-C509 VanDerWaalsContact O-SG 3.36Å; D505-R514 IonicContact OD1-CZ 3.57Å; D505-R514 IonicContact OD1-NE 3.95Å; D505-R514 PolarHBondContact OD1-NE 2.99Å; D505-R514 IonicContact OD1-NH2 3.49Å; D505-R514 PolarHBondContact OD1-NH2 3.2Å; D505-R514 IonicContact OD2-NH2 2.69Å
506	D	95.5	Very high	96.4	Very high	16 Å²	16	47 Å²	47	9%	0.086	25%	0.249	C	C	.	.	H	α-helix	trans	-58.2	-41.2	171.3	-69.9	-44.7	0	0	0	111.5	F115 Y498 R502 F503 C509 M510 R607	F115-D506 HydrophobicContact CD2-CB 4.11Å; F115-D506 HydrophobicContact CE1-CB 4.1Å; F115-D506 HydrophobicContact CE2-CB 3.59Å; F115-D506 HydrophobicContact CZ-CB 3.58Å; F115-D506 WeakPolarHBondContact CZ-OD1 3.4Å; Y498-D506 VanDerWaalsContact CE1-OD2 3.27Å; Y498-D506 WeakPolarHBondContact CE1-OD2 3.49Å; Y498-D506 VanDerWaalsContact CZ-OD2 3.26Å; Y498-D506 PolarHBondContact OH-OD2 3.45Å; R502-D506 VanDerWaalsContact O-CG 3.29Å; R502-D506 PolarHBondContact O-N 2.83Å; R502-D506 VanDerWaalsContact O-OD2 3.1Å; F503-D506 PolarHBondContact O-N 3.45Å; D506-C509 WeakPolarHBondContact O-CB 3.49Å; D506-C509 PolarHBondContact O-N 2.93Å; D506-M510 PolarHBondContact O-N 3.18Å; D506-M510 VanDerWaalsContact O-N 3.12Å; D506-R607 IonicContact OD1-NH2 3.94Å
507	I	96.9	Very high	96.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-42.2	173.4	-68	165.3	0	0	0	111.2	F107 F503 D505 C509 M510 I511 P515 W523	F107-I507 HydrophobicContact CE1-CD1 4.09Å; F107-I507 HydrophobicContact CZ-CD1 3.92Å; F107-I507 HydrophobicContact CZ-CG2 3.92Å; F503-I507 HydrophobicContact CD1-CD1 3.8Å; F503-I507 HydrophobicContact CE1-CD1 3.64Å; F503-I507 HydrophobicContact CE1-CG1 4.43Å; F503-I507 HydrophobicContact CG-CD1 4.42Å; F503-I507 HydrophobicContact CZ-CD1 4.11Å; F503-I507 HydrophobicContact CZ-CG1 4.46Å; F503-I507 VanDerWaalsContact O-CG1 3.26Å; F503-I507 WeakPolarHBondContact O-CG1 3.39Å; F503-I507 PolarHBondContact O-N 2.79Å; D505-I507 VanDerWaalsContact C-N 3.28Å; D505-I507 PolarHBondContact O-N 3.4Å; I507-C509 VanDerWaalsContact C-N 3.25Å; I507-C509 PolarHBondContact O-N 3.12Å; I507-M510 HydrophobicContact CB-CE 4.14Å; I507-M510 HydrophobicContact CG1-CE 3.71Å; I507-M510 HydrophobicContact CG2-CE 4.48Å; I507-M510 WeakPolarHBondContact O-CA 3.48Å; I507-M510 WeakPolarHBondContact O-CB 3.43Å; I507-M510 PolarHBondContact O-N 3.22Å; I507-I511 HydrophobicContact CG2-CD1 3.82Å; I507-I511 HydrophobicContact CG2-CG1 4.19Å; I507-I511 HydrophobicContact CG2-CG2 4.38Å; I507-I511 WeakPolarHBondContact O-CG1 3.26Å; I507-I511 PolarHBondContact O-N 2.85Å; I507-P515 HydrophobicContact CB-CG 4.26Å; I507-P515 HydrophobicContact CG2-CG 3.44Å; I507-P515 VanDerWaalsContact CG2-CG 3.44Å; I507-W523 HydrophobicContact CD1-CH2 3.94Å; I507-W523 HydrophobicContact CD1-CZ3 4.48Å
508	A	96.2	Very high	96.3	Very high	22 Å²	22	46.7 Å²	46.7	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-38.3	176.9	0	0	0	0	0	111.8	M504 D505 M510 G512 Y513 R514	M504-A508 WeakPolarHBondContact O-CB 3.2Å; M504-A508 PolarHBondContact O-N 3.4Å; D505-A508 WeakPolarHBondContact O-CA 3.37Å; D505-A508 WeakPolarHBondContact O-CB 3.47Å; D505-A508 PolarHBondContact O-N 2.71Å; A508-M510 VanDerWaalsContact C-N 3.32Å; A508-M510 PolarHBondContact O-N 3.43Å; A508-G512 CarbonylContact O-C 3.47Å; A508-G512 VanDerWaalsContact O-CA 3.3Å; A508-G512 WeakPolarHBondContact O-CA 3.39Å; A508-G512 PolarHBondContact O-N 2.95Å; A508-Y513 WeakPolarHBondContact CA-O 3.27Å; A508-Y513 PolarHBondContact O-N 3.41Å; A508-R514 HydrophobicContact CB-CB 4.21Å; A508-R514 HydrophobicContact CB-CG 4.46Å
509	C	93.5	Very high	96.3	Very high	73 Å²	73	47 Å²	47	49%	0.493	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-34.1	172.1	-65.8	0	0	0	0	112.8	D505 D506 I507	D505-C509 PolarHBondContact O-N 3.18Å; D505-C509 PolarHBondContact O-SG 2.9Å; D505-C509 VanDerWaalsContact O-SG 3.36Å; D506-C509 WeakPolarHBondContact O-CB 3.49Å; D506-C509 PolarHBondContact O-N 2.93Å; I507-C509 VanDerWaalsContact C-N 3.25Å; I507-C509 PolarHBondContact O-N 3.12Å
510	M	94.3	Very high	96.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-71.3	-57.4	174.2	-71.2	-169.9	-69.8	0	0	112.3	Q114 F115 F333 N334 D506 I507 A508	Q114-M510 HydrophobicContact CB-SD 4.33Å; Q114-M510 HydrophobicContact CG-SD 4.02Å; F115-M510 WeakPolarHBondContact CA-SD 3.25Å; F115-M510 HydrophobicContact CB-CE 3.73Å; F115-M510 HydrophobicContact CB-SD 3.55Å; F115-M510 VanDerWaalsContact CB-SD 3.55Å; F115-M510 HydrophobicContact CD2-CE 4.16Å; F115-M510 HydrophobicContact CD2-CG 3.99Å; F115-M510 HydrophobicContact CD2-SD 3.81Å; F115-M510 HydrophobicContact CG-CE 4.32Å; F115-M510 HydrophobicContact CG-SD 4.17Å; F333-M510 HydrophobicContact CD1-CG 4.28Å; F333-M510 HydrophobicContact CD2-CG 4.19Å; F333-M510 HydrophobicContact CD2-SD 4.44Å; F333-M510 HydrophobicContact CE1-CB 4.41Å; F333-M510 HydrophobicContact CE1-CG 3.79Å; F333-M510 HydrophobicContact CE2-CG 3.69Å; F333-M510 HydrophobicContact CE2-SD 4.12Å; F333-M510 HydrophobicContact CG-CG 4.48Å; F333-M510 HydrophobicContact CZ-CG 3.47Å; F333-M510 VanDerWaalsContact CZ-CG 3.47Å; F333-M510 HydrophobicContact CZ-SD 4.48Å; N334-M510 VanDerWaalsContact CA-O 3.23Å; N334-M510 WeakPolarHBondContact CA-O 3.44Å; N334-M510 PolarHBondContact OD1-O 2.62Å; D506-M510 PolarHBondContact O-N 3.18Å; D506-M510 VanDerWaalsContact O-N 3.12Å; I507-M510 HydrophobicContact CB-CE 4.14Å; I507-M510 HydrophobicContact CG1-CE 3.71Å; I507-M510 HydrophobicContact CG2-CE 4.48Å; I507-M510 WeakPolarHBondContact O-CA 3.48Å; I507-M510 WeakPolarHBondContact O-CB 3.43Å; I507-M510 PolarHBondContact O-N 3.22Å; A508-M510 VanDerWaalsContact C-N 3.32Å; A508-M510 PolarHBondContact O-N 3.43Å
511	I	95.8	Very high	96.3	Very high	19 Å²	19	54.8 Å²	54.8	10%	0.097	28%	0.279	C	S	.	.	H	α-helix	trans	-93.7	-6.5	-166	74.8	-179.1	0	0	0	113.7	N335 I507 Y513 P515	N335-I511 WeakPolarHBondContact O-CG2 3.32Å; I507-I511 HydrophobicContact CG2-CD1 3.82Å; I507-I511 HydrophobicContact CG2-CG1 4.19Å; I507-I511 HydrophobicContact CG2-CG2 4.38Å; I507-I511 WeakPolarHBondContact O-CG1 3.26Å; I507-I511 PolarHBondContact O-N 2.85Å; I511-Y513 HydrophobicContact CB-CE1 4.35Å; I511-Y513 HydrophobicContact CD1-CD1 4.27Å; I511-Y513 HydrophobicContact CD1-CD2 4.14Å; I511-Y513 HydrophobicContact CD1-CE1 3.86Å; I511-Y513 HydrophobicContact CD1-CE2 3.69Å; I511-Y513 HydrophobicContact CD1-CG 4.41Å; I511-Y513 HydrophobicContact CG1-CD1 3.97Å; I511-Y513 HydrophobicContact CG1-CD2 4.49Å; I511-Y513 HydrophobicContact CG1-CE1 3.89Å; I511-Y513 HydrophobicContact CG1-CE2 4.41Å; I511-Y513 HydrophobicContact CG1-CG 4.29Å; I511-Y513 VanDerWaalsContact CG1-O 3.24Å; I511-Y513 WeakPolarHBondContact CG1-O 3.47Å; I511-Y513 WeakPolarHBondContact O-CD1 3.26Å; I511-P515 HydrophobicContact CD1-CG 4.09Å
512	G	95.1	Very high	96.4	Very high	69 Å²	69	51.3 Å²	51.3	71%	0.711	26%	0.261	S	S	*	.	S	Bend	trans	85.8	2.7	178.4	0	0	0	0	0	115.2	A508	A508-G512 CarbonylContact O-C 3.47Å; A508-G512 VanDerWaalsContact O-CA 3.3Å; A508-G512 WeakPolarHBondContact O-CA 3.39Å; A508-G512 PolarHBondContact O-N 2.95Å
513	Y	96.2	Very high	96.5	Very high	93 Å²	93	45 Å²	45	37%	0.365	24%	0.237	S	C	.	.	S	Bend	trans	-155.6	154.7	175.2	64.6	-88.3	0	0	0	111.3	N336 Y338 A508 I511 P515	N336-Y513 WeakPolarHBondContact ND2-CE1 3.4Å; N336-Y513 PolarHBondContact ND2-OH 2.93Å; N336-Y513 PolarHBondContact OD1-OH 2.88Å; Y338-Y513 HydrophobicContact CD1-CE2 4.2Å; A508-Y513 WeakPolarHBondContact CA-O 3.27Å; A508-Y513 PolarHBondContact O-N 3.41Å; I511-Y513 HydrophobicContact CB-CE1 4.35Å; I511-Y513 HydrophobicContact CD1-CD1 4.27Å; I511-Y513 HydrophobicContact CD1-CD2 4.14Å; I511-Y513 HydrophobicContact CD1-CE1 3.86Å; I511-Y513 HydrophobicContact CD1-CE2 3.69Å; I511-Y513 HydrophobicContact CD1-CG 4.41Å; I511-Y513 HydrophobicContact CG1-CD1 3.97Å; I511-Y513 HydrophobicContact CG1-CD2 4.49Å; I511-Y513 HydrophobicContact CG1-CE1 3.89Å; I511-Y513 HydrophobicContact CG1-CE2 4.41Å; I511-Y513 HydrophobicContact CG1-CG 4.29Å; I511-Y513 VanDerWaalsContact CG1-O 3.24Å; I511-Y513 WeakPolarHBondContact CG1-O 3.47Å; I511-Y513 WeakPolarHBondContact O-CD1 3.26Å; Y513-P515 WeakPolarHBondContact O-CD 3.42Å
514	R	95.9	Very high	96.5	Very high	129 Å²	129	45.5 Å²	45.5	49%	0.487	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-77	125.7	178.9	-156.8	169.3	-161	-146.1	-3.4	110.5	D501 M504 D505 A508	D501-R514 IonicContact OD1-NH2 3.75Å; D501-R514 PolarHBondContact OD1-NH2 3.45Å; D501-R514 VanDerWaalsContact OD1-NH2 3.17Å; M504-R514 HydrophobicContact CE-CG 4.4Å; D505-R514 IonicContact OD1-CZ 3.57Å; D505-R514 IonicContact OD1-NE 3.95Å; D505-R514 PolarHBondContact OD1-NE 2.99Å; D505-R514 IonicContact OD1-NH2 3.49Å; D505-R514 PolarHBondContact OD1-NH2 3.2Å; D505-R514 IonicContact OD2-NH2 2.69Å; A508-R514 HydrophobicContact CB-CB 4.21Å; A508-R514 HydrophobicContact CB-CG 4.46Å
515	P	96	Very high	96.5	Very high	4 Å²	4	49.2 Å²	49.2	3%	0.026	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-62.1	169.2	177.4	-18.8	28.2	0	0	0	113.1	F107 Y338 M504 I507 I511 Y513	F107-P515 HydrophobicContact CE1-CB 4.14Å; F107-P515 HydrophobicContact CE1-CG 4.1Å; F107-P515 HydrophobicContact CZ-CB 4.32Å; F107-P515 HydrophobicContact CZ-CG 3.92Å; Y338-P515 HydrophobicContact CD2-CB 3.97Å; Y338-P515 HydrophobicContact CE2-CB 4.02Å; Y338-P515 HydrophobicContact CG-CB 4.33Å; M504-P515 HydrophobicContact CE-CB 3.72Å; M504-P515 HydrophobicContact CE-CG 4.07Å; M504-P515 WeakPolarHBondContact CE-O 3.14Å; M504-P515 HydrophobicContact SD-CB 4.18Å; M504-P515 HydrophobicContact SD-CG 4.14Å; I507-P515 HydrophobicContact CB-CG 4.26Å; I507-P515 HydrophobicContact CG2-CG 3.44Å; I507-P515 VanDerWaalsContact CG2-CG 3.44Å; I511-P515 HydrophobicContact CD1-CG 4.09Å; Y513-P515 WeakPolarHBondContact O-CD 3.42Å
516	C	95.7	Very high	96.5	Very high	57 Å²	57	50 Å²	50	39%	0.385	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-58.3	131.9	177.9	-177.3	0	0	0	0	111.2	Y338 W518 M519	Y338-C516 VanDerWaalsContact OH-CB 3.25Å; Y338-C516 WeakPolarHBondContact OH-CB 3.22Å; C516-W518 PolarHBondContact O-N 3.41Å; C516-M519 PolarHBondContact O-N 3.21Å
517	P	96.7	Very high	96.6	Very high	81 Å²	81	49.2 Å²	49.2	53%	0.526	25%	0.252	S	S	.	.	H	α-helix	trans	-55.7	-21.2	177	-27.5	35.2	0	0	0	114.4	M519 K520 W521	P517-M519 PolarHBondContact O-N 3.29Å; P517-K520 WeakPolarHBondContact O-CB 3.3Å; P517-K520 PolarHBondContact O-N 2.59Å; P517-K520 VanDerWaalsContact O-N 3.12Å; P517-W521 PolarHBondContact O-N 3.11Å; P517-W521 VanDerWaalsContact O-N 3.13Å
518	W	97.4	Very high	96.6	Very high	101 Å²	101	49.7 Å²	49.7	38%	0.383	26%	0.256	S	S	.	.	H	α-helix	trans	-50.9	-41.8	172.9	180	-107.3	0	0	0	112.7	L99 V100 C516 K520 W521 C522 F526	L99-W518 PolarHBondContact O-NE1 2.98Å; V100-W518 HydrophobicContact CG2-CH2 4.46Å; V100-W518 HydrophobicContact CG2-CZ2 3.94Å; C516-W518 PolarHBondContact O-N 3.41Å; W518-K520 VanDerWaalsContact C-N 3.32Å; W518-K520 PolarHBondContact O-N 2.94Å; W518-W521 PolarHBondContact O-N 2.59Å; W518-W521 VanDerWaalsContact O-N 3.16Å; W518-C522 PolarHBondContact NE1-SG 3Å; W518-C522 VanDerWaalsContact NE1-SG 3.39Å; W518-C522 PolarHBondContact O-N 3.22Å; W518-F526 HydrophobicContact CH2-CD2 4.29Å; W518-F526 HydrophobicContact CH2-CE2 4.15Å; W518-F526 HydrophobicContact CZ3-CD2 4.44Å; W518-F526 AromaticContact CZ3-CE2 3.95Å; W518-F526 HydrophobicContact CZ3-CE2 3.95Å
519	M	97.5	Very high	96.6	Very high	11 Å²	11	54.4 Å²	54.4	5%	0.054	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-44.2	179.3	-62.1	-57.9	158.4	0	0	111.5	I103 P104 F107 Y338 C516 P517 W521 C522 W523	I103-M519 HydrophobicContact CG2-CE 3.87Å; P104-M519 HydrophobicContact CB-SD 4.13Å; P104-M519 HydrophobicContact CG-SD 4.05Å; F107-M519 HydrophobicContact CD1-CB 4.42Å; F107-M519 HydrophobicContact CD1-CG 4.02Å; F107-M519 HydrophobicContact CD1-SD 4.29Å; F107-M519 HydrophobicContact CE1-CG 4.28Å; Y338-M519 HydrophobicContact CE2-CE 3.75Å; Y338-M519 HydrophobicContact CE2-CG 3.8Å; Y338-M519 HydrophobicContact CE2-SD 4.39Å; C516-M519 PolarHBondContact O-N 3.21Å; P517-M519 PolarHBondContact O-N 3.29Å; M519-W521 PolarHBondContact O-N 3.46Å; M519-C522 WeakPolarHBondContact O-CB 3.32Å; M519-C522 PolarHBondContact O-N 3.49Å; M519-W523 HydrophobicContact CB-CH2 4.06Å; M519-W523 HydrophobicContact CB-CZ2 3.99Å; M519-W523 HydrophobicContact CB-CZ3 4.38Å; M519-W523 PolarHBondContact O-N 3.46Å
520	K	97.4	Very high	96.6	Very high	55 Å²	55	52.9 Å²	52.9	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-58.6	-47.7	174.7	172.1	-176.5	179.6	-173.6	0	111.8	A500 D501 M504 P517 W518 C522 W523 S524	A500-K520 HydrophobicContact CB-CD 4.4Å; A500-K520 HydrophobicContact CB-CG 3.78Å; D501-K520 WeakPolarHBondContact OD1-CE 3.41Å; D501-K520 IonicContact OD1-NZ 2.64Å; D501-K520 PolarHBondContact OD1-NZ 3.4Å; D501-K520 WeakPolarHBondContact OD2-CE 3.38Å; D501-K520 IonicContact OD2-NZ 3.87Å; D501-K520 PolarHBondContact OD2-NZ 3.45Å; M504-K520 HydrophobicContact CG-CB 4.28Å; P517-K520 WeakPolarHBondContact O-CB 3.3Å; P517-K520 PolarHBondContact O-N 2.59Å; P517-K520 VanDerWaalsContact O-N 3.12Å; W518-K520 VanDerWaalsContact C-N 3.32Å; W518-K520 PolarHBondContact O-N 2.94Å; K520-C522 VanDerWaalsContact C-N 3.33Å; K520-C522 PolarHBondContact O-N 3.31Å; K520-W523 PolarHBondContact O-N 2.91Å; K520-S524 VanDerWaalsContact O-CB 3.28Å; K520-S524 WeakPolarHBondContact O-CB 3.43Å; K520-S524 PolarHBondContact O-N 3.41Å; K520-S524 PolarHBondContact O-OG 3.22Å
521	W	98.1	Very high	96.6	Very high	135 Å²	135	52.8 Å²	52.8	51%	0.511	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-39.9	179.8	-72.7	107.8	0	0	0	112.2	P517 W518 M519 S524 F525 F526	P517-W521 PolarHBondContact O-N 3.11Å; P517-W521 VanDerWaalsContact O-N 3.13Å; W518-W521 PolarHBondContact O-N 2.59Å; W518-W521 VanDerWaalsContact O-N 3.16Å; M519-W521 PolarHBondContact O-N 3.46Å; W521-S524 PolarHBondContact O-N 3.04Å; W521-F525 AromaticContact CE3-CD2 3.6Å; W521-F525 HydrophobicContact CE3-CD2 3.6Å; W521-F525 AromaticContact CE3-CE2 3.57Å; W521-F525 HydrophobicContact CE3-CE2 3.57Å; W521-F525 AromaticContact CZ3-CD2 3.99Å; W521-F525 HydrophobicContact CZ3-CD2 3.99Å; W521-F525 AromaticContact CZ3-CE2 3.55Å; W521-F525 HydrophobicContact CZ3-CE2 3.55Å; W521-F525 HydrophobicContact CZ3-CZ 4.42Å; W521-F525 PolarHBondContact O-N 2.91Å; W521-F526 HydrophobicContact CB-CD2 4.27Å; W521-F526 HydrophobicContact CB-CE2 4.02Å; W521-F526 PolarHBondContact O-N 3.23Å
522	C	98.2	Very high	96.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.271	C	S	.	.	I	π-helix	trans	-58.7	-57	173.6	-78.4	0	0	0	0	111.6	V100 P104 W518 M519 K520 S524 F525 F526 T527 P528	V100-C522 PolarHBondContact O-SG 2.49Å; V100-C522 VanDerWaalsContact O-SG 3.39Å; P104-C522 HydrophobicContact CB-CB 3.59Å; P104-C522 HydrophobicContact CG-CB 3.48Å; P104-C522 VanDerWaalsContact CG-CB 3.48Å; W518-C522 PolarHBondContact NE1-SG 3Å; W518-C522 VanDerWaalsContact NE1-SG 3.39Å; W518-C522 PolarHBondContact O-N 3.22Å; M519-C522 WeakPolarHBondContact O-CB 3.32Å; M519-C522 PolarHBondContact O-N 3.49Å; K520-C522 VanDerWaalsContact C-N 3.33Å; K520-C522 PolarHBondContact O-N 3.31Å; C522-S524 VanDerWaalsContact C-N 3.25Å; C522-S524 PolarHBondContact O-N 3.15Å; C522-F525 PolarHBondContact O-N 2.86Å; C522-F526 PolarHBondContact O-N 3.08Å; C522-T527 VanDerWaalsContact C-OG1 3.22Å; C522-T527 WeakPolarHBondContact CB-OG1 3.36Å; C522-T527 WeakPolarHBondContact O-CB 3.43Å; C522-T527 PolarHBondContact O-N 3.25Å; C522-T527 PolarHBondContact O-OG1 3.01Å; C522-T527 VanDerWaalsContact O-OG1 3.06Å; C522-P528 VanDerWaalsContact O-CD 3.3Å; C522-P528 WeakPolarHBondContact O-CD 3.43Å
523	W	98.2	Very high	96.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-59.8	-35.8	179.7	-55.8	-33.5	0	0	0	113.2	P104 F107 L108 C491 A495 F503 M504 I507 M519 K520	P104-W523 VanDerWaalsContact C-NE1 3.27Å; P104-W523 PolarHBondContact O-NE1 3.18Å; F107-W523 AromaticContact CD1-CH2 3.84Å; F107-W523 HydrophobicContact CD1-CH2 3.84Å; F107-W523 AromaticContact CD1-CZ2 3.51Å; F107-W523 HydrophobicContact CD1-CZ2 3.51Å; F107-W523 AromaticContact CE1-CH2 3.75Å; F107-W523 HydrophobicContact CE1-CH2 3.75Å; F107-W523 AromaticContact CE1-CZ2 3.94Å; F107-W523 HydrophobicContact CE1-CZ2 3.94Å; F107-W523 HydrophobicContact CG-CZ2 4.41Å; L108-W523 HydrophobicContact CB-CZ2 4.05Å; L108-W523 HydrophobicContact CD1-CD2 4.26Å; L108-W523 HydrophobicContact CD1-CG 4.04Å; C491-W523 WeakPolarHBondContact CB-O 3.4Å; A495-W523 HydrophobicContact CB-CB 4.11Å; F503-W523 HydrophobicContact CD1-CE3 4.41Å; F503-W523 HydrophobicContact CD1-CH2 4.07Å; F503-W523 AromaticContact CD1-CZ3 3.78Å; F503-W523 HydrophobicContact CD1-CZ3 3.78Å; F503-W523 HydrophobicContact CE1-CH2 4.07Å; F503-W523 HydrophobicContact CE1-CZ3 4.23Å; M504-W523 HydrophobicContact CG-CZ3 4.15Å; M504-W523 HydrophobicContact SD-CH2 4.08Å; M504-W523 HydrophobicContact SD-CZ3 3.66Å; I507-W523 HydrophobicContact CD1-CH2 3.94Å; I507-W523 HydrophobicContact CD1-CZ3 4.48Å; M519-W523 HydrophobicContact CB-CH2 4.06Å; M519-W523 HydrophobicContact CB-CZ2 3.99Å; M519-W523 HydrophobicContact CB-CZ3 4.38Å; M519-W523 PolarHBondContact O-N 3.46Å; K520-W523 PolarHBondContact O-N 2.91Å
524	S	98.3	Very high	96.1	Very high	11 Å²	11	49.1 Å²	49.1	8%	0.077	24%	0.244	C	C	.	.	I	π-helix	trans	-77.7	-35.9	-176.1	-53.6	0	0	0	0	112.6	W496 K520 W521 C522	W496-S524 PolarHBondContact NE1-O 3.16Å; K520-S524 VanDerWaalsContact O-CB 3.28Å; K520-S524 WeakPolarHBondContact O-CB 3.43Å; K520-S524 PolarHBondContact O-N 3.41Å; K520-S524 PolarHBondContact O-OG 3.22Å; W521-S524 PolarHBondContact O-N 3.04Å; C522-S524 VanDerWaalsContact C-N 3.25Å; C522-S524 PolarHBondContact O-N 3.15Å
525	F	97.5	Very high	95.9	Very high	81 Å²	81	44.2 Å²	44.2	36%	0.355	23%	0.227	S	C	.	.	I	π-helix	trans	-135.7	-64.1	-169.4	-54.3	-78.6	0	0	0	113.2	W496 W521 C522 T527 P528 L529	W496-F525 AromaticContact CH2-CE1 3.76Å; W496-F525 HydrophobicContact CH2-CE1 3.76Å; W496-F525 AromaticContact CH2-CZ 3.93Å; W496-F525 HydrophobicContact CH2-CZ 3.93Å; W496-F525 HydrophobicContact CZ2-CD1 4.05Å; W496-F525 AromaticContact CZ2-CE1 3.43Å; W496-F525 HydrophobicContact CZ2-CE1 3.43Å; W496-F525 VanDerWaalsContact CZ2-CE1 3.43Å; W496-F525 AromaticContact CZ2-CZ 3.77Å; W496-F525 HydrophobicContact CZ2-CZ 3.77Å; W521-F525 AromaticContact CE3-CD2 3.6Å; W521-F525 HydrophobicContact CE3-CD2 3.6Å; W521-F525 AromaticContact CE3-CE2 3.57Å; W521-F525 HydrophobicContact CE3-CE2 3.57Å; W521-F525 AromaticContact CZ3-CD2 3.99Å; W521-F525 HydrophobicContact CZ3-CD2 3.99Å; W521-F525 AromaticContact CZ3-CE2 3.55Å; W521-F525 HydrophobicContact CZ3-CE2 3.55Å; W521-F525 HydrophobicContact CZ3-CZ 4.42Å; W521-F525 PolarHBondContact O-N 2.91Å; C522-F525 PolarHBondContact O-N 2.86Å; F525-T527 PolarHBondContact O-N 2.82Å; F525-P528 WeakPolarHBondContact O-CD 3.43Å; F525-P528 WeakPolarHBondContact O-CG 3.28Å; F525-L529 WeakPolarHBondContact O-CB 3.45Å; F525-L529 WeakPolarHBondContact O-CD1 3.42Å; F525-L529 WeakPolarHBondContact O-CG 3.35Å; F525-L529 PolarHBondContact O-N 3.12Å; F525-L529 VanDerWaalsContact O-N 3.1Å
526	F	97.1	Very high	95.7	Very high	90 Å²	90	48.3 Å²	48.3	40%	0.395	25%	0.247	S	C	.	.	I	π-helix	trans	-68	-45.7	-164.8	-58.4	-66.7	0	0	0	112.9	V100 W518 W521 C522 L529 V530	V100-F526 HydrophobicContact CG1-CB 3.39Å; V100-F526 HydrophobicContact CG1-CG 4.33Å; W518-F526 HydrophobicContact CH2-CD2 4.29Å; W518-F526 HydrophobicContact CH2-CE2 4.15Å; W518-F526 HydrophobicContact CZ3-CD2 4.44Å; W518-F526 AromaticContact CZ3-CE2 3.95Å; W518-F526 HydrophobicContact CZ3-CE2 3.95Å; W521-F526 HydrophobicContact CB-CD2 4.27Å; W521-F526 HydrophobicContact CB-CE2 4.02Å; W521-F526 PolarHBondContact O-N 3.23Å; C522-F526 PolarHBondContact O-N 3.08Å; F526-L529 PolarHBondContact O-N 3.35Å; F526-V530 WeakPolarHBondContact O-CG2 3.46Å; F526-V530 PolarHBondContact O-N 2.88Å
527	T	96.6	Very high	95.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-53.7	179.4	-53	0	0	0	0	112.4	V100 I105 C491 C522 F525 L529 V530 C531	V100-T527 PolarHBondContact O-OG1 3.02Å; I105-T527 HydrophobicContact CD1-CG2 3.38Å; I105-T527 HydrophobicContact CG1-CG2 3.48Å; I105-T527 VanDerWaalsContact CG1-CG2 3.48Å; C491-T527 VanDerWaalsContact SG-CG2 3.51Å; C522-T527 VanDerWaalsContact C-OG1 3.22Å; C522-T527 WeakPolarHBondContact CB-OG1 3.36Å; C522-T527 WeakPolarHBondContact O-CB 3.43Å; C522-T527 PolarHBondContact O-N 3.25Å; C522-T527 PolarHBondContact O-OG1 3.01Å; C522-T527 VanDerWaalsContact O-OG1 3.06Å; F525-T527 PolarHBondContact O-N 2.82Å; T527-L529 VanDerWaalsContact C-N 3.27Å; T527-L529 PolarHBondContact O-N 3.47Å; T527-V530 PolarHBondContact O-N 3.47Å; T527-C531 PolarHBondContact O-N 3.25Å; T527-C531 PolarHBondContact O-SG 3.06Å
528	P	97	Very high	94.8	Very high	11 Å²	11	45.6 Å²	45.6	7%	0.071	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-32.3	178.5	22.7	-32.3	0	0	0	112.6	F488 C491 C522 F525 C531 M532	F488-P528 HydrophobicContact CD2-CB 3.68Å; F488-P528 HydrophobicContact CE2-CB 3.95Å; C491-P528 HydrophobicContact CB-CB 4.29Å; C491-P528 HydrophobicContact CB-CG 4.32Å; C522-P528 VanDerWaalsContact O-CD 3.3Å; C522-P528 WeakPolarHBondContact O-CD 3.43Å; F525-P528 WeakPolarHBondContact O-CD 3.43Å; F525-P528 WeakPolarHBondContact O-CG 3.28Å; P528-C531 PolarHBondContact O-N 3.5Å; P528-M532 VanDerWaalsContact O-CB 3.26Å; P528-M532 WeakPolarHBondContact O-CB 3.47Å; P528-M532 PolarHBondContact O-N 2.91Å
529	L	95.9	Very high	94.4	Very high	121 Å²	121	44 Å²	44	63%	0.634	22%	0.224	S	C	*	.	H	α-helix	trans	-64.6	-44.6	173.2	-73.9	171.3	0	0	0	112.3	F525 F526 T527 G533	F525-L529 WeakPolarHBondContact O-CB 3.45Å; F525-L529 WeakPolarHBondContact O-CD1 3.42Å; F525-L529 WeakPolarHBondContact O-CG 3.35Å; F525-L529 PolarHBondContact O-N 3.12Å; F525-L529 VanDerWaalsContact O-N 3.1Å; F526-L529 PolarHBondContact O-N 3.35Å; T527-L529 VanDerWaalsContact C-N 3.27Å; T527-L529 PolarHBondContact O-N 3.47Å; L529-G533 WeakPolarHBondContact O-CA 3.32Å; L529-G533 PolarHBondContact O-N 3.13Å
530	V	93	Very high	94.1	Very high	41 Å²	41	48.1 Å²	48.1	25%	0.248	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-45.8	175.2	170.2	0	0	0	0	110.5	I97 V100 F526 T527 G533 I534	I97-V530 HydrophobicContact CG2-CG1 4.44Å; V100-V530 HydrophobicContact CG1-CG2 4.2Å; F526-V530 WeakPolarHBondContact O-CG2 3.46Å; F526-V530 PolarHBondContact O-N 2.88Å; T527-V530 PolarHBondContact O-N 3.47Å; V530-G533 PolarHBondContact O-N 3.5Å; V530-I534 HydrophobicContact CG1-CD1 3.77Å; V530-I534 HydrophobicContact CG1-CG1 4.48Å; V530-I534 WeakPolarHBondContact O-CG1 3.35Å; V530-I534 PolarHBondContact O-N 3.43Å
531	C	94.2	Very high	93.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.9	-51.6	179.5	-63.1	0	0	0	0	111.5	F314 L484 F488 T527 P528 F535	F314-C531 WeakPolarHBondContact CE1-SG 3.29Å; F314-C531 VanDerWaalsContact CZ-SG 3.52Å; L484-C531 HydrophobicContact CD2-CB 4.36Å; F488-C531 HydrophobicContact CB-CB 3.92Å; T527-C531 PolarHBondContact O-N 3.25Å; T527-C531 PolarHBondContact O-SG 3.06Å; P528-C531 PolarHBondContact O-N 3.5Å; C531-F535 WeakPolarHBondContact O-CB 3.17Å; C531-F535 PolarHBondContact O-N 3.02Å
532	M	94.6	Very high	93.1	Very high	47 Å²	47	49.7 Å²	49.7	23%	0.232	26%	0.255	C	S	.	.	H	α-helix	trans	-69.1	-36.6	-178.7	-171.7	56.8	64.8	0	0	112	F488 P528 F535 I536	F488-M532 HydrophobicContact CD1-CE 3.66Å; F488-M532 HydrophobicContact CD2-CB 4.08Å; F488-M532 HydrophobicContact CD2-CE 3.75Å; F488-M532 HydrophobicContact CE1-CE 3.58Å; F488-M532 HydrophobicContact CE2-CB 4.23Å; F488-M532 HydrophobicContact CE2-CE 3.67Å; F488-M532 HydrophobicContact CG-CE 3.75Å; F488-M532 HydrophobicContact CZ-CE 3.58Å; P528-M532 VanDerWaalsContact O-CB 3.26Å; P528-M532 WeakPolarHBondContact O-CB 3.47Å; P528-M532 PolarHBondContact O-N 2.91Å; M532-F535 PolarHBondContact O-N 3.27Å; M532-F535 HydrophobicContact SD-CD1 4.03Å; M532-I536 HydrophobicContact CG-CD1 3.77Å; M532-I536 HydrophobicContact CG-CG1 4.27Å; M532-I536 WeakPolarHBondContact O-CB 3.31Å; M532-I536 VanDerWaalsContact O-CG1 3.25Å; M532-I536 WeakPolarHBondContact O-CG1 3.29Å; M532-I536 PolarHBondContact O-N 2.89Å; M532-I536 HydrophobicContact SD-CD1 4.01Å; M532-I536 HydrophobicContact SD-CG1 4Å
533	G	92.2	Very high	92.6	Very high	42 Å²	42	56.8 Å²	56.8	43%	0.433	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-48.8	176.3	0	0	0	0	0	112.5	L529 V530 F537	L529-G533 WeakPolarHBondContact O-CA 3.32Å; L529-G533 PolarHBondContact O-N 3.13Å; V530-G533 PolarHBondContact O-N 3.5Å; G533-F537 PolarHBondContact O-N 3.07Å; G533-F537 VanDerWaalsContact O-N 3.1Å
534	I	90.1	Very high	92.1	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.072	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-41.4	176.3	-62.5	171	0	0	0	110.5	I307 T311 L484 V530 F537 N538	I307-I534 HydrophobicContact CB-CG2 4.39Å; I307-I534 HydrophobicContact CG1-CG1 4.43Å; I307-I534 HydrophobicContact CG1-CG2 4.19Å; I307-I534 HydrophobicContact CG2-CG2 3.92Å; T311-I534 HydrophobicContact CG2-CG2 4.28Å; L484-I534 HydrophobicContact CD1-CB 3.88Å; L484-I534 HydrophobicContact CD1-CG2 3.37Å; L484-I534 HydrophobicContact CD2-CB 4.43Å; L484-I534 HydrophobicContact CD2-CD1 4.46Å; V530-I534 HydrophobicContact CG1-CD1 3.77Å; V530-I534 HydrophobicContact CG1-CG1 4.48Å; V530-I534 WeakPolarHBondContact O-CG1 3.35Å; V530-I534 PolarHBondContact O-N 3.43Å; I534-F537 PolarHBondContact O-N 3.41Å; I534-N538 WeakPolarHBondContact O-CB 3.45Å; I534-N538 PolarHBondContact O-N 3.27Å
535	F	91.3	Very high	91.8	Very high	27 Å²	27	59.7 Å²	59.7	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-51.4	177.5	176.9	-89.9	0	0	0	112.2	T481 W485 C531 M532 F537 N538 V539 M569	T481-F535 HydrophobicContact CG2-CD2 3.59Å; T481-F535 HydrophobicContact CG2-CE2 3.49Å; T481-F535 VanDerWaalsContact CG2-CE2 3.49Å; W485-F535 HydrophobicContact CB-CD2 4.37Å; W485-F535 HydrophobicContact CB-CE2 4.21Å; W485-F535 HydrophobicContact CE3-CE1 4.25Å; W485-F535 HydrophobicContact CE3-CE2 4.03Å; W485-F535 AromaticContact CE3-CZ 3.88Å; W485-F535 HydrophobicContact CE3-CZ 3.88Å; W485-F535 HydrophobicContact CZ3-CE1 4.41Å; W485-F535 HydrophobicContact CZ3-CZ 4.31Å; C531-F535 WeakPolarHBondContact O-CB 3.17Å; C531-F535 PolarHBondContact O-N 3.02Å; M532-F535 PolarHBondContact O-N 3.27Å; M532-F535 HydrophobicContact SD-CD1 4.03Å; F535-F537 VanDerWaalsContact C-N 3.29Å; F535-F537 PolarHBondContact O-N 3.35Å; F535-N538 PolarHBondContact O-N 3.06Å; F535-V539 HydrophobicContact CD1-CG2 4.38Å; F535-V539 HydrophobicContact CE1-CG2 3.97Å; F535-V539 HydrophobicContact CE2-CG2 4.45Å; F535-V539 HydrophobicContact CZ-CG2 3.99Å; F535-V539 WeakPolarHBondContact O-CG2 3.06Å; F535-V539 PolarHBondContact O-N 2.96Å; F535-M569 HydrophobicContact CE2-CE 3.52Å; F535-M569 HydrophobicContact CZ-CE 3.58Å
536	I	92.3	Very high	91.5	Very high	89 Å²	89	58.9 Å²	58.9	46%	0.456	31%	0.308	S	S	.	.	H	α-helix	trans	-60	-43.1	178.6	-70.8	168.9	0	0	0	110.1	M532 V539 V540	M532-I536 HydrophobicContact CG-CD1 3.77Å; M532-I536 HydrophobicContact CG-CG1 4.27Å; M532-I536 WeakPolarHBondContact O-CB 3.31Å; M532-I536 VanDerWaalsContact O-CG1 3.25Å; M532-I536 WeakPolarHBondContact O-CG1 3.29Å; M532-I536 PolarHBondContact O-N 2.89Å; M532-I536 HydrophobicContact SD-CD1 4.01Å; M532-I536 HydrophobicContact SD-CG1 4Å; I536-V539 PolarHBondContact O-N 3.28Å; I536-V540 HydrophobicContact CG2-CG2 4.03Å; I536-V540 WeakPolarHBondContact O-CB 3.18Å; I536-V540 VanDerWaalsContact O-CG2 3.27Å; I536-V540 WeakPolarHBondContact O-CG2 3.42Å; I536-V540 PolarHBondContact O-N 2.92Å
537	F	89.1	Confident	91.1	Very high	46 Å²	46	55.8 Å²	55.8	20%	0.202	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-47	177.8	-170.1	-76.5	0	0	0	111.8	P303 I307 G533 I534 F535 V539 V540 Y541	P303-F537 HydrophobicContact CB-CD2 4.39Å; P303-F537 HydrophobicContact CB-CE2 3.6Å; P303-F537 HydrophobicContact CB-CZ 3.84Å; P303-F537 HydrophobicContact CG-CE2 4.18Å; I307-F537 HydrophobicContact CD1-CB 3.98Å; I307-F537 HydrophobicContact CD1-CD1 2.98Å; I307-F537 HydrophobicContact CD1-CD2 4.01Å; I307-F537 HydrophobicContact CD1-CE1 3.24Å; I307-F537 HydrophobicContact CD1-CE2 4.22Å; I307-F537 HydrophobicContact CD1-CG 3.39Å; I307-F537 HydrophobicContact CD1-CZ 3.87Å; I307-F537 HydrophobicContact CG1-CD1 4.34Å; G533-F537 PolarHBondContact O-N 3.07Å; G533-F537 VanDerWaalsContact O-N 3.1Å; I534-F537 PolarHBondContact O-N 3.41Å; F535-F537 VanDerWaalsContact C-N 3.29Å; F535-F537 PolarHBondContact O-N 3.35Å; F537-V539 PolarHBondContact O-N 3.03Å; F537-V540 PolarHBondContact O-N 3.34Å; F537-Y541 AromaticContact CD1-CD2 3.68Å; F537-Y541 HydrophobicContact CD1-CD2 3.68Å; F537-Y541 HydrophobicContact CD1-CG 4.3Å; F537-Y541 AromaticContact CD2-CD2 3.56Å; F537-Y541 HydrophobicContact CD2-CD2 3.56Å; F537-Y541 AromaticContact CD2-CE2 3.6Å; F537-Y541 HydrophobicContact CD2-CE2 3.6Å; F537-Y541 AromaticContact CE1-CD2 3.56Å; F537-Y541 HydrophobicContact CE1-CD2 3.56Å; F537-Y541 HydrophobicContact CE1-CE2 4.34Å; F537-Y541 AromaticContact CE1-CG 3.89Å; F537-Y541 HydrophobicContact CE1-CG 3.89Å; F537-Y541 AromaticContact CE2-CD2 3.4Å; F537-Y541 HydrophobicContact CE2-CD2 3.4Å; F537-Y541 AromaticContact CE2-CE2 3.32Å; F537-Y541 HydrophobicContact CE2-CE2 3.32Å; F537-Y541 HydrophobicContact CE2-CG 4.31Å; F537-Y541 AromaticContact CG-CD2 3.71Å; F537-Y541 HydrophobicContact CG-CD2 3.71Å; F537-Y541 HydrophobicContact CG-CE2 4.22Å; F537-Y541 AromaticContact CZ-CD2 3.41Å; F537-Y541 HydrophobicContact CZ-CD2 3.41Å; F537-Y541 VanDerWaalsContact CZ-CD2 3.41Å; F537-Y541 AromaticContact CZ-CE2 3.75Å; F537-Y541 HydrophobicContact CZ-CE2 3.75Å; F537-Y541 AromaticContact CZ-CG 3.9Å; F537-Y541 HydrophobicContact CZ-CG 3.9Å; F537-Y541 PolarHBondContact O-N 3.37Å
538	N	85.7	Confident	90.3	Very high	36 Å²	36	59.8 Å²	59.8	19%	0.193	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-31.8	177.9	-75.8	-13	0	0	0	112.6	I307 T481 I534 F535 Y542	I307-N538 WeakPolarHBondContact CG2-OD1 3.35Å; T481-N538 PolarHBondContact OG1-ND2 2.94Å; I534-N538 WeakPolarHBondContact O-CB 3.45Å; I534-N538 PolarHBondContact O-N 3.27Å; F535-N538 PolarHBondContact O-N 3.06Å; N538-Y542 WeakPolarHBondContact O-CA 3.45Å; N538-Y542 PolarHBondContact O-N 3.19Å
539	V	89.1	Confident	89.5	Confident	67 Å²	67	66.6 Å²	66.6	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-78	-41.4	176.4	173.2	0	0	0	0	111.7	F535 I536 F537 Y542	F535-V539 HydrophobicContact CD1-CG2 4.38Å; F535-V539 HydrophobicContact CE1-CG2 3.97Å; F535-V539 HydrophobicContact CE2-CG2 4.45Å; F535-V539 HydrophobicContact CZ-CG2 3.99Å; F535-V539 WeakPolarHBondContact O-CG2 3.06Å; F535-V539 PolarHBondContact O-N 2.96Å; I536-V539 PolarHBondContact O-N 3.28Å; F537-V539 PolarHBondContact O-N 3.03Å; V539-Y542 WeakPolarHBondContact O-CB 3.11Å
540	V	90.3	Very high	89.1	Confident	98 Å²	98	66.2 Å²	66.2	59%	0.594	35%	0.354	S	S	*	.	H	α-helix	trans	-71.5	-41.1	-178.4	170	0	0	0	0	111.8	I536 F537	I536-V540 HydrophobicContact CG2-CG2 4.03Å; I536-V540 WeakPolarHBondContact O-CB 3.18Å; I536-V540 VanDerWaalsContact O-CG2 3.27Å; I536-V540 WeakPolarHBondContact O-CG2 3.42Å; I536-V540 PolarHBondContact O-N 2.92Å; F537-V540 PolarHBondContact O-N 3.34Å
541	Y	87.5	Confident	89	Confident	155 Å²	155	65.8 Å²	65.8	61%	0.608	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	37	178.5	-62.3	-82.9	0	0	0	111.3	F537 E543	F537-Y541 AromaticContact CD1-CD2 3.68Å; F537-Y541 HydrophobicContact CD1-CD2 3.68Å; F537-Y541 HydrophobicContact CD1-CG 4.3Å; F537-Y541 AromaticContact CD2-CD2 3.56Å; F537-Y541 HydrophobicContact CD2-CD2 3.56Å; F537-Y541 AromaticContact CD2-CE2 3.6Å; F537-Y541 HydrophobicContact CD2-CE2 3.6Å; F537-Y541 AromaticContact CE1-CD2 3.56Å; F537-Y541 HydrophobicContact CE1-CD2 3.56Å; F537-Y541 HydrophobicContact CE1-CE2 4.34Å; F537-Y541 AromaticContact CE1-CG 3.89Å; F537-Y541 HydrophobicContact CE1-CG 3.89Å; F537-Y541 AromaticContact CE2-CD2 3.4Å; F537-Y541 HydrophobicContact CE2-CD2 3.4Å; F537-Y541 AromaticContact CE2-CE2 3.32Å; F537-Y541 HydrophobicContact CE2-CE2 3.32Å; F537-Y541 HydrophobicContact CE2-CG 4.31Å; F537-Y541 AromaticContact CG-CD2 3.71Å; F537-Y541 HydrophobicContact CG-CD2 3.71Å; F537-Y541 HydrophobicContact CG-CE2 4.22Å; F537-Y541 AromaticContact CZ-CD2 3.41Å; F537-Y541 HydrophobicContact CZ-CD2 3.41Å; F537-Y541 VanDerWaalsContact CZ-CD2 3.41Å; F537-Y541 AromaticContact CZ-CE2 3.75Å; F537-Y541 HydrophobicContact CZ-CE2 3.75Å; F537-Y541 AromaticContact CZ-CG 3.9Å; F537-Y541 HydrophobicContact CZ-CG 3.9Å; F537-Y541 PolarHBondContact O-N 3.37Å; Y541-E543 PolarHBondContact O-N 3.48Å
542	Y	86.9	Confident	89.1	Confident	68 Å²	68	70.1 Å²	70.1	27%	0.267	37%	0.374	S	S	.	.			trans	-62	124.2	179	170.1	-104	0	0	0	110.8	Y475 Y476 N538 V539 P544 W562	Y475-Y542 HydrophobicContact CE1-CE2 4.4Å; Y476-Y542 HydrophobicContact CE1-CE2 4.18Å; Y476-Y542 PolarHBondContact OH-OH 2.88Å; N538-Y542 WeakPolarHBondContact O-CA 3.45Å; N538-Y542 PolarHBondContact O-N 3.19Å; V539-Y542 WeakPolarHBondContact O-CB 3.11Å; Y542-P544 HydrophobicContact CE1-CG 4.28Å; Y542-W562 HydrophobicContact CD1-CZ2 4.39Å; Y542-W562 AromaticContact CD2-CZ2 3.91Å; Y542-W562 HydrophobicContact CD2-CZ2 3.91Å; Y542-W562 HydrophobicContact CE1-CZ2 4.21Å; Y542-W562 AromaticContact CE2-CZ2 3.73Å; Y542-W562 HydrophobicContact CE2-CZ2 3.73Å; Y542-W562 HydrophobicContact CG-CZ2 4.22Å; Y542-W562 AromaticContact CZ-CZ2 3.88Å; Y542-W562 AromaticContact CZ-NE1 3.63Å; Y542-W562 PolarHBondContact OH-NE1 3.38Å
543	E	86.7	Confident	89.1	Confident	148 Å²	148	68.2 Å²	68.2	69%	0.692	37%	0.365	S	S	*	.			trans	-106.7	128.7	171	-69	-173.8	163.3	0	0	109.2	Y475 Y541	Y475-E543 PolarHBondContact OH-O 3.2Å; Y541-E543 PolarHBondContact O-N 3.48Å
544	P	89.7	Confident	89.3	Confident	63 Å²	63	67.7 Å²	67.7	41%	0.409	35%	0.354	S	S	.	.			trans	-57.3	148.7	174.8	-25.2	34.5	0	0	0	112.4	Y542 V546	Y542-P544 HydrophobicContact CE1-CG 4.28Å; P544-V546 PolarHBondContact O-N 2.85Å
545	L	90.6	Very high	89.5	Confident	9 Å²	9	76.8 Å²	76.8	5%	0.047	39%	0.387	C	S	.	.			trans	-63.2	124.6	175.6	175.3	64	0	0	0	110.1	Q471 L472 Y475 Y476 Y553	Q471-L545 HydrophobicContact CB-CD2 4.16Å; L472-L545 HydrophobicContact CD2-CD2 4.04Å; Y475-L545 HydrophobicContact CD1-CB 4.24Å; Y475-L545 HydrophobicContact CD2-CD1 3.71Å; Y475-L545 HydrophobicContact CE1-CB 4.46Å; Y475-L545 HydrophobicContact CE2-CD1 4.33Å; Y475-L545 HydrophobicContact CG-CB 4.37Å; Y475-L545 HydrophobicContact CG-CD1 3.8Å; Y475-L545 HydrophobicContact CG-CG 4.44Å; Y476-L545 HydrophobicContact CE2-CB 4.06Å; Y476-L545 HydrophobicContact CE2-CD2 4.07Å; L545-Y553 HydrophobicContact CB-CD2 4.3Å; L545-Y553 HydrophobicContact CB-CE2 4.46Å; L545-Y553 HydrophobicContact CD2-CD2 4.02Å; L545-Y553 HydrophobicContact CD2-CE1 4.12Å; L545-Y553 HydrophobicContact CD2-CE2 3.56Å; L545-Y553 HydrophobicContact CD2-CG 4.47Å; L545-Y553 HydrophobicContact CG-CD2 3.9Å; L545-Y553 HydrophobicContact CG-CE2 3.57Å; L545-Y553 VanDerWaalsContact O-CD2 3.29Å; L545-Y553 WeakPolarHBondContact O-CD2 3.1Å
546	V	91.3	Very high	89.8	Confident	65 Å²	65	79.9 Å²	79.9	39%	0.394	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.6	173.5	179.5	0	0	0	0	108.8	P544 Y551 V552	P544-V546 PolarHBondContact O-N 2.85Å; V546-Y551 WeakPolarHBondContact CA-O 3.36Å; V546-Y551 WeakPolarHBondContact CG1-O 3.37Å; V546-V552 HydrophobicContact CG2-CG2 4.46Å
547	Y	88.7	Confident	90	Very high	24 Å²	24	75.6 Å²	75.6	9%	0.094	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.5	175	179.9	-98.2	0	0	0	110.9	L221 M467 Y468 Q471 N549 T550 Y551	L221-Y547 HydrophobicContact CD1-CE1 4.3Å; L221-Y547 HydrophobicContact CD2-CE1 3.8Å; M467-Y547 HydrophobicContact CE-CE2 3.89Å; M467-Y547 HydrophobicContact CG-CE2 3.66Å; Y468-Y547 HydrophobicContact CD1-CD1 4.41Å; Y468-Y547 HydrophobicContact CD1-CG 4.39Å; Y468-Y547 AromaticContact CE1-CD1 3.71Å; Y468-Y547 HydrophobicContact CE1-CD1 3.71Å; Y468-Y547 HydrophobicContact CE1-CE1 4.36Å; Y468-Y547 HydrophobicContact CE1-CG 4.1Å; Q471-Y547 HydrophobicContact CG-CD2 4.02Å; Q471-Y547 HydrophobicContact CG-CE2 4.46Å; Y547-N549 PolarHBondContact O-N 3.16Å; Y547-N549 VanDerWaalsContact O-N 3.11Å; Y547-T550 PolarHBondContact O-N 3.03Å; Y547-T550 VanDerWaalsContact O-N 3.14Å; Y547-Y551 PolarHBondContact N-O 3.31Å; Y547-Y551 PolarHBondContact O-N 3.39Å
548	N	80.6	Confident	90.2	Very high	85 Å²	85	75.7 Å²	75.7	46%	0.455	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	37.8	179.8	-161.2	13.7	0	0	0	113.9	T550	N548-T550 PolarHBondContact O-N 3.27Å; N548-T550 PolarHBondContact O-OG1 3.41Å
549	N	80.2	Confident	90.7	Very high	153 Å²	153	76.3 Å²	76.3	82%	0.818	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	8.7	-178.5	-55.7	-44.8	0	0	0	116.3	Y547	Y547-N549 PolarHBondContact O-N 3.16Å; Y547-N549 VanDerWaalsContact O-N 3.11Å
550	T	86.8	Confident	91	Very high	113 Å²	113	77.1 Å²	77.1	69%	0.693	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	-41.2	-168.2	46.2	0	0	0	0	112.4	Y547 N548 V552	Y547-T550 PolarHBondContact O-N 3.03Å; Y547-T550 VanDerWaalsContact O-N 3.14Å; N548-T550 PolarHBondContact O-N 3.27Å; N548-T550 PolarHBondContact O-OG1 3.41Å; T550-V552 PolarHBondContact O-N 3.46Å
551	Y	92	Very high	91.3	Very high	32 Å²	32	72.4 Å²	72.4	13%	0.125	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	115.8	-178.5	179.4	-90.1	0	0	0	110.8	G223 L225 E226 Y468 V546 Y547 Y553 P554	G223-Y551 WeakPolarHBondContact O-CE2 3.07Å; L225-Y551 WeakPolarHBondContact CB-OH 3.48Å; L225-Y551 PolarHBondContact N-OH 3.48Å; E226-Y551 PolarHBondContact OE2-OH 3.45Å; Y468-Y551 AromaticContact CD1-CD1 3.65Å; Y468-Y551 HydrophobicContact CD1-CD1 3.65Å; Y468-Y551 AromaticContact CD1-CE1 3.58Å; Y468-Y551 HydrophobicContact CD1-CE1 3.58Å; Y468-Y551 HydrophobicContact CD1-CG 4.31Å; Y468-Y551 AromaticContact CE1-CD1 3.43Å; Y468-Y551 HydrophobicContact CE1-CD1 3.43Å; Y468-Y551 VanDerWaalsContact CE1-CD1 3.43Å; Y468-Y551 HydrophobicContact CE1-CD2 4.06Å; Y468-Y551 AromaticContact CE1-CE1 3.71Å; Y468-Y551 HydrophobicContact CE1-CE1 3.71Å; Y468-Y551 HydrophobicContact CE1-CE2 4.3Å; Y468-Y551 AromaticContact CE1-CG 3.62Å; Y468-Y551 HydrophobicContact CE1-CG 3.62Å; Y468-Y551 HydrophobicContact CG-CE1 4.38Å; V546-Y551 WeakPolarHBondContact CA-O 3.36Å; V546-Y551 WeakPolarHBondContact CG1-O 3.37Å; Y547-Y551 PolarHBondContact N-O 3.31Å; Y547-Y551 PolarHBondContact O-N 3.39Å; Y551-Y553 AromaticContact CD1-CD2 3.98Å; Y551-Y553 HydrophobicContact CD1-CD2 3.98Å; Y551-Y553 AromaticContact CD1-CE2 3.91Å; Y551-Y553 HydrophobicContact CD1-CE2 3.91Å; Y551-Y553 HydrophobicContact CE1-CD1 4.22Å; Y551-Y553 AromaticContact CE1-CD2 3.84Å; Y551-Y553 HydrophobicContact CE1-CD2 3.84Å; Y551-Y553 HydrophobicContact CE1-CE1 4.32Å; Y551-Y553 AromaticContact CE1-CE2 3.94Å; Y551-Y553 HydrophobicContact CE1-CE2 3.94Å; Y551-Y553 AromaticContact CE1-CG 3.98Å; Y551-Y553 HydrophobicContact CE1-CG 3.98Å; Y551-P554 WeakPolarHBondContact OH-CD 3.39Å
552	V	94.5	Very high	91.6	Very high	91 Å²	91	69.3 Å²	69.3	55%	0.552	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.9	173.5	-177.8	0	0	0	0	108.5	V546 T550	V546-V552 HydrophobicContact CG2-CG2 4.46Å; T550-V552 PolarHBondContact O-N 3.46Å
553	Y	95.7	Very high	92.1	Very high	8 Å²	8	68.8 Å²	68.8	3%	0.031	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-67.6	145.2	-178.2	-79	-108.9	0	0	0	111.1	L225 Y468 Q471 L472 L545 Y551	L225-Y553 HydrophobicContact CD2-CD1 4.01Å; L225-Y553 HydrophobicContact CD2-CE1 4.32Å; Y468-Y553 VanDerWaalsContact CA-OH 3.26Å; Y468-Y553 WeakPolarHBondContact CA-OH 3.27Å; Y468-Y553 PolarHBondContact O-OH 3.24Å; Y468-Y553 VanDerWaalsContact O-OH 3.14Å; Q471-Y553 VanDerWaalsContact CB-OH 3.26Å; Q471-Y553 WeakPolarHBondContact CB-OH 3.37Å; L472-Y553 HydrophobicContact CD1-CD1 4.4Å; L472-Y553 HydrophobicContact CD1-CE1 4.22Å; L472-Y553 HydrophobicContact CD2-CD1 3.86Å; L472-Y553 HydrophobicContact CD2-CE1 3.91Å; L472-Y553 HydrophobicContact CG-CD1 4.13Å; L472-Y553 HydrophobicContact CG-CE1 3.75Å; L545-Y553 HydrophobicContact CB-CD2 4.3Å; L545-Y553 HydrophobicContact CB-CE2 4.46Å; L545-Y553 HydrophobicContact CD2-CD2 4.02Å; L545-Y553 HydrophobicContact CD2-CE1 4.12Å; L545-Y553 HydrophobicContact CD2-CE2 3.56Å; L545-Y553 HydrophobicContact CD2-CG 4.47Å; L545-Y553 HydrophobicContact CG-CD2 3.9Å; L545-Y553 HydrophobicContact CG-CE2 3.57Å; L545-Y553 VanDerWaalsContact O-CD2 3.29Å; L545-Y553 WeakPolarHBondContact O-CD2 3.1Å; Y551-Y553 AromaticContact CD1-CD2 3.98Å; Y551-Y553 HydrophobicContact CD1-CD2 3.98Å; Y551-Y553 AromaticContact CD1-CE2 3.91Å; Y551-Y553 HydrophobicContact CD1-CE2 3.91Å; Y551-Y553 HydrophobicContact CE1-CD1 4.22Å; Y551-Y553 AromaticContact CE1-CD2 3.84Å; Y551-Y553 HydrophobicContact CE1-CD2 3.84Å; Y551-Y553 HydrophobicContact CE1-CE1 4.32Å; Y551-Y553 AromaticContact CE1-CE2 3.94Å; Y551-Y553 HydrophobicContact CE1-CE2 3.94Å; Y551-Y553 AromaticContact CE1-CG 3.98Å; Y551-Y553 HydrophobicContact CE1-CG 3.98Å
554	P	96	Very high	92.5	Very high	31 Å²	31	63.4 Å²	63.4	20%	0.201	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-64.6	152.9	170.7	29.1	-35.3	0	0	0	110	L225 Y551 W556 G557 E558	L225-P554 HydrophobicContact CD2-CG 4.4Å; Y551-P554 WeakPolarHBondContact OH-CD 3.39Å; P554-W556 HydrophobicContact CB-CG 4.42Å; P554-W556 HydrophobicContact CG-CD2 4.08Å; P554-W556 VanDerWaalsContact CG-CE2 3.45Å; P554-W556 HydrophobicContact CG-CG 4.42Å; P554-W556 HydrophobicContact CG-CZ2 3.73Å; P554-W556 PolarHBondContact O-N 3.3Å; P554-G557 WeakPolarHBondContact O-CA 3.4Å; P554-G557 PolarHBondContact O-N 2.92Å; P554-E558 PolarHBondContact O-N 3.26Å
555	W	95.4	Very high	92.8	Very high	204 Å²	204	60.7 Å²	60.7	77%	0.773	31%	0.314	S	S	*	.	H	α-helix	trans	-51.3	-34.2	-177	71	-92.7	0	0	0	113.8	A559	W555-A559 WeakPolarHBondContact O-CB 3.34Å; W555-A559 PolarHBondContact O-N 3.3Å
556	W	96.3	Very high	93.1	Very high	92 Å²	92	63.7 Å²	63.7	35%	0.348	33%	0.329	S	S	.	.	H	α-helix	trans	-74	-29.1	178.9	62.9	-100.5	0	0	0	112.1	L225 E226 P554 A559 M560	L225-W556 HydrophobicContact CB-CH2 4.3Å; L225-W556 HydrophobicContact CD2-CE3 4.22Å; L225-W556 HydrophobicContact CD2-CH2 3.35Å; L225-W556 HydrophobicContact CD2-CZ2 4.03Å; L225-W556 HydrophobicContact CD2-CZ3 3.43Å; L225-W556 VanDerWaalsContact CD2-CZ3 3.43Å; L225-W556 HydrophobicContact CG-CH2 3.49Å; L225-W556 VanDerWaalsContact CG-CH2 3.49Å; L225-W556 HydrophobicContact CG-CZ2 4.22Å; L225-W556 HydrophobicContact CG-CZ3 4.01Å; E226-W556 HydrophobicContact CB-CZ2 4.32Å; P554-W556 HydrophobicContact CB-CG 4.42Å; P554-W556 HydrophobicContact CG-CD2 4.08Å; P554-W556 VanDerWaalsContact CG-CE2 3.45Å; P554-W556 HydrophobicContact CG-CG 4.42Å; P554-W556 HydrophobicContact CG-CZ2 3.73Å; P554-W556 PolarHBondContact O-N 3.3Å; W556-A559 PolarHBondContact O-N 3.08Å; W556-M560 HydrophobicContact CE3-SD 3.63Å; W556-M560 HydrophobicContact CZ3-SD 3.63Å; W556-M560 WeakPolarHBondContact O-CB 3.23Å; W556-M560 VanDerWaalsContact O-CG 3.29Å; W556-M560 WeakPolarHBondContact O-CG 3.17Å; W556-M560 PolarHBondContact O-N 3.36Å
557	G	96.5	Very high	93.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.5	-42.9	172.8	0	0	0	0	0	111.1	L472 P554 M560 G561	L472-G557 VanDerWaalsContact CD2-O 3.3Å; L472-G557 WeakPolarHBondContact CD2-O 3.08Å; P554-G557 WeakPolarHBondContact O-CA 3.4Å; P554-G557 PolarHBondContact O-N 2.92Å; G557-M560 WeakPolarHBondContact O-CB 3.18Å; G557-M560 PolarHBondContact O-N 3.09Å; G557-G561 PolarHBondContact O-N 2.7Å
558	E	94.2	Very high	93.8	Very high	48 Å²	48	61.6 Å²	61.6	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-44.1	170.8	-67.4	-176.3	-176.1	0	0	111.8	P554 M560 G561 W562	P554-E558 PolarHBondContact O-N 3.26Å; E558-M560 VanDerWaalsContact C-N 3.29Å; E558-M560 PolarHBondContact O-N 2.89Å; E558-G561 WeakPolarHBondContact O-CA 3.33Å; E558-G561 PolarHBondContact O-N 2.96Å; E558-G561 VanDerWaalsContact O-N 3.11Å; E558-W562 PolarHBondContact O-N 3.41Å
559	A	96.3	Very high	94.5	Very high	49 Å²	49	58.5 Å²	58.5	41%	0.405	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-38.8	176	0	0	0	0	0	112.2	W555 W556 A563	W555-A559 WeakPolarHBondContact O-CB 3.34Å; W555-A559 PolarHBondContact O-N 3.3Å; W556-A559 PolarHBondContact O-N 3.08Å; A559-A563 WeakPolarHBondContact O-CB 3.5Å; A559-A563 PolarHBondContact O-N 2.99Å
560	M	95.8	Very high	95.4	Very high	83 Å²	83	54.8 Å²	54.8	41%	0.409	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-42.8	172.2	-76.9	178.6	61.8	0	0	112.1	W556 G557 E558 A563 F564	W556-M560 HydrophobicContact CE3-SD 3.63Å; W556-M560 HydrophobicContact CZ3-SD 3.63Å; W556-M560 WeakPolarHBondContact O-CB 3.23Å; W556-M560 VanDerWaalsContact O-CG 3.29Å; W556-M560 WeakPolarHBondContact O-CG 3.17Å; W556-M560 PolarHBondContact O-N 3.36Å; G557-M560 WeakPolarHBondContact O-CB 3.18Å; G557-M560 PolarHBondContact O-N 3.09Å; E558-M560 VanDerWaalsContact C-N 3.29Å; E558-M560 PolarHBondContact O-N 2.89Å; M560-A563 WeakPolarHBondContact O-CB 3.15Å; M560-A563 PolarHBondContact O-N 3.12Å; M560-F564 PolarHBondContact O-N 2.91Å
561	G	95.2	Very high	95.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.3	-52.2	173.8	0	0	0	0	0	112	Y476 G557 E558 A563 F564 A565	Y476-G561 WeakPolarHBondContact CB-O 3.1Å; Y476-G561 VanDerWaalsContact CD2-CA 3.44Å; Y476-G561 VanDerWaalsContact CG-C 3.47Å; Y476-G561 VanDerWaalsContact CG-CA 3.41Å; G557-G561 PolarHBondContact O-N 2.7Å; E558-G561 WeakPolarHBondContact O-CA 3.33Å; E558-G561 PolarHBondContact O-N 2.96Å; E558-G561 VanDerWaalsContact O-N 3.11Å; G561-A563 VanDerWaalsContact C-N 3.28Å; G561-A563 PolarHBondContact O-N 2.85Å; G561-F564 WeakPolarHBondContact O-CB 3.49Å; G561-F564 PolarHBondContact O-N 2.85Å; G561-A565 PolarHBondContact O-N 2.04Å
562	W	94.9	Very high	96.2	Very high	90 Å²	90	49.1 Å²	49.1	34%	0.341	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-35.3	175.3	-80.7	104	0	0	0	113	Y542 E558 F564 A565 L566	Y542-W562 HydrophobicContact CD1-CZ2 4.39Å; Y542-W562 AromaticContact CD2-CZ2 3.91Å; Y542-W562 HydrophobicContact CD2-CZ2 3.91Å; Y542-W562 HydrophobicContact CE1-CZ2 4.21Å; Y542-W562 AromaticContact CE2-CZ2 3.73Å; Y542-W562 HydrophobicContact CE2-CZ2 3.73Å; Y542-W562 HydrophobicContact CG-CZ2 4.22Å; Y542-W562 AromaticContact CZ-CZ2 3.88Å; Y542-W562 AromaticContact CZ-NE1 3.63Å; Y542-W562 PolarHBondContact OH-NE1 3.38Å; E558-W562 PolarHBondContact O-N 3.41Å; W562-F564 VanDerWaalsContact C-N 3.35Å; W562-A565 PolarHBondContact O-N 3.11Å; W562-L566 VanDerWaalsContact O-CB 3.31Å; W562-L566 WeakPolarHBondContact O-CB 3.22Å; W562-L566 VanDerWaalsContact O-CG 3.24Å; W562-L566 WeakPolarHBondContact O-CG 3.27Å; W562-L566 PolarHBondContact O-N 3.42Å
563	A	97	Very high	96.3	Very high	57 Å²	57	47.1 Å²	47.1	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-62.6	-40.1	173.1	0	0	0	0	0	112	A559 M560 G561 S567	A559-A563 WeakPolarHBondContact O-CB 3.5Å; A559-A563 PolarHBondContact O-N 2.99Å; M560-A563 WeakPolarHBondContact O-CB 3.15Å; M560-A563 PolarHBondContact O-N 3.12Å; G561-A563 VanDerWaalsContact C-N 3.28Å; G561-A563 PolarHBondContact O-N 2.85Å; A563-S567 VanDerWaalsContact O-CB 3.29Å; A563-S567 WeakPolarHBondContact O-CB 3.42Å; A563-S567 PolarHBondContact O-N 3.17Å
564	F	95.7	Very high	96.4	Very high	35 Å²	35	51.9 Å²	51.9	15%	0.154	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-48.6	173.2	-65.2	-34.5	0	0	0	111.9	Y143 L472 F473 M560 G561 W562 L566 S567	Y143-F564 HydrophobicContact CE1-CD1 4.46Å; Y143-F564 HydrophobicContact CE2-CB 4.47Å; L472-F564 HydrophobicContact CB-CE2 4.34Å; F473-F564 AromaticContact CD2-CE2 3.87Å; F473-F564 HydrophobicContact CD2-CE2 3.87Å; F473-F564 HydrophobicContact CD2-CZ 4.24Å; F473-F564 HydrophobicContact CE1-CZ 4.39Å; F473-F564 AromaticContact CE2-CE2 3.75Å; F473-F564 HydrophobicContact CE2-CE2 3.75Å; F473-F564 AromaticContact CE2-CZ 3.63Å; F473-F564 HydrophobicContact CE2-CZ 3.63Å; F473-F564 HydrophobicContact CG-CE2 4.38Å; F473-F564 HydrophobicContact CZ-CE1 4.21Å; F473-F564 HydrophobicContact CZ-CE2 4.15Å; F473-F564 AromaticContact CZ-CZ 3.72Å; F473-F564 HydrophobicContact CZ-CZ 3.72Å; M560-F564 PolarHBondContact O-N 2.91Å; G561-F564 WeakPolarHBondContact O-CB 3.49Å; G561-F564 PolarHBondContact O-N 2.85Å; W562-F564 VanDerWaalsContact C-N 3.35Å; F564-L566 PolarHBondContact O-N 3.46Å; F564-S567 PolarHBondContact O-N 2.99Å; F564-S567 PolarHBondContact O-OG 3Å
565	A	95.1	Very high	96.5	Very high	6 Å²	6	52.8 Å²	52.8	5%	0.05	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-47.9	178.4	0	0	0	0	0	111.9	Y476 T482 G561 W562 S567 S568 M569	Y476-A565 WeakPolarHBondContact O-CB 3.46Å; T482-A565 HydrophobicContact CG2-CB 4.1Å; G561-A565 PolarHBondContact O-N 2.04Å; W562-A565 PolarHBondContact O-N 3.11Å; A565-S567 VanDerWaalsContact C-N 3.3Å; A565-S567 PolarHBondContact O-N 3.08Å; A565-S568 PolarHBondContact O-OG 2.94Å; A565-M569 HydrophobicContact CB-SD 4.41Å; A565-M569 VanDerWaalsContact O-CG 3.25Å; A565-M569 WeakPolarHBondContact O-CG 3.33Å; A565-M569 PolarHBondContact O-N 3.26Å
566	L	96.5	Very high	96.6	Very high	72 Å²	72	44.7 Å²	44.7	38%	0.377	24%	0.241	S	C	.	.	H	α-helix	trans	-67.7	-29.2	-179.1	-70.5	173	0	0	0	112.8	W562 F564 S568 M569 L570	W562-L566 VanDerWaalsContact O-CB 3.31Å; W562-L566 WeakPolarHBondContact O-CB 3.22Å; W562-L566 VanDerWaalsContact O-CG 3.24Å; W562-L566 WeakPolarHBondContact O-CG 3.27Å; W562-L566 PolarHBondContact O-N 3.42Å; F564-L566 PolarHBondContact O-N 3.46Å; L566-S568 VanDerWaalsContact C-N 3.26Å; L566-S568 PolarHBondContact O-N 2.88Å; L566-M569 PolarHBondContact O-N 3.31Å; L566-L570 HydrophobicContact CB-CD1 4Å; L566-L570 HydrophobicContact CB-CG 4.26Å; L566-L570 HydrophobicContact CD2-CD1 4.46Å; L566-L570 HydrophobicContact CD2-CG 4.29Å; L566-L570 WeakPolarHBondContact O-CB 3.47Å; L566-L570 VanDerWaalsContact O-CG 3.26Å; L566-L570 WeakPolarHBondContact O-CG 3.3Å; L566-L570 PolarHBondContact O-N 2.97Å
567	S	97.3	Very high	96.6	Very high	43 Å²	43	44.6 Å²	44.6	30%	0.301	25%	0.246	S	C	.	.	H	α-helix	trans	-60.3	-33.5	-178.2	70.2	0	0	0	0	113.4	Y143 A563 F564 A565 C571	Y143-S567 VanDerWaalsContact CE2-OG 3.26Å; Y143-S567 WeakPolarHBondContact CE2-OG 3.3Å; Y143-S567 PolarHBondContact OH-OG 3.18Å; A563-S567 VanDerWaalsContact O-CB 3.29Å; A563-S567 WeakPolarHBondContact O-CB 3.42Å; A563-S567 PolarHBondContact O-N 3.17Å; F564-S567 PolarHBondContact O-N 2.99Å; F564-S567 PolarHBondContact O-OG 3Å; A565-S567 VanDerWaalsContact C-N 3.3Å; A565-S567 PolarHBondContact O-N 3.08Å; S567-C571 PolarHBondContact O-SG 3.5Å
568	S	97.1	Very high	96.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.007	26%	0.258	C	S	.	.	H	α-helix	trans	-89.1	-45.2	172.6	59.1	0	0	0	0	112.2	A136 I140 A565 L566 L570 C571	A136-S568 VanDerWaalsContact CB-O 3.32Å; A136-S568 WeakPolarHBondContact CB-O 3.35Å; I140-S568 VanDerWaalsContact CG1-CB 3.48Å; A565-S568 PolarHBondContact O-OG 2.94Å; L566-S568 VanDerWaalsContact C-N 3.26Å; L566-S568 PolarHBondContact O-N 2.88Å; S568-L570 VanDerWaalsContact C-N 3.28Å; S568-L570 PolarHBondContact O-N 3.43Å; S568-C571 VanDerWaalsContact O-CB 3.27Å; S568-C571 WeakPolarHBondContact O-CB 3.4Å; S568-C571 PolarHBondContact O-N 2.93Å
569	M	96.6	Very high	96.8	Very high	21 Å²	21	45 Å²	45	10%	0.103	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-37.2	-175.4	-69.1	172.6	63.5	0	0	112.7	T482 W485 F535 A565 L566 C571 P573	T482-M569 HydrophobicContact CG2-CG 4.1Å; T482-M569 HydrophobicContact CG2-SD 4.11Å; W485-M569 HydrophobicContact CB-CE 4.41Å; W485-M569 HydrophobicContact CB-CG 4.33Å; W485-M569 HydrophobicContact CD2-CE 4.06Å; W485-M569 HydrophobicContact CE3-CE 4.26Å; W485-M569 HydrophobicContact CG-CB 4.4Å; W485-M569 HydrophobicContact CG-CE 4.14Å; W485-M569 HydrophobicContact CG-CG 4Å; W485-M569 PolarHBondContact NE1-O 3.4Å; F535-M569 HydrophobicContact CE2-CE 3.52Å; F535-M569 HydrophobicContact CZ-CE 3.58Å; A565-M569 HydrophobicContact CB-SD 4.41Å; A565-M569 VanDerWaalsContact O-CG 3.25Å; A565-M569 WeakPolarHBondContact O-CG 3.33Å; A565-M569 PolarHBondContact O-N 3.26Å; L566-M569 PolarHBondContact O-N 3.31Å; M569-C571 VanDerWaalsContact C-N 3.3Å; M569-C571 PolarHBondContact O-N 3.04Å; M569-P573 VanDerWaalsContact O-CD 3.24Å; M569-P573 WeakPolarHBondContact O-CD 3.5Å
570	L	97.8	Very high	96.7	Very high	74 Å²	74	44.1 Å²	44.1	39%	0.387	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-14.7	179.6	-66.5	177.3	0	0	0	113.4	L566 S568 V572 P573 L574	L566-L570 HydrophobicContact CB-CD1 4Å; L566-L570 HydrophobicContact CB-CG 4.26Å; L566-L570 HydrophobicContact CD2-CD1 4.46Å; L566-L570 HydrophobicContact CD2-CG 4.29Å; L566-L570 WeakPolarHBondContact O-CB 3.47Å; L566-L570 VanDerWaalsContact O-CG 3.26Å; L566-L570 WeakPolarHBondContact O-CG 3.3Å; L566-L570 PolarHBondContact O-N 2.97Å; S568-L570 VanDerWaalsContact C-N 3.28Å; S568-L570 PolarHBondContact O-N 3.43Å; L570-V572 PolarHBondContact O-N 2.97Å; L570-P573 HydrophobicContact CD2-CG 4.29Å; L570-P573 WeakPolarHBondContact O-CD 3.33Å; L570-L574 HydrophobicContact CB-CD1 3.8Å; L570-L574 HydrophobicContact CB-CG 4.14Å; L570-L574 WeakPolarHBondContact O-CB 3.43Å; L570-L574 WeakPolarHBondContact O-CG 3.47Å; L570-L574 PolarHBondContact O-N 3.25Å
571	C	98.3	Very high	96.7	Very high	26 Å²	26	46 Å²	46	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-56.6	-38.5	177	-68.1	0	0	0	0	112	G132 A136 S567 S568 M569 H575	G132-C571 WeakPolarHBondContact CA-O 3.3Å; G132-C571 WeakPolarHBondContact O-CB 3.29Å; A136-C571 HydrophobicContact CB-CB 3.96Å; S567-C571 PolarHBondContact O-SG 3.5Å; S568-C571 VanDerWaalsContact O-CB 3.27Å; S568-C571 WeakPolarHBondContact O-CB 3.4Å; S568-C571 PolarHBondContact O-N 2.93Å; M569-C571 VanDerWaalsContact C-N 3.3Å; M569-C571 PolarHBondContact O-N 3.04Å; C571-H575 WeakPolarHBondContact O-CB 3.39Å; C571-H575 PolarHBondContact O-N 3.13Å; C571-H575 VanDerWaalsContact O-N 3.14Å
572	V	97.7	Very high	96.8	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-66.1	-62.8	179.8	-175.2	0	0	0	0	111.9	F130 L133 A136 W489 L570 L574 H575 L576	F130-V572 HydrophobicContact CD1-CG1 4.39Å; L133-V572 HydrophobicContact CD2-CG2 3.87Å; L133-V572 HydrophobicContact CG-CG2 4.07Å; A136-V572 HydrophobicContact CB-CG2 4.41Å; W489-V572 HydrophobicContact CD2-CG1 3.99Å; W489-V572 HydrophobicContact CE3-CG1 4.47Å; W489-V572 HydrophobicContact CG-CG1 4Å; L570-V572 PolarHBondContact O-N 2.97Å; V572-L574 PolarHBondContact O-N 3.33Å; V572-H575 PolarHBondContact O-N 3.5Å; V572-L576 WeakPolarHBondContact O-CB 3.41Å; V572-L576 PolarHBondContact O-N 3.11Å; V572-L576 VanDerWaalsContact O-N 3.08Å
573	P	97.6	Very high	96.7	Very high	49 Å²	49	53 Å²	53	32%	0.318	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-36.8	-177.4	26.3	-35.8	0	0	0	113.2	M569 L570 L576 L577	M569-P573 VanDerWaalsContact O-CD 3.24Å; M569-P573 WeakPolarHBondContact O-CD 3.5Å; L570-P573 HydrophobicContact CD2-CG 4.29Å; L570-P573 WeakPolarHBondContact O-CD 3.33Å; P573-L576 PolarHBondContact O-N 2.64Å; P573-L577 VanDerWaalsContact O-CB 3.29Å; P573-L577 WeakPolarHBondContact O-CB 3.47Å; P573-L577 PolarHBondContact O-N 3Å
574	L	98.1	Very high	96.5	Very high	108 Å²	108	59.6 Å²	59.6	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-68.8	-40.9	-179.6	-66.8	178.6	0	0	0	112	L570 V572 G578	L570-L574 HydrophobicContact CB-CD1 3.8Å; L570-L574 HydrophobicContact CB-CG 4.14Å; L570-L574 WeakPolarHBondContact O-CB 3.43Å; L570-L574 WeakPolarHBondContact O-CG 3.47Å; L570-L574 PolarHBondContact O-N 3.25Å; V572-L574 PolarHBondContact O-N 3.33Å; L574-G578 PolarHBondContact O-N 2.97Å
575	H	98.1	Very high	96.5	Very high	49 Å²	49	59.8 Å²	59.8	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-46.3	175.6	-174.1	86.7	0	0	0	111.1	L129 G132 Y135 C571 V572 L577 G578 C579	L129-H575 PolarHBondContact O-CD2 2.8Å; G132-H575 PolarHBondContact N-CD2 3.21Å; Y135-H575 AromaticContact CE2-ND1 3.99Å; C571-H575 WeakPolarHBondContact O-CB 3.39Å; C571-H575 PolarHBondContact O-N 3.13Å; C571-H575 VanDerWaalsContact O-N 3.14Å; V572-H575 PolarHBondContact O-N 3.5Å; H575-L577 PolarHBondContact O-N 3.37Å; H575-G578 PolarHBondContact O-N 2.84Å; H575-C579 PolarHBondContact NE2-SG 3.29Å; H575-C579 VanDerWaalsContact NE2-SG 3.39Å; H575-C579 WeakPolarHBondContact O-CB 3Å; H575-C579 PolarHBondContact O-N 3.4Å; H575-C579 PolarHBondContact O-SG 2.99Å
576	L	97.2	Very high	96.4	Very high	35 Å²	35	63.3 Å²	63.3	18%	0.183	34%	0.338	C	S	.	.	H	α-helix	trans	-56.6	-51.2	177.2	179.6	152.3	0	0	0	111.2	L129 F130 V572 P573 C579 L580	L129-L576 HydrophobicContact CD1-CG 4.04Å; L129-L576 HydrophobicContact CD2-CG 4.48Å; L129-L576 HydrophobicContact CG-CD1 4.37Å; L129-L576 HydrophobicContact CG-CG 4.11Å; F130-L576 HydrophobicContact CD1-CD1 4.08Å; F130-L576 HydrophobicContact CE1-CD1 3.43Å; F130-L576 VanDerWaalsContact CE1-CD1 3.43Å; F130-L576 HydrophobicContact CE2-CD1 4.36Å; F130-L576 HydrophobicContact CZ-CD1 3.6Å; V572-L576 WeakPolarHBondContact O-CB 3.41Å; V572-L576 PolarHBondContact O-N 3.11Å; V572-L576 VanDerWaalsContact O-N 3.08Å; P573-L576 PolarHBondContact O-N 2.64Å; L576-C579 PolarHBondContact O-N 3.21Å; L576-L580 HydrophobicContact CD2-CD1 3.6Å; L576-L580 HydrophobicContact CD2-CG 4.45Å; L576-L580 HydrophobicContact CG-CD1 4.41Å; L576-L580 WeakPolarHBondContact O-CG 3.28Å; L576-L580 PolarHBondContact O-N 3.5Å
577	L	96.5	Very high	96.3	Very high	90 Å²	90	65.9 Å²	65.9	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-44.2	179.4	-178.6	61.9	0	0	0	111.3	P573 H575 C579 L580 L581	P573-L577 VanDerWaalsContact O-CB 3.29Å; P573-L577 WeakPolarHBondContact O-CB 3.47Å; P573-L577 PolarHBondContact O-N 3Å; H575-L577 PolarHBondContact O-N 3.37Å; L577-C579 VanDerWaalsContact C-N 3.33Å; L577-C579 PolarHBondContact O-N 3.13Å; L577-L580 PolarHBondContact O-N 3.39Å; L577-L581 HydrophobicContact CD1-CD1 4.03Å; L577-L581 HydrophobicContact CD1-CG 4.03Å; L577-L581 HydrophobicContact CD2-CD1 4.5Å; L577-L581 HydrophobicContact CG-CD1 3.85Å; L577-L581 HydrophobicContact CG-CG 4.27Å; L577-L581 WeakPolarHBondContact O-CB 3.37Å; L577-L581 VanDerWaalsContact O-CG 3.24Å; L577-L581 WeakPolarHBondContact O-CG 3.4Å; L577-L581 PolarHBondContact O-N 3.43Å
578	G	97.2	Very high	96.1	Very high	24 Å²	24	67.3 Å²	67.3	25%	0.247	36%	0.364	C	S	.	.	H	α-helix	trans	-59.6	-40.9	177.5	0	0	0	0	0	113.1	L574 H575 R582	L574-G578 PolarHBondContact O-N 2.97Å; H575-G578 PolarHBondContact O-N 2.84Å; G578-R582 WeakPolarHBondContact O-CB 3.45Å; G578-R582 VanDerWaalsContact O-CG 3.27Å; G578-R582 WeakPolarHBondContact O-CG 3.47Å; G578-R582 PolarHBondContact O-N 2.96Å; G578-R582 VanDerWaalsContact O-N 3.15Å
579	C	96.7	Very high	96	Very high	31 Å²	31	72.3 Å²	72.3	21%	0.209	39%	0.388	C	S	.	.	H	α-helix	trans	-67.2	-45.4	175.7	-75.6	0	0	0	0	112	L129 H575 L576 L577 L581 R582 A583 L594	L129-C579 HydrophobicContact CD1-CB 3.88Å; H575-C579 PolarHBondContact NE2-SG 3.29Å; H575-C579 VanDerWaalsContact NE2-SG 3.39Å; H575-C579 WeakPolarHBondContact O-CB 3Å; H575-C579 PolarHBondContact O-N 3.4Å; H575-C579 PolarHBondContact O-SG 2.99Å; L576-C579 PolarHBondContact O-N 3.21Å; L577-C579 VanDerWaalsContact C-N 3.33Å; L577-C579 PolarHBondContact O-N 3.13Å; C579-L581 VanDerWaalsContact C-N 3.33Å; C579-L581 PolarHBondContact O-N 3.37Å; C579-R582 PolarHBondContact O-N 3.26Å; C579-A583 WeakPolarHBondContact O-CB 3.39Å; C579-A583 PolarHBondContact O-N 2.75Å; C579-L594 HydrophobicContact CB-CD1 4.19Å; C579-L594 HydrophobicContact CB-CD2 4.47Å
580	L	95.3	Very high	96	Very high	32 Å²	32	73.7 Å²	73.7	17%	0.168	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-37.7	176.9	-72.4	176	0	0	0	112.7	L129 L576 L577 R590 L594	L129-L580 HydrophobicContact CD1-CD2 4.31Å; L129-L580 HydrophobicContact CD1-CG 4.1Å; L576-L580 HydrophobicContact CD2-CD1 3.6Å; L576-L580 HydrophobicContact CD2-CG 4.45Å; L576-L580 HydrophobicContact CG-CD1 4.41Å; L576-L580 WeakPolarHBondContact O-CG 3.28Å; L576-L580 PolarHBondContact O-N 3.5Å; L577-L580 PolarHBondContact O-N 3.39Å; L580-R590 HydrophobicContact CD2-CB 4.34Å; L580-R590 WeakPolarHBondContact O-CD 3.08Å; L580-R590 PolarHBondContact O-NH1 3.32Å; L580-L594 HydrophobicContact CD2-CD1 4.03Å
581	L	95.5	Very high	95.9	Very high	121 Å²	121	75.8 Å²	75.8	63%	0.634	40%	0.395	S	S	*	.	H	α-helix	trans	-71.5	-33.1	178.9	-70.9	175.4	0	0	0	112.7	L577 C579	L577-L581 HydrophobicContact CD1-CD1 4.03Å; L577-L581 HydrophobicContact CD1-CG 4.03Å; L577-L581 HydrophobicContact CD2-CD1 4.5Å; L577-L581 HydrophobicContact CG-CD1 3.85Å; L577-L581 HydrophobicContact CG-CG 4.27Å; L577-L581 WeakPolarHBondContact O-CB 3.37Å; L577-L581 VanDerWaalsContact O-CG 3.24Å; L577-L581 WeakPolarHBondContact O-CG 3.4Å; L577-L581 PolarHBondContact O-N 3.43Å; C579-L581 VanDerWaalsContact C-N 3.33Å; C579-L581 PolarHBondContact O-N 3.37Å
582	R	95.8	Very high	95.7	Very high	220 Å²	220	80.7 Å²	80.7	83%	0.83	42%	0.415	S	S	*	.	H	α-helix	trans	-84.9	-27.1	-179.2	-71.3	175.7	-178.4	176.5	2	113.8	G578 C579	G578-R582 WeakPolarHBondContact O-CB 3.45Å; G578-R582 VanDerWaalsContact O-CG 3.27Å; G578-R582 WeakPolarHBondContact O-CG 3.47Å; G578-R582 PolarHBondContact O-N 2.96Å; G578-R582 VanDerWaalsContact O-N 3.15Å; C579-R582 PolarHBondContact O-N 3.26Å
583	A	94	Very high	95.5	Very high	19 Å²	19	86.7 Å²	86.7	16%	0.157	44%	0.442	C	S	.	.	S	Bend	trans	-68.5	144.3	178.9	0	0	0	0	0	111.7	C579 R590 L594	C579-A583 WeakPolarHBondContact O-CB 3.39Å; C579-A583 PolarHBondContact O-N 2.75Å; A583-R590 HydrophobicContact CB-CB 4.12Å; A583-R590 HydrophobicContact CB-CG 3.72Å; A583-R590 PolarHBondContact O-NE 3.37Å; A583-R590 VanDerWaalsContact O-NE 3.09Å; A583-R590 PolarHBondContact O-NH1 3.03Å; A583-L594 HydrophobicContact CB-CD1 3.78Å; A583-L594 HydrophobicContact CB-CD2 4.46Å; A583-L594 HydrophobicContact CB-CG 4.31Å
584	K	93	Very high	95.4	Very high	195 Å²	195	85.7 Å²	85.7	85%	0.848	44%	0.435	S	S	*	.			trans	-92.5	158.5	178.1	-63.4	-177.8	-179.6	179.6	0	110.3	R590	K584-R590 WeakPolarHBondContact O-CG 3.46Å
585	G	94.3	Very high	95.3	Very high	39 Å²	39	81.7 Å²	81.7	40%	0.402	42%	0.415	S	S	.	.	S	Bend	trans	100.2	-173.9	-178.7	0	0	0	0	0	113.5	E589 R590	G585-E589 WeakPolarHBondContact CA-OE2 3.35Å; G585-R590 VanDerWaalsContact O-CZ 3.31Å; G585-R590 PolarHBondContact O-NE 3.34Å; G585-R590 PolarHBondContact O-NH2 3.27Å
586	T	94.9	Very high	95.1	Very high	80 Å²	80	84.2 Å²	84.2	49%	0.491	43%	0.426	S	S	.	.			trans	-69.9	163.1	173.1	63.9	0	0	0	0	111.4	A588 E589 R590	T586-A588 PolarHBondContact O-N 3.28Å; T586-E589 PolarHBondContact N-OE2 3.33Å; T586-E589 PolarHBondContact O-N 2.99Å; T586-E589 VanDerWaalsContact OG1-CD 3.3Å; T586-E589 VanDerWaalsContact OG1-CG 3.26Å; T586-E589 WeakPolarHBondContact OG1-CG 3.49Å; T586-E589 PolarHBondContact OG1-N 3.08Å; T586-E589 PolarHBondContact OG1-OE2 3.24Å; T586-R590 VanDerWaalsContact O-CG 3.26Å; T586-R590 WeakPolarHBondContact O-CG 3.2Å; T586-R590 PolarHBondContact O-N 3.34Å
587	M	92.8	Very high	95	Very high	126 Å²	126	83.8 Å²	83.8	62%	0.621	43%	0.425	S	S	*	.	H	α-helix	trans	-59.2	-36.2	178.8	-72.2	-61.5	163.7	0	0	112.9	W591	M587-W591 WeakPolarHBondContact O-CB 3.32Å; M587-W591 PolarHBondContact O-N 3.48Å
588	A	93.9	Very high	94.8	Very high	73 Å²	73	83.8 Å²	83.8	60%	0.603	43%	0.425	S	S	*	.	H	α-helix	trans	-66.1	-45.4	176.5	0	0	0	0	0	112.1	T586 W591 Q592	T586-A588 PolarHBondContact O-N 3.28Å; A588-W591 PolarHBondContact O-N 3.25Å; A588-Q592 WeakPolarHBondContact O-CB 3.38Å; A588-Q592 PolarHBondContact O-N 2.86Å
589	E	95.2	Very high	94.5	Very high	105 Å²	105	86.3 Å²	86.3	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-43	177	-70.3	165.3	149.1	0	0	111.7	G585 T586 Q592 H593	G585-E589 WeakPolarHBondContact CA-OE2 3.35Å; T586-E589 PolarHBondContact N-OE2 3.33Å; T586-E589 PolarHBondContact O-N 2.99Å; T586-E589 VanDerWaalsContact OG1-CD 3.3Å; T586-E589 VanDerWaalsContact OG1-CG 3.26Å; T586-E589 WeakPolarHBondContact OG1-CG 3.49Å; T586-E589 PolarHBondContact OG1-N 3.08Å; T586-E589 PolarHBondContact OG1-OE2 3.24Å; E589-Q592 PolarHBondContact O-N 3.13Å; E589-H593 VanDerWaalsContact O-CB 3.27Å; E589-H593 WeakPolarHBondContact O-CB 3.2Å; E589-H593 PolarHBondContact O-N 3Å
590	R	95.6	Very high	93.9	Very high	51 Å²	51	86.3 Å²	86.3	19%	0.192	43%	0.432	C	S	.	.	H	α-helix	trans	-60.6	-47.1	175.9	-67	177.1	-160.9	-158.1	1.2	111	L580 A583 K584 G585 T586 H593 L594	L580-R590 HydrophobicContact CD2-CB 4.34Å; L580-R590 WeakPolarHBondContact O-CD 3.08Å; L580-R590 PolarHBondContact O-NH1 3.32Å; A583-R590 HydrophobicContact CB-CB 4.12Å; A583-R590 HydrophobicContact CB-CG 3.72Å; A583-R590 PolarHBondContact O-NE 3.37Å; A583-R590 VanDerWaalsContact O-NE 3.09Å; A583-R590 PolarHBondContact O-NH1 3.03Å; K584-R590 WeakPolarHBondContact O-CG 3.46Å; G585-R590 VanDerWaalsContact O-CZ 3.31Å; G585-R590 PolarHBondContact O-NE 3.34Å; G585-R590 PolarHBondContact O-NH2 3.27Å; T586-R590 VanDerWaalsContact O-CG 3.26Å; T586-R590 WeakPolarHBondContact O-CG 3.2Å; T586-R590 PolarHBondContact O-N 3.34Å; R590-H593 PolarHBondContact O-N 3.4Å; R590-L594 HydrophobicContact CB-CD1 4.47Å; R590-L594 VanDerWaalsContact O-CB 3.28Å; R590-L594 WeakPolarHBondContact O-CB 3.43Å; R590-L594 WeakPolarHBondContact O-CD1 3.14Å; R590-L594 WeakPolarHBondContact O-CG 3.2Å; R590-L594 PolarHBondContact O-N 2.9Å
591	W	95.4	Very high	93.3	Very high	118 Å²	118	90.3 Å²	90.3	45%	0.447	45%	0.453	S	S	.	.	H	α-helix	trans	-60	-51.6	177.8	-178.5	-89.8	0	0	0	111.3	L129 F130 V497 M587 A588 H593 L594 T595	L129-W591 HydrophobicContact CD2-CE3 3.81Å; L129-W591 HydrophobicContact CD2-CH2 4.39Å; L129-W591 HydrophobicContact CD2-CZ3 3.73Å; F130-W591 HydrophobicContact CE2-CH2 4.39Å; F130-W591 HydrophobicContact CZ-CH2 4.33Å; V497-W591 HydrophobicContact CG1-CZ2 4.28Å; V497-W591 HydrophobicContact CG2-CZ2 4.45Å; M587-W591 WeakPolarHBondContact O-CB 3.32Å; M587-W591 PolarHBondContact O-N 3.48Å; A588-W591 PolarHBondContact O-N 3.25Å; W591-H593 VanDerWaalsContact C-N 3.32Å; W591-H593 PolarHBondContact O-N 3Å; W591-L594 PolarHBondContact O-N 3.21Å; W591-T595 HydrophobicContact CD2-CG2 4.13Å; W591-T595 HydrophobicContact CG-CG2 4.42Å; W591-T595 HydrophobicContact CZ2-CG2 4.18Å; W591-T595 WeakPolarHBondContact O-CB 3.42Å; W591-T595 VanDerWaalsContact O-CG2 3.3Å; W591-T595 WeakPolarHBondContact O-CG2 3.33Å; W591-T595 PolarHBondContact O-N 3.03Å; W591-T595 PolarHBondContact O-OG1 3.37Å
592	Q	94	Very high	92.6	Very high	128 Å²	128	86.7 Å²	86.7	60%	0.598	43%	0.433	S	S	*	.	H	α-helix	trans	-60.3	-41.5	-179.8	-173.7	179.1	5.2	0	0	111.9	A588 E589 Q596	A588-Q592 WeakPolarHBondContact O-CB 3.38Å; A588-Q592 PolarHBondContact O-N 2.86Å; E589-Q592 PolarHBondContact O-N 3.13Å; Q592-Q596 WeakPolarHBondContact O-CG 3.35Å
593	H	94	Very high	92	Very high	127 Å²	127	76.5 Å²	76.5	59%	0.588	40%	0.395	S	S	*	.	H	α-helix	trans	-71	-43.5	180	-177.4	56.4	0	0	0	112.6	E589 R590 W591 Q596	E589-H593 VanDerWaalsContact O-CB 3.27Å; E589-H593 WeakPolarHBondContact O-CB 3.2Å; E589-H593 PolarHBondContact O-N 3Å; R590-H593 PolarHBondContact O-N 3.4Å; W591-H593 VanDerWaalsContact C-N 3.32Å; W591-H593 PolarHBondContact O-N 3Å; H593-Q596 PolarHBondContact O-N 2.81Å
594	L	95.3	Very high	91.3	Very high	29 Å²	29	79.5 Å²	79.5	15%	0.152	41%	0.408	C	S	.	.	H	α-helix	trans	-79.1	-18.6	-174.8	-65.7	168.3	0	0	0	113.7	P128 L129 C579 L580 A583 R590 W591	P128-L594 WeakPolarHBondContact CD-O 3.3Å; L129-L594 HydrophobicContact CB-CB 3.96Å; L129-L594 WeakPolarHBondContact CB-O 3.26Å; L129-L594 HydrophobicContact CD1-CB 4.13Å; L129-L594 HydrophobicContact CD1-CD1 3.99Å; L129-L594 HydrophobicContact CG-CB 4.45Å; L129-L594 PolarHBondContact N-O 3.22Å; C579-L594 HydrophobicContact CB-CD1 4.19Å; C579-L594 HydrophobicContact CB-CD2 4.47Å; L580-L594 HydrophobicContact CD2-CD1 4.03Å; A583-L594 HydrophobicContact CB-CD1 3.78Å; A583-L594 HydrophobicContact CB-CD2 4.46Å; A583-L594 HydrophobicContact CB-CG 4.31Å; R590-L594 HydrophobicContact CB-CD1 4.47Å; R590-L594 VanDerWaalsContact O-CB 3.28Å; R590-L594 WeakPolarHBondContact O-CB 3.43Å; R590-L594 WeakPolarHBondContact O-CD1 3.14Å; R590-L594 WeakPolarHBondContact O-CG 3.2Å; R590-L594 PolarHBondContact O-N 2.9Å; W591-L594 PolarHBondContact O-N 3.21Å
595	T	96	Very high	90.4	Very high	24 Å²	24	76.1 Å²	76.1	15%	0.147	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.5	174.3	56.6	0	0	0	0	112.9	L129 V497 W591	L129-T595 HydrophobicContact CB-CG2 4.39Å; L129-T595 HydrophobicContact CD2-CG2 3.94Å; V497-T595 HydrophobicContact CG1-CG2 3.56Å; W591-T595 HydrophobicContact CD2-CG2 4.13Å; W591-T595 HydrophobicContact CG-CG2 4.42Å; W591-T595 HydrophobicContact CZ2-CG2 4.18Å; W591-T595 WeakPolarHBondContact O-CB 3.42Å; W591-T595 VanDerWaalsContact O-CG2 3.3Å; W591-T595 WeakPolarHBondContact O-CG2 3.33Å; W591-T595 PolarHBondContact O-N 3.03Å; W591-T595 PolarHBondContact O-OG1 3.37Å
596	Q	94.5	Very high	89.3	Confident	102 Å²	102	78 Å²	78	48%	0.477	39%	0.39	S	S	.	.	S	Bend	trans	-69.7	128.8	174.9	-85.7	173.5	13.7	0	0	111.4	P128 Q592 H593	P128-Q596 WeakPolarHBondContact CD-O 3.16Å; P128-Q596 VanDerWaalsContact CG-O 3.28Å; P128-Q596 WeakPolarHBondContact CG-O 3.2Å; Q592-Q596 WeakPolarHBondContact O-CG 3.35Å; H593-Q596 PolarHBondContact O-N 2.81Å
597	P	94.7	Very high	88.1	Confident	25 Å²	25	78.6 Å²	78.6	16%	0.162	38%	0.384	C	S	.	.			trans	-63.6	143.3	176.4	-19	29.1	0	0	0	112.4	N125 I126 Y498 W599	N125-P597 CarbonylContact O-C 3.58Å; N125-P597 VanDerWaalsContact O-CA 3.27Å; N125-P597 WeakPolarHBondContact O-CA 3.38Å; I126-P597 WeakPolarHBondContact O-CA 3.48Å; I126-P597 WeakPolarHBondContact O-CB 3.4Å; I126-P597 VanDerWaalsContact O-CG 3.29Å; I126-P597 WeakPolarHBondContact O-CG 3.44Å; Y498-P597 HydrophobicContact CD2-CG 3.95Å; Y498-P597 HydrophobicContact CE2-CB 4.45Å; Y498-P597 HydrophobicContact CE2-CG 3.57Å; P597-W599 HydrophobicContact CB-CD2 4.14Å; P597-W599 VanDerWaalsContact CB-CE2 3.5Å; P597-W599 HydrophobicContact CB-CE3 4.4Å; P597-W599 HydrophobicContact CB-CH2 3.54Å; P597-W599 HydrophobicContact CB-CZ2 3.21Å; P597-W599 HydrophobicContact CB-CZ3 4.13Å; P597-W599 HydrophobicContact CG-CH2 3.92Å; P597-W599 HydrophobicContact CG-CZ2 3.46Å; P597-W599 VanDerWaalsContact CG-CZ2 3.46Å
598	I	93.5	Very high	86.5	Confident	90 Å²	90	75 Å²	75	46%	0.462	37%	0.374	S	S	.	.			trans	-99.1	108.2	172.1	-59.2	168	0	0	0	108.2	N125 P128	N125-I598 HydrophobicContact CB-CB 4.11Å; N125-I598 PolarHBondContact O-N 3.29Å; P128-I598 HydrophobicContact CB-CD1 4.12Å; P128-I598 HydrophobicContact CG-CD1 3.54Å; P128-I598 HydrophobicContact CG-CG1 3.69Å
599	W	91.1	Very high	84.7	Confident	77 Å²	77	77.1 Å²	77.1	29%	0.292	37%	0.372	S	S	.	.			trans	-85.6	128.5	-177.3	-56.1	117	0	0	0	112.1	F115 M116 Y498 P597 H603	F115-W599 HydrophobicContact CE1-CH2 4.19Å; F115-W599 AromaticContact CE1-CZ3 3.74Å; F115-W599 HydrophobicContact CE1-CZ3 3.74Å; F115-W599 HydrophobicContact CZ-CZ3 4.15Å; M116-W599 HydrophobicContact SD-CZ3 4.21Å; Y498-W599 HydrophobicContact CE2-CH2 4.06Å; Y498-W599 HydrophobicContact CE2-CZ2 4.46Å; Y498-W599 WeakPolarHBondContact OH-CH2 3.34Å; P597-W599 HydrophobicContact CB-CD2 4.14Å; P597-W599 VanDerWaalsContact CB-CE2 3.5Å; P597-W599 HydrophobicContact CB-CE3 4.4Å; P597-W599 HydrophobicContact CB-CH2 3.54Å; P597-W599 HydrophobicContact CB-CZ2 3.21Å; P597-W599 HydrophobicContact CB-CZ3 4.13Å; P597-W599 HydrophobicContact CG-CH2 3.92Å; P597-W599 HydrophobicContact CG-CZ2 3.46Å; P597-W599 VanDerWaalsContact CG-CZ2 3.46Å; W599-H603 HydrophobicContact CB-CB 4.33Å; W599-H603 HydrophobicContact CE3-CB 4.16Å; W599-H603 AromaticContact CE3-CD2 3.85Å; W599-H603 AromaticContact CE3-CG 3.78Å; W599-H603 AromaticContact CE3-ND1 3.99Å
600	G	84.1	Confident	82.7	Confident	31 Å²	31	75 Å²	75	32%	0.32	36%	0.364	S	S	.	.			trans	-79	167	166	0	0	0	0	0	113.2	H602 H603	G600-H602 VanDerWaalsContact C-N 3.29Å; G600-H602 PolarHBondContact O-N 3.13Å; G600-H603 PolarHBondContact N-ND1 3.36Å; G600-H603 PolarHBondContact O-N 3.23Å; G600-H603 VanDerWaalsContact O-N 3.1Å; G600-H603 PolarHBondContact O-ND1 3.05Å
601	L	81.1	Confident	80.7	Confident	116 Å²	116	75.5 Å²	75.5	61%	0.607	38%	0.379	S	S	*	.	H	α-helix	trans	-51.3	-42.9	-179.3	-77.3	151.1	0	0	0	113.4	H603 L604 E605	L601-H603 VanDerWaalsContact C-N 3.28Å; L601-H603 PolarHBondContact O-N 3.35Å; L601-L604 WeakPolarHBondContact O-CB 3.48Å; L601-L604 PolarHBondContact O-N 3.38Å; L601-E605 PolarHBondContact O-N 3.23Å
602	H	81	Confident	78.8	Confident	45 Å²	45	75.2 Å²	75.2	21%	0.208	39%	0.386	C	S	.	.	H	α-helix	trans	-63.9	-30.5	-177.9	67.8	-79.8	0	0	0	113.1	F115 M116 G600 L604 E605 Y606	F115-H602 PolarHBondContact O-NE2 2.91Å; F115-H602 VanDerWaalsContact O-NE2 3.1Å; M116-H602 PolarHBondContact O-CE1 3.23Å; M116-H602 VanDerWaalsContact O-CE1 3.25Å; M116-H602 PolarHBondContact O-NE2 2.69Å; G600-H602 VanDerWaalsContact C-N 3.29Å; G600-H602 PolarHBondContact O-N 3.13Å; H602-L604 VanDerWaalsContact C-N 3.28Å; H602-L604 PolarHBondContact O-N 3.42Å; H602-E605 PolarHBondContact O-N 3.42Å; H602-Y606 WeakPolarHBondContact O-CD2 3.17Å
603	H	84.7	Confident	76.7	Confident	6 Å²	6	72.9 Å²	72.9	3%	0.028	38%	0.38	C	S	.	.	H	α-helix	trans	-69	-30.2	175.8	-54	100	0	0	0	111.9	F115 W599 G600 L601 R607	F115-H603 PolarHBondContact O-NE2 2.94Å; W599-H603 HydrophobicContact CB-CB 4.33Å; W599-H603 HydrophobicContact CE3-CB 4.16Å; W599-H603 AromaticContact CE3-CD2 3.85Å; W599-H603 AromaticContact CE3-CG 3.78Å; W599-H603 AromaticContact CE3-ND1 3.99Å; G600-H603 PolarHBondContact N-ND1 3.36Å; G600-H603 PolarHBondContact O-N 3.23Å; G600-H603 VanDerWaalsContact O-N 3.1Å; G600-H603 PolarHBondContact O-ND1 3.05Å; L601-H603 VanDerWaalsContact C-N 3.28Å; L601-H603 PolarHBondContact O-N 3.35Å; H603-R607 WeakPolarHBondContact O-CB 3.48Å; H603-R607 WeakPolarHBondContact O-CG 3.34Å; H603-R607 PolarHBondContact O-N 3.03Å
604	L	78.2	Confident	74.5	Confident	83 Å²	83	74.5 Å²	74.5	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-71.2	-36.9	178.5	-60.9	175.8	0	0	0	111.1	L601 H602 Y606 R607 A608	L601-L604 WeakPolarHBondContact O-CB 3.48Å; L601-L604 PolarHBondContact O-N 3.38Å; H602-L604 VanDerWaalsContact C-N 3.28Å; H602-L604 PolarHBondContact O-N 3.42Å; L604-Y606 VanDerWaalsContact C-N 3.31Å; L604-Y606 PolarHBondContact O-N 2.79Å; L604-R607 PolarHBondContact O-N 2.99Å; L604-A608 WeakPolarHBondContact O-CB 3.45Å; L604-A608 PolarHBondContact O-N 3.22Å
605	E	74.9	Confident	72	Confident	123 Å²	123	74.8 Å²	74.8	58%	0.575	39%	0.391	S	S	*	.	H	α-helix	trans	-58.6	-42.9	175.8	-66.3	174.1	-176.6	0	0	111.5	L601 H602 Q609	L601-E605 PolarHBondContact O-N 3.23Å; H602-E605 PolarHBondContact O-N 3.42Å; E605-Q609 WeakPolarHBondContact O-CG 3.39Å; E605-Q609 PolarHBondContact O-N 3.25Å
606	Y	70.9	Confident	69.6	Low	78 Å²	78	79.2 Å²	79.2	31%	0.306	41%	0.414	S	S	.	.	H	α-helix	trans	-78.7	-35.7	179.2	-66.4	-67	0	0	0	113.5	F333 H602 L604 Q609 D610	F333-Y606 HydrophobicContact CB-CE2 4.01Å; F333-Y606 WeakPolarHBondContact CB-OH 3.41Å; F333-Y606 AromaticContact CD1-CD1 3.86Å; F333-Y606 HydrophobicContact CD1-CD1 3.86Å; F333-Y606 AromaticContact CD1-CD2 3.75Å; F333-Y606 HydrophobicContact CD1-CD2 3.75Å; F333-Y606 AromaticContact CD1-CE1 3.5Å; F333-Y606 HydrophobicContact CD1-CE1 3.5Å; F333-Y606 VanDerWaalsContact CD1-CE1 3.5Å; F333-Y606 AromaticContact CD1-CE2 3.41Å; F333-Y606 HydrophobicContact CD1-CE2 3.41Å; F333-Y606 VanDerWaalsContact CD1-CE2 3.41Å; F333-Y606 AromaticContact CD1-CG 3.98Å; F333-Y606 HydrophobicContact CD1-CG 3.98Å; F333-Y606 AromaticContact CD1-CZ 3.27Å; F333-Y606 HydrophobicContact CD2-CD2 4.21Å; F333-Y606 AromaticContact CD2-CE2 3.81Å; F333-Y606 HydrophobicContact CD2-CE2 3.81Å; F333-Y606 AromaticContact CE1-CD1 3.7Å; F333-Y606 HydrophobicContact CE1-CD1 3.7Å; F333-Y606 AromaticContact CE1-CD2 3.5Å; F333-Y606 HydrophobicContact CE1-CD2 3.5Å; F333-Y606 AromaticContact CE1-CE1 3.87Å; F333-Y606 HydrophobicContact CE1-CE1 3.87Å; F333-Y606 AromaticContact CE1-CE2 3.7Å; F333-Y606 HydrophobicContact CE1-CE2 3.7Å; F333-Y606 AromaticContact CE1-CG 3.53Å; F333-Y606 HydrophobicContact CE1-CG 3.53Å; F333-Y606 AromaticContact CE1-CZ 3.88Å; F333-Y606 AromaticContact CE2-CD2 3.98Å; F333-Y606 HydrophobicContact CE2-CD2 3.98Å; F333-Y606 HydrophobicContact CE2-CE2 4.06Å; F333-Y606 HydrophobicContact CG-CD2 4.1Å; F333-Y606 HydrophobicContact CG-CE1 4.26Å; F333-Y606 AromaticContact CG-CE2 3.46Å; F333-Y606 HydrophobicContact CG-CE2 3.46Å; F333-Y606 VanDerWaalsContact CG-CE2 3.46Å; F333-Y606 AromaticContact CG-CZ 3.55Å; F333-Y606 AromaticContact CZ-CD2 3.61Å; F333-Y606 HydrophobicContact CZ-CD2 3.61Å; F333-Y606 HydrophobicContact CZ-CE2 4.01Å; F333-Y606 AromaticContact CZ-CG 3.94Å; F333-Y606 HydrophobicContact CZ-CG 3.94Å; H602-Y606 WeakPolarHBondContact O-CD2 3.17Å; L604-Y606 VanDerWaalsContact C-N 3.31Å; L604-Y606 PolarHBondContact O-N 2.79Å; Y606-Q609 PolarHBondContact O-N 2.98Å; Y606-D610 PolarHBondContact O-N 3.01Å
607	R	68.9	Low	67.2	Low	94 Å²	94	79.4 Å²	79.4	36%	0.355	42%	0.422	S	S	.	.	H	α-helix	trans	-72.4	-29.7	176.4	-74.6	-176.4	176.1	171.6	5.1	113.3	D506 H603 L604 D610 A611	D506-R607 IonicContact OD1-NH2 3.94Å; H603-R607 WeakPolarHBondContact O-CB 3.48Å; H603-R607 WeakPolarHBondContact O-CG 3.34Å; H603-R607 PolarHBondContact O-N 3.03Å; L604-R607 PolarHBondContact O-N 2.99Å; R607-D610 PolarHBondContact O-N 3.13Å; R607-A611 PolarHBondContact O-N 3.23Å; R607-A611 VanDerWaalsContact O-N 3.07Å
608	A	59.5	Low	64.8	Low	50 Å²	50	83.4 Å²	83.4	41%	0.413	45%	0.446	S	S	.	.	H	α-helix	trans	-64.7	-43.3	172.4	0	0	0	0	0	111.2	L604 D610 A611 D612	L604-A608 WeakPolarHBondContact O-CB 3.45Å; L604-A608 PolarHBondContact O-N 3.22Å; A608-D610 VanDerWaalsContact C-N 3.28Å; A608-D610 PolarHBondContact O-N 3.31Å; A608-A611 PolarHBondContact O-N 3.46Å; A608-A611 VanDerWaalsContact O-N 3.14Å; A608-D612 PolarHBondContact O-N 3.41Å
609	Q	56.2	Low	62.1	Low	118 Å²	118	84.9 Å²	84.9	55%	0.551	45%	0.454	S	S	*	.	H	α-helix	trans	-58.5	-40.6	174.1	-71.6	176.4	-4	0	0	111.9	E605 Y606 A611 D612 V613	E605-Q609 WeakPolarHBondContact O-CG 3.39Å; E605-Q609 PolarHBondContact O-N 3.25Å; Y606-Q609 PolarHBondContact O-N 2.98Å; Q609-A611 VanDerWaalsContact C-N 3.35Å; Q609-A611 PolarHBondContact O-N 3.36Å; Q609-D612 PolarHBondContact O-N 2.97Å; Q609-V613 WeakPolarHBondContact O-CB 3.03Å; Q609-V613 WeakPolarHBondContact O-CG2 3.4Å; Q609-V613 PolarHBondContact O-N 2.95Å
610	D	52.3	Low	59.5	Low	61 Å²	61	86.7 Å²	86.7	33%	0.326	47%	0.474	S	S	.	.	H	α-helix	trans	-68.2	-33.8	178.3	-145.7	48.5	0	0	0	112.3	Y606 R607 A608 R614	Y606-D610 PolarHBondContact O-N 3.01Å; R607-D610 PolarHBondContact O-N 3.13Å; A608-D610 VanDerWaalsContact C-N 3.28Å; A608-D610 PolarHBondContact O-N 3.31Å; D610-R614 WeakPolarHBondContact O-CB 3.49Å; D610-R614 VanDerWaalsContact O-CG 3.3Å; D610-R614 WeakPolarHBondContact O-CG 3.5Å; D610-R614 PolarHBondContact O-N 2.73Å; D610-R614 IonicContact OD2-CZ 2.86Å; D610-R614 IonicContact OD2-NE 3.8Å; D610-R614 PolarHBondContact OD2-NE 3.11Å; D610-R614 IonicContact OD2-NH2 2.79Å; D610-R614 PolarHBondContact OD2-NH2 3.27Å
611	A	55.3	Low	57.4	Low	61 Å²	61	91.3 Å²	91.3	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-41	173.6	0	0	0	0	0	112.3	R607 A608 Q609 R614 G615	R607-A611 PolarHBondContact O-N 3.23Å; R607-A611 VanDerWaalsContact O-N 3.07Å; A608-A611 PolarHBondContact O-N 3.46Å; A608-A611 VanDerWaalsContact O-N 3.14Å; Q609-A611 VanDerWaalsContact C-N 3.35Å; Q609-A611 PolarHBondContact O-N 3.36Å; A611-R614 PolarHBondContact O-N 3.49Å; A611-G615 PolarHBondContact O-N 2.88Å
612	D	54.2	Low	55.3	Low	111 Å²	111	91.1 Å²	91.1	59%	0.594	50%	0.501	S	S	*	.	H	α-helix	trans	-65.6	-40.1	174.8	-74	-21.6	0	0	0	111.2	A608 Q609 G615 L616	A608-D612 PolarHBondContact O-N 3.41Å; Q609-D612 PolarHBondContact O-N 2.97Å; D612-G615 PolarHBondContact O-N 2.05Å; D612-L616 WeakPolarHBondContact O-CB 3.43Å; D612-L616 WeakPolarHBondContact O-CD1 3.5Å; D612-L616 WeakPolarHBondContact O-CG 3.22Å; D612-L616 PolarHBondContact O-N 3.49Å
613	V	50	Low	53.1	Low	79 Å²	79	92.7 Å²	92.7	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-67.1	-38.8	174.9	172.5	0	0	0	0	111.7	Q609 L616 T617	Q609-V613 WeakPolarHBondContact O-CB 3.03Å; Q609-V613 WeakPolarHBondContact O-CG2 3.4Å; Q609-V613 PolarHBondContact O-N 2.95Å; V613-L616 PolarHBondContact O-N 3.29Å; V613-T617 WeakPolarHBondContact O-CB 3.27Å; V613-T617 WeakPolarHBondContact O-CG2 3.14Å; V613-T617 PolarHBondContact O-N 3.44Å; V613-T617 PolarHBondContact O-OG1 3.4Å
614	R	48.3	Very low	51	Low	161 Å²	161	101.2 Å²	101.2	61%	0.608	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-40.4	170.6	-75.1	-178.9	-145.7	-164.1	5.7	111.8	D610 A611 L616 T617 T618	D610-R614 WeakPolarHBondContact O-CB 3.49Å; D610-R614 VanDerWaalsContact O-CG 3.3Å; D610-R614 WeakPolarHBondContact O-CG 3.5Å; D610-R614 PolarHBondContact O-N 2.73Å; D610-R614 IonicContact OD2-CZ 2.86Å; D610-R614 IonicContact OD2-NE 3.8Å; D610-R614 PolarHBondContact OD2-NE 3.11Å; D610-R614 IonicContact OD2-NH2 2.79Å; D610-R614 PolarHBondContact OD2-NH2 3.27Å; A611-R614 PolarHBondContact O-N 3.49Å; R614-L616 VanDerWaalsContact C-N 3.33Å; R614-L616 PolarHBondContact O-N 3.42Å; R614-T617 WeakPolarHBondContact CA-OG1 3.43Å; R614-T617 PolarHBondContact O-N 3.35Å; R614-T617 PolarHBondContact O-OG1 3.29Å; R614-T618 WeakPolarHBondContact O-CG2 3.17Å; R614-T618 PolarHBondContact O-N 3.27Å; R614-T618 PolarHBondContact O-OG1 3.45Å; R614-T618 VanDerWaalsContact O-OG1 3.1Å
615	G	43.1	Very low	49.2	Very low	36 Å²	36	102.2 Å²	102.2	37%	0.371	57%	0.571	S	S	.	*	H	α-helix	trans	-58.2	-44.5	172.6	0	0	0	0	0	112.2	A611 D612 T618 L619	A611-G615 PolarHBondContact O-N 2.88Å; D612-G615 PolarHBondContact O-N 2.05Å; G615-T618 PolarHBondContact O-N 3.45Å; G615-T618 PolarHBondContact O-OG1 3.22Å; G615-L619 PolarHBondContact O-N 2.91Å
616	L	45.2	Very low	47.4	Very low	117 Å²	117	99.7 Å²	99.7	61%	0.613	57%	0.567	S	S	*	*	H	α-helix	trans	-70	-35.1	178	-77.2	156.9	0	0	0	113.4	D612 V613 R614 L619	D612-L616 WeakPolarHBondContact O-CB 3.43Å; D612-L616 WeakPolarHBondContact O-CD1 3.5Å; D612-L616 WeakPolarHBondContact O-CG 3.22Å; D612-L616 PolarHBondContact O-N 3.49Å; V613-L616 PolarHBondContact O-N 3.29Å; R614-L616 VanDerWaalsContact C-N 3.33Å; R614-L616 PolarHBondContact O-N 3.42Å; L616-L619 HydrophobicContact CD2-CD1 4.13Å; L616-L619 WeakPolarHBondContact O-CB 3.39Å; L616-L619 PolarHBondContact O-N 3.22Å
617	T	44.3	Very low	45.6	Very low	106 Å²	106	104.3 Å²	104.3	65%	0.65	59%	0.589	S	S	*	*	H	α-helix	trans	-79.7	-20.2	177.4	45.9	0	0	0	0	113.2	V613 R614 L619	V613-T617 WeakPolarHBondContact O-CB 3.27Å; V613-T617 WeakPolarHBondContact O-CG2 3.14Å; V613-T617 PolarHBondContact O-N 3.44Å; V613-T617 PolarHBondContact O-OG1 3.4Å; R614-T617 WeakPolarHBondContact CA-OG1 3.43Å; R614-T617 PolarHBondContact O-N 3.35Å; R614-T617 PolarHBondContact O-OG1 3.29Å; T617-L619 VanDerWaalsContact C-N 3.25Å
618	T	44.5	Very low	44.1	Very low	108 Å²	108	105.9 Å²	105.9	66%	0.663	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-8.2	166.9	54	0	0	0	0	113.8	R614 G615 T620	R614-T618 WeakPolarHBondContact O-CG2 3.17Å; R614-T618 PolarHBondContact O-N 3.27Å; R614-T618 PolarHBondContact O-OG1 3.45Å; R614-T618 VanDerWaalsContact O-OG1 3.1Å; G615-T618 PolarHBondContact O-N 3.45Å; G615-T618 PolarHBondContact O-OG1 3.22Å; T618-T620 VanDerWaalsContact C-N 3.34Å; T618-T620 PolarHBondContact O-N 3.2Å
619	L	36.9	Very low	42.8	Very low	122 Å²	122	108.9 Å²	108.9	64%	0.639	62%	0.622	S	S	*	*	S	Bend	trans	-72.5	95.3	166.7	-61.9	171.2	0	0	0	107.8	G615 L616 T617	G615-L619 PolarHBondContact O-N 2.91Å; L616-L619 HydrophobicContact CD2-CD1 4.13Å; L616-L619 WeakPolarHBondContact O-CB 3.39Å; L616-L619 PolarHBondContact O-N 3.22Å; T617-L619 VanDerWaalsContact C-N 3.25Å
620	T	35.1	Very low	42	Very low	115 Å²	115	109.4 Å²	109.4	71%	0.706	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-46.8	136.9	166.9	44.2	0	0	0	0	109.8	T618 V622	T618-T620 VanDerWaalsContact C-N 3.34Å; T618-T620 PolarHBondContact O-N 3.2Å; T620-V622 PolarHBondContact O-N 3.4Å
621	P	40.2	Very low	41.2	Very low	127 Å²	127	112.2 Å²	112.2	83%	0.825	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-58.6	117.8	175.1	21.3	-26.6	0	0	0	108.1	S623	P621-S623 PolarHBondContact O-N 3.17Å; P621-S623 VanDerWaalsContact O-N 3.13Å
622	V	37.1	Very low	40	Very low	112 Å²	112	117.5 Å²	117.5	68%	0.679	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-51.1	119.8	174.8	174.1	0	0	0	0	107.4	T620 S626	T620-V622 PolarHBondContact O-N 3.4Å; V622-S626 WeakPolarHBondContact CG1-OG 3.36Å
623	S	34.4	Very low	39	Very low	79 Å²	79	117.9 Å²	117.9	55%	0.552	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.7	149	-179.1	71.1	0	0	0	0	109.9	P621 S625 S626	P621-S623 PolarHBondContact O-N 3.17Å; P621-S623 VanDerWaalsContact O-N 3.13Å; S623-S625 PolarHBondContact O-N 3.15Å; S623-S625 PolarHBondContact OG-OG 3.28Å; S623-S626 PolarHBondContact O-N 3.28Å; S623-S626 PolarHBondContact O-OG 3.49Å
624	E	40.7	Very low	38.1	Very low	184 Å²	184	120.5 Å²	120.5	86%	0.86	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-55.3	2.8	-175.5	-77.2	-171.1	134.6	0	0	116.1
625	S	41.4	Very low	37.4	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-87.3	2.8	176.6	54.7	0	0	0	0	115.3	S623	S623-S625 PolarHBondContact O-N 3.15Å; S623-S625 PolarHBondContact OG-OG 3.28Å
626	S	36	Very low	37.1	Very low	70 Å²	70	129.7 Å²	129.7	49%	0.49	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-117.8	37.1	176.1	17.3	0	0	0	0	114.7	V622 S623 V628	V622-S626 WeakPolarHBondContact CG1-OG 3.36Å; S623-S626 PolarHBondContact O-N 3.28Å; S623-S626 PolarHBondContact O-OG 3.49Å; S626-V628 VanDerWaalsContact C-N 3.28Å; S626-V628 PolarHBondContact O-N 3.3Å
627	K	35.2	Very low	36.7	Very low	175 Å²	175	130.3 Å²	130.3	76%	0.761	75%	0.75	S	S	*	*			trans	-66.8	92.2	155.7	-77.1	-175.8	-179.9	173.7	0	108.9	V629	K627-V629 PolarHBondContact O-N 2.86Å; K627-V629 VanDerWaalsContact O-N 3.08Å
628	V	35.3	Very low	36.3	Very low	127 Å²	127	131.7 Å²	131.7	77%	0.77	76%	0.755	S	S	*	*			trans	-68.2	101.5	159.8	178.3	0	0	0	0	106.5	S626 V630	S626-V628 VanDerWaalsContact C-N 3.28Å; S626-V628 PolarHBondContact O-N 3.3Å; V628-V630 HydrophobicContact CG1-CG2 4.43Å; V628-V630 PolarHBondContact O-N 2.67Å; V628-V630 VanDerWaalsContact O-N 3.16Å
629	V	33.9	Very low	35.8	Very low	114 Å²	114	133.1 Å²	133.1	69%	0.691	76%	0.761	S	S	*	*			trans	-68.7	104.9	166.6	177.6	0	0	0	0	106.4	K627 V631	K627-V629 PolarHBondContact O-N 2.86Å; K627-V629 VanDerWaalsContact O-N 3.08Å; V629-V631 HydrophobicContact CG1-CG2 4.05Å; V629-V631 PolarHBondContact O-N 3.33Å; V629-V631 VanDerWaalsContact O-N 3.14Å
630	V	39.7	Very low	35.7	Very low	129 Å²	129	133.8 Å²	133.8	78%	0.782	77%	0.768	S	S	*	*			trans	-73.4	100.5	167.8	-179.9	0	0	0	0	106.4	V628	V628-V630 HydrophobicContact CG1-CG2 4.43Å; V628-V630 PolarHBondContact O-N 2.67Å; V628-V630 VanDerWaalsContact O-N 3.16Å
631	V	33.7	Very low	35.8	Very low	120 Å²	120	135 Å²	135	73%	0.727	77%	0.772	S	S	*	*			trans	-74.1	121.1	172.8	176.5	0	0	0	0	108.1	V629 S633	V629-V631 HydrophobicContact CG1-CG2 4.05Å; V629-V631 PolarHBondContact O-N 3.33Å; V629-V631 VanDerWaalsContact O-N 3.14Å; V631-S633 PolarHBondContact O-N 2.79Å
632	E	30	Very low	35.5	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.804	77%	0.769	S	S	*	*			trans	-58.7	122.6	167.3	-74	178.3	147.3	0	0	110	V634	E632-V634 PolarHBondContact O-N 3.48Å
633	S	34.3	Very low	35.3	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	78%	0.775	S	S	*	*			trans	-82.4	106.2	164.7	60	0	0	0	0	108.8	V631	V631-S633 PolarHBondContact O-N 2.79Å
634	V	30.7	Very low	35.4	Very low	134 Å²	134	142.3 Å²	142.3	81%	0.812	79%	0.794	S	S	*	*			trans	-77.6	116.1	163.7	179.9	0	0	0	0	108.1	E632	E632-V634 PolarHBondContact O-N 3.48Å
635	M	34.2	Very low	34.9	Very low	260 Å²	260	138.5 Å²	138.5	100%	1.281	79%	0.788	S	S	*	*			trans	-141.7	0	145.9	-113	-172.3	178.1	0	0	109

Retrieved 635 of 635 residues in 280.9 ms (Link to these results)

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