A0A087YAN6_POEFO Loading...

Sulfotransferase

AlphaFold DB , UniProt , Accession A0A087YAN6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 372 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	38.8	Very low	241 Å²	241	163.2 Å²	163.2	100%	1.187	84%	0.836	S	S	*	*				0	92.1	0	-56.2	-151.3	-153.3	0	0	106.6
2	A	34.2	Very low	39.3	Very low	85 Å²	85	160.1 Å²	160.1	70%	0.702	83%	0.834	S	S	*	*				48.6	113.7	83.2	0	0	0	0	0	110.6
3	F	33.8	Very low	39.5	Very low	204 Å²	204	157 Å²	157	90%	0.895	84%	0.835	S	S	*	*				-156.8	148.2	65	-100.2	-94.5	0	0	0	114.1
4	S	36	Very low	39.9	Very low	90 Å²	90	163.6 Å²	163.6	63%	0.629	84%	0.842	S	S	*	*			trans	-75	159.3	167	66.8	0	0	0	0	112.9
5	L	40.5	Very low	40	Very low	154 Å²	154	157 Å²	157	81%	0.806	83%	0.831	S	S	*	*			trans	-151.3	105.5	143.3	-110.8	139.6	0	0	0	112.5
6	I	40.4	Very low	40.6	Very low	151 Å²	151	157.6 Å²	157.6	77%	0.774	83%	0.832	S	S	*	*			trans	-68.2	135.9	161.5	-68.4	163.4	0	0	0	108.1
7	R	39	Very low	41.2	Very low	231 Å²	231	156.8 Å²	156.8	87%	0.872	83%	0.828	S	S	*	*			trans	-127.1	129.5	159.5	-81.5	-169.3	-179.5	-174.1	1.6	112
8	K	37.1	Very low	42.3	Very low	200 Å²	200	151.6 Å²	151.6	87%	0.87	81%	0.806	S	S	*	*			trans	-45.8	145	-177.7	-70.6	167.9	172.2	-179.1	0	115.7
9	L	37.3	Very low	43	Very low	174 Å²	174	155.7 Å²	155.7	91%	0.911	81%	0.809	S	S	*	*			trans	-76.5	137.2	160.8	-74.3	154.3	0	0	0	110
10	D	43.7	Very low	43.5	Very low	153 Å²	153	156.5 Å²	156.5	82%	0.818	81%	0.806	S	S	*	*			trans	-115.4	151.1	164.2	-88.1	-34	0	0	0	110.4
11	P	46.2	Very low	44.2	Very low	112 Å²	112	151.1 Å²	151.1	73%	0.727	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.8	166.4	-166	33	-35.4	0	0	0	114.4
12	P	44.3	Very low	45.2	Very low	126 Å²	126	143.4 Å²	143.4	82%	0.818	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-77.1	143.1	-166.5	31.1	-34.1	0	0	0	113.1
13	S	42.5	Very low	46.5	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-71.2	138	173.7	56.2	0	0	0	0	111.9
14	R	44.5	Very low	47.9	Very low	249 Å²	249	141 Å²	141	94%	0.94	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-70.8	131.4	173.7	-76.7	175.3	170.2	178.4	-3.2	110.9
15	G	41.5	Very low	48.9	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	74%	0.736	S	S	*	*			trans	87.7	112.3	143.2	0	0	0	0	0	116.8
16	I	49.3	Very low	49.8	Very low	166 Å²	166	139.1 Å²	139.1	85%	0.851	73%	0.725	S	S	*	*				-158.7	97.9	118.3	-81.2	136.1	0	0	0	105.2	S18	I16-S18 PolarHBondContact O-N 2.94Å; I16-S18 VanDerWaalsContact O-N 3.09Å
17	L	51.6	Low	50.9	Low	145 Å²	145	135.4 Å²	135.4	76%	0.759	71%	0.713	S	S	*	*			trans	-69	104.3	166	-122.1	88.7	0	0	0	106.6	R19 V22	L17-R19 PolarHBondContact O-N 3.48Å; L17-V22 HydrophobicContact CD2-CG2 4.08Å
18	S	61	Low	52	Low	62 Å²	62	130 Å²	130	43%	0.434	70%	0.7	S	S	.	*			trans	-56.5	134.1	172.6	167.9	0	0	0	0	109.6	I16 K20 A21	I16-S18 PolarHBondContact O-N 2.94Å; I16-S18 VanDerWaalsContact O-N 3.09Å; S18-K20 PolarHBondContact O-N 3.08Å; S18-K20 PolarHBondContact OG-N 3.3Å; S18-A21 WeakPolarHBondContact O-CB 3.5Å; S18-A21 PolarHBondContact O-N 2.56Å
19	R	55.6	Low	53.4	Low	231 Å²	231	125.1 Å²	125.1	87%	0.872	68%	0.683	S	S	*	*	H	α-helix	trans	-49.2	-19	172.7	-82.5	-179.7	168.8	-166.7	-3	113.4	L17 V23	L17-R19 PolarHBondContact O-N 3.48Å; R19-V23 WeakPolarHBondContact O-CG2 3.21Å
20	K	53.3	Low	55	Low	170 Å²	170	119.9 Å²	119.9	74%	0.739	67%	0.665	S	S	*	*	H	α-helix	trans	-74.9	-25.5	175.1	-62.9	-175	176.2	-177.4	0	114.1	S18 M24	S18-K20 PolarHBondContact O-N 3.08Å; S18-K20 PolarHBondContact OG-N 3.3Å; K20-M24 PolarHBondContact O-N 2.7Å
21	A	56.9	Low	56.3	Low	44 Å²	44	116.2 Å²	116.2	36%	0.364	65%	0.649	S	S	.	*	H	α-helix	trans	-76.9	-33.4	179	0	0	0	0	0	112.7	S18 M24 L25	S18-A21 WeakPolarHBondContact O-CB 3.5Å; S18-A21 PolarHBondContact O-N 2.56Å; A21-M24 PolarHBondContact O-N 3.15Å; A21-L25 PolarHBondContact O-N 3.36Å; A21-L25 VanDerWaalsContact O-N 3.12Å
22	V	60.3	Low	57.4	Low	79 Å²	79	115.8 Å²	115.8	48%	0.479	64%	0.64	S	S	.	*	H	α-helix	trans	-69.4	-36.9	175.8	179.5	0	0	0	0	111.2	L17 L25 C26	L17-V22 HydrophobicContact CD2-CG2 4.08Å; V22-L25 PolarHBondContact O-N 3.43Å; V22-C26 PolarHBondContact O-N 2.99Å; V22-C26 PolarHBondContact O-SG 3.34Å
23	V	61.6	Low	58.8	Low	104 Å²	104	114.7 Å²	114.7	63%	0.63	63%	0.627	S	S	*	*	H	α-helix	trans	-69.5	-33.8	176.4	177.6	0	0	0	0	111.8	R19 S27	R19-V23 WeakPolarHBondContact O-CG2 3.21Å; V23-S27 PolarHBondContact O-N 2.86Å; V23-S27 PolarHBondContact O-OG 3.37Å
24	M	62.6	Low	60	Low	135 Å²	135	114.2 Å²	114.2	67%	0.665	61%	0.614	S	S	*	*	H	α-helix	trans	-73.4	-29.9	174.7	-83.3	-123.6	-86.2	0	0	113.9	K20 A21 S27	K20-M24 PolarHBondContact O-N 2.7Å; A21-M24 PolarHBondContact O-N 3.15Å; M24-S27 PolarHBondContact O-OG 3.22Å; M24-S27 VanDerWaalsContact O-OG 3.13Å
25	L	58.9	Low	61.1	Low	120 Å²	120	107.9 Å²	107.9	63%	0.628	60%	0.599	S	S	*	*	H	α-helix	trans	-73.8	-36.4	174.6	-114.9	86.9	0	0	0	112.2	A21 V22 L28 L29	A21-L25 PolarHBondContact O-N 3.36Å; A21-L25 VanDerWaalsContact O-N 3.12Å; V22-L25 PolarHBondContact O-N 3.43Å; L25-L28 PolarHBondContact O-N 2.9Å; L25-L29 PolarHBondContact O-N 3.23Å
26	C	58.2	Low	62.5	Low	84 Å²	84	111.5 Å²	111.5	57%	0.568	60%	0.598	S	S	*	*	H	α-helix	trans	-71.4	-29.2	179	-71.9	0	0	0	0	113.5	V22	V22-C26 PolarHBondContact O-N 2.99Å; V22-C26 PolarHBondContact O-SG 3.34Å
27	S	63.8	Low	63.3	Low	73 Å²	73	109.2 Å²	109.2	51%	0.51	59%	0.587	S	S	.	*	H	α-helix	trans	-77.1	-19.2	177.9	53.3	0	0	0	0	114	V23 M24 P31	V23-S27 PolarHBondContact O-N 2.86Å; V23-S27 PolarHBondContact O-OG 3.37Å; M24-S27 PolarHBondContact O-OG 3.22Å; M24-S27 VanDerWaalsContact O-OG 3.13Å; S27-P31 VanDerWaalsContact O-CD 3.31Å; S27-P31 WeakPolarHBondContact O-CD 3.18Å
28	L	62	Low	63.7	Low	118 Å²	118	108.1 Å²	108.1	62%	0.618	58%	0.581	S	S	*	*	H	α-helix	trans	-88.3	-25.9	176.6	-70.1	170.2	0	0	0	113.2	L25 P31	L25-L28 PolarHBondContact O-N 2.9Å; L28-P31 WeakPolarHBondContact O-CD 3.4Å
29	L	67.4	Low	63.3	Low	98 Å²	98	109.8 Å²	109.8	51%	0.513	59%	0.589	S	S	.	*	H	α-helix	trans	-82.8	-28.7	-179.5	-70.1	170.3	0	0	0	113.6	L25 L32 I33	L25-L29 PolarHBondContact O-N 3.23Å; L29-L32 PolarHBondContact O-N 2.96Å; L29-I33 WeakPolarHBondContact O-CG1 3.43Å; L29-I33 PolarHBondContact O-N 3.32Å; L29-I33 VanDerWaalsContact O-N 3.16Å
30	A	70.6	Confident	62.9	Low	63 Å²	63	105.9 Å²	105.9	52%	0.521	59%	0.585	S	S	.	*	H	α-helix	trans	-60.6	-44.5	178.8	0	0	0	0	0	115	L34	A30-L34 PolarHBondContact O-N 3.47Å
31	P	70.9	Confident	62.6	Low	76 Å²	76	108.5 Å²	108.5	49%	0.494	59%	0.59	S	S	.	*	H	α-helix	trans	-74.1	-27	177.9	26.1	-32.5	0	0	0	113.4	S27 L28 L34 L35	S27-P31 VanDerWaalsContact O-CD 3.31Å; S27-P31 WeakPolarHBondContact O-CD 3.18Å; L28-P31 WeakPolarHBondContact O-CD 3.4Å; P31-L34 PolarHBondContact O-N 3.37Å; P31-L35 WeakPolarHBondContact O-CB 3.38Å; P31-L35 PolarHBondContact O-N 3.09Å
32	L	69.4	Low	61.7	Low	103 Å²	103	112.5 Å²	112.5	54%	0.539	61%	0.614	S	S	.	*	H	α-helix	trans	-70	-37.4	176.3	-88.6	159.2	0	0	0	112.2	L29 L35 H36	L29-L32 PolarHBondContact O-N 2.96Å; L32-L35 PolarHBondContact O-N 3.48Å; L32-H36 PolarHBondContact O-N 3.28Å; L32-H36 VanDerWaalsContact O-N 3.15Å
33	I	73.9	Confident	60.7	Low	104 Å²	104	113.4 Å²	113.4	53%	0.533	63%	0.63	S	S	.	*	H	α-helix	trans	-69.8	-38.3	174.3	-65.8	167.1	0	0	0	110.7	L29 L35 H36 L37	L29-I33 WeakPolarHBondContact O-CG1 3.43Å; L29-I33 PolarHBondContact O-N 3.32Å; L29-I33 VanDerWaalsContact O-N 3.16Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 2.79Å; I33-H36 PolarHBondContact O-N 2.91Å; I33-L37 HydrophobicContact CG2-CD1 4.11Å; I33-L37 WeakPolarHBondContact O-CG 3.42Å; I33-L37 PolarHBondContact O-N 3.32Å
34	L	67.3	Low	59.7	Low	109 Å²	109	113.9 Å²	113.9	57%	0.571	64%	0.637	S	S	*	*	H	α-helix	trans	-65.9	-35.2	176.1	-162.3	72.6	0	0	0	112.3	A30 P31 L37 L38	A30-L34 PolarHBondContact O-N 3.47Å; P31-L34 PolarHBondContact O-N 3.37Å; L34-L37 PolarHBondContact O-N 3.35Å; L34-L38 HydrophobicContact CG-CD1 4.27Å; L34-L38 WeakPolarHBondContact O-CD1 3.32Å; L34-L38 VanDerWaalsContact O-CG 3.26Å; L34-L38 WeakPolarHBondContact O-CG 3.37Å; L34-L38 PolarHBondContact O-N 3.46Å
35	L	67.5	Low	58.5	Low	117 Å²	117	113.6 Å²	113.6	61%	0.613	65%	0.646	S	S	*	*	H	α-helix	trans	-71.4	-33.6	176.4	-157.2	74.6	0	0	0	112.4	P31 L32 I33 T39	P31-L35 WeakPolarHBondContact O-CB 3.38Å; P31-L35 PolarHBondContact O-N 3.09Å; L32-L35 PolarHBondContact O-N 3.48Å; I33-L35 VanDerWaalsContact C-N 3.34Å; I33-L35 PolarHBondContact O-N 2.79Å; L35-T39 WeakPolarHBondContact O-CG2 3.47Å; L35-T39 PolarHBondContact O-N 3.22Å; L35-T39 PolarHBondContact O-OG1 3.28Å
36	H	71.2	Confident	57.4	Low	140 Å²	140	113.1 Å²	113.1	65%	0.648	65%	0.653	S	S	*	*	H	α-helix	trans	-70.7	-37.3	172.7	-97.4	-46	0	0	0	112.7	L32 I33 L38 T39	L32-H36 PolarHBondContact O-N 3.28Å; L32-H36 VanDerWaalsContact O-N 3.15Å; I33-H36 PolarHBondContact O-N 2.91Å; H36-L38 VanDerWaalsContact C-N 3.32Å; H36-L38 PolarHBondContact O-N 3.11Å; H36-T39 PolarHBondContact O-N 3.27Å; H36-T39 PolarHBondContact O-OG1 3.12Å; H36-T39 VanDerWaalsContact O-OG1 3.08Å
37	L	65.8	Low	56.5	Low	119 Å²	119	114.9 Å²	114.9	62%	0.623	66%	0.663	S	S	*	*	H	α-helix	trans	-73.5	-21.4	177.9	-67.6	174.4	0	0	0	113.8	I33 L34	I33-L37 HydrophobicContact CG2-CD1 4.11Å; I33-L37 WeakPolarHBondContact O-CG 3.42Å; I33-L37 PolarHBondContact O-N 3.32Å; L34-L37 PolarHBondContact O-N 3.35Å
38	L	59.8	Low	55.1	Low	121 Å²	121	119.8 Å²	119.8	63%	0.634	68%	0.682	S	S	*	*	H	α-helix	trans	-88.3	-17.9	177.4	-71.3	170.4	0	0	0	113.7	L34 H36	L34-L38 HydrophobicContact CG-CD1 4.27Å; L34-L38 WeakPolarHBondContact O-CD1 3.32Å; L34-L38 VanDerWaalsContact O-CG 3.26Å; L34-L38 WeakPolarHBondContact O-CG 3.37Å; L34-L38 PolarHBondContact O-N 3.46Å; H36-L38 VanDerWaalsContact C-N 3.32Å; H36-L38 PolarHBondContact O-N 3.11Å
39	T	52.8	Low	53.8	Low	98 Å²	98	126 Å²	126	60%	0.601	70%	0.697	S	S	*	*	H	α-helix	trans	-85.6	-16.4	179.9	39.5	0	0	0	0	113.4	L35 H36 R41	L35-T39 WeakPolarHBondContact O-CG2 3.47Å; L35-T39 PolarHBondContact O-N 3.22Å; L35-T39 PolarHBondContact O-OG1 3.28Å; H36-T39 PolarHBondContact O-N 3.27Å; H36-T39 PolarHBondContact O-OG1 3.12Å; H36-T39 VanDerWaalsContact O-OG1 3.08Å; T39-R41 PolarHBondContact O-N 2.67Å
40	D	46.3	Very low	51.9	Low	148 Å²	148	125.2 Å²	125.2	79%	0.791	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	5.3	179	-102.1	-13.9	0	0	0	115.4
41	R	46.9	Very low	49.8	Very low	226 Å²	226	127.7 Å²	127.7	85%	0.853	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.9	28.2	-176.7	-74.9	-160.4	-176.3	-150.5	2.7	116.3	T39	T39-R41 PolarHBondContact O-N 2.67Å
42	C	39.5	Very low	48.8	Very low	128 Å²	128	128.9 Å²	128.9	87%	0.865	73%	0.734	S	S	*	*			trans	-133.8	72.4	169.8	-81	0	0	0	0	111.5
43	A	37.8	Very low	46.9	Very low	98 Å²	98	135.3 Å²	135.3	81%	0.81	75%	0.751	S	S	*	*			trans	-103.6	130.9	155.4	0	0	0	0	0	108.8
44	S	40.4	Very low	44.8	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	76%	0.763	S	S	*	*			trans	-64.5	164.1	-168.4	11.3	0	0	0	0	115.6
45	P	37.7	Very low	43	Very low	129 Å²	129	141.9 Å²	141.9	84%	0.838	78%	0.778	S	S	*	*				-134	151.5	125	26.2	-8.6	0	0	0	115.3
46	S	35.2	Very low	41.2	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	79%	0.789	S	S	*	*			trans	-77	177	-178.1	-58.6	0	0	0	0	113.8
47	P	40.5	Very low	39.2	Very low	121 Å²	121	148.3 Å²	148.3	79%	0.786	80%	0.8	S	S	*	*			trans	-97.6	159.9	-145.1	38.9	-36.4	0	0	0	115.4
48	I	35	Very low	37.4	Very low	176 Å²	176	148.9 Å²	148.9	90%	0.903	81%	0.808	S	S	*	*			trans	-127.3	138.4	165.1	-60.1	-179.2	0	0	0	110.6
49	R	33.5	Very low	36	Very low	249 Å²	249	148.5 Å²	148.5	94%	0.94	82%	0.816	S	S	*	*			trans	-94.1	142.3	-172.9	-164.4	-178.1	-161.6	-160.3	4.9	110.4
50	G	26.9	Very low	34.9	Very low	81 Å²	81	152.4 Å²	152.4	84%	0.835	83%	0.827	S	S	*	*			trans	163.2	115.4	165.3	0	0	0	0	0	115.5
51	S	28.2	Very low	34	Very low	114 Å²	114	156.8 Å²	156.8	80%	0.797	83%	0.832	S	S	*	*			trans	-99.8	-168.9	178.4	-172.9	0	0	0	0	110.2
52	P	49.3	Very low	33.1	Very low	102 Å²	102	157.4 Å²	157.4	66%	0.662	84%	0.835	S	S	*	*				-121.5	170.2	-71.3	35.2	-20.8	0	0	0	113
53	R	29.9	Very low	32.6	Very low	237 Å²	237	155.9 Å²	155.9	89%	0.894	83%	0.831	S	S	*	*			trans	160.2	121.2	132.3	-91.4	172.4	175.4	-174.5	-0.4	114.3
54	N	29.9	Very low	32.1	Very low	147 Å²	147	156.4 Å²	156.4	79%	0.786	84%	0.835	S	S	*	*				38.9	123.5	123.8	-140.8	7.3	0	0	0	120.6
55	K	29.8	Very low	31.4	Very low	204 Å²	204	154.1 Å²	154.1	89%	0.887	83%	0.83	S	S	*	*				-179.5	136.2	121.2	-98.1	171.7	-172.9	-175	0	113.4
56	R	29.5	Very low	31	Very low	227 Å²	227	157.9 Å²	157.9	86%	0.857	84%	0.836	S	S	*	*			trans	-58.9	153.7	160.6	-80.3	173.3	169	-172.1	-3.9	112.4
57	L	28.1	Very low	30.6	Very low	165 Å²	165	155.9 Å²	155.9	86%	0.864	83%	0.833	S	S	*	*				176.6	117.1	129.5	-113.6	97.2	0	0	0	106.2
58	V	29.4	Very low	30	Very low	131 Å²	131	156.8 Å²	156.8	79%	0.794	84%	0.836	S	S	*	*				38.3	109.3	81.1	-171.1	0	0	0	0	114.8
59	S	28.7	Very low	29.8	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	83%	0.833	S	S	*	*			trans	-165.2	127.1	134.6	66	0	0	0	0	112.1
60	E	30.1	Very low	29.7	Very low	180 Å²	180	150.8 Å²	150.8	84%	0.841	83%	0.833	S	S	*	*			trans	-63.9	154.8	158.9	-61.9	167.4	121.1	0	0	111.8
61	R	27.9	Very low	29.8	Very low	239 Å²	239	150.8 Å²	150.8	90%	0.902	83%	0.832	S	S	*	*				177.2	119.5	124.5	-97	172.6	-172	-156.9	3.4	113
62	R	28.3	Very low	29.8	Very low	240 Å²	240	150 Å²	150	91%	0.906	83%	0.833	S	S	*	*				32.1	124.3	128.3	-79.2	-177.5	178.3	179.2	-0.4	121.8
63	A	27.8	Very low	29	Very low	95 Å²	95	151.9 Å²	151.9	79%	0.785	84%	0.842	S	S	*	*				96.1	143	111.6	0	0	0	0	0	122.2
64	A	28.6	Very low	29	Very low	109 Å²	109	146.5 Å²	146.5	90%	0.901	84%	0.836	S	S	*	*			trans	73.8	136.3	166.8	0	0	0	0	0	116.3
65	G	25.4	Very low	29	Very low	66 Å²	66	144.6 Å²	144.6	68%	0.68	84%	0.84	S	S	*	*			cis	147.3	153	9.4	0	0	0	0	0	108.8
66	H	28.1	Very low	29.1	Very low	207 Å²	207	141.6 Å²	141.6	96%	0.958	84%	0.839	S	S	*	*			trans	93.1	133.5	164.8	-74.4	68.3	0	0	0	122.3
67	G	27.4	Very low	29.2	Very low	70 Å²	70	142.6 Å²	142.6	72%	0.722	84%	0.842	S	S	*	*			trans	120.7	73	152.4	0	0	0	0	0	115.3
68	V	28	Very low	29.5	Very low	139 Å²	139	139.7 Å²	139.7	84%	0.842	84%	0.842	S	S	*	*				33.5	117.2	100	-169.2	0	0	0	0	116.5
69	A	31.7	Very low	29.7	Very low	103 Å²	103	136.7 Å²	136.7	85%	0.851	84%	0.838	S	S	*	*			trans	-156.7	121.7	142.3	0	0	0	0	0	110.1
70	E	30	Very low	29.9	Very low	197 Å²	197	137.4 Å²	137.4	92%	0.921	84%	0.84	S	S	*	*			trans	-77	154.2	173.7	-70.3	176.4	136.6	0	0	112
71	G	28.8	Very low	30.1	Very low	80 Å²	80	134.2 Å²	134.2	83%	0.825	83%	0.833	S	S	*	*			trans	-161	96.4	168	0	0	0	0	0	110.2
72	A	29.8	Very low	30.2	Very low	99 Å²	99	128.3 Å²	128.3	82%	0.818	82%	0.823	S	S	*	*			trans	-76.3	140.9	-179.2	0	0	0	0	0	112.6
73	V	32.4	Very low	30.3	Very low	140 Å²	140	128.1 Å²	128.1	85%	0.848	82%	0.822	S	S	*	*			trans	-142.2	114.3	152.6	-173.5	0	0	0	0	110.4
74	T	30.3	Very low	30.4	Very low	125 Å²	125	131.9 Å²	131.9	77%	0.767	82%	0.824	S	S	*	*			trans	-3.9	126.4	161.7	50.3	0	0	0	0	120.7
75	A	29.8	Very low	30.5	Very low	106 Å²	106	134.8 Å²	134.8	88%	0.876	82%	0.823	S	S	*	*			trans	-88.8	138.4	162	0	0	0	0	0	111.4
76	V	32	Very low	31	Very low	142 Å²	142	137.2 Å²	137.2	86%	0.861	83%	0.827	S	S	*	*			trans	-110.8	125.5	167.4	175.7	0	0	0	0	108.5
77	R	31.6	Very low	31.2	Very low	247 Å²	247	136.3 Å²	136.3	93%	0.932	82%	0.823	S	S	*	*			trans	-76.5	141.7	174.2	-84.4	174.6	163.9	175.3	-4.6	111
78	A	33.2	Very low	31.4	Very low	104 Å²	104	142 Å²	142	86%	0.86	83%	0.831	S	S	*	*			trans	-143.2	131.4	150.3	0	0	0	0	0	108.8
79	G	32.9	Very low	31.7	Very low	68 Å²	68	141 Å²	141	70%	0.701	83%	0.83	S	S	*	*			trans	-79.1	179.4	-169.2	0	0	0	0	0	115.4
80	P	34.8	Very low	32	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90.3	131.9	-171.1	34.4	-29.4	0	0	0	111.5
81	T	32.5	Very low	32.3	Very low	114 Å²	114	137 Å²	137	70%	0.699	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-101	116.9	170.6	-46.4	0	0	0	0	109
82	V	30.9	Very low	32.7	Very low	115 Å²	115	142.3 Å²	142.3	70%	0.697	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-72.7	129	174.4	172.8	0	0	0	0	109.2	Q84	V82-Q84 HydrophobicContact CG1-CG 4.28Å
83	W	29.7	Very low	33.7	Very low	235 Å²	235	143 Å²	143	89%	0.89	82%	0.818	S	S	*	*			trans	-124.9	110.4	164.4	-70.7	104	0	0	0	108.3
84	Q	31.3	Very low	34.3	Very low	175 Å²	175	141.6 Å²	141.6	82%	0.818	81%	0.812	S	S	*	*			trans	-96.6	135.3	169	-77.1	177	-38.9	0	0	109.1	V82	V82-Q84 HydrophobicContact CG1-CG 4.28Å
85	L	30.7	Very low	34.8	Very low	169 Å²	169	141.6 Å²	141.6	89%	0.885	81%	0.814	S	S	*	*			trans	-165.3	158.3	159.8	-95.4	-165.8	0	0	0	108.6
86	P	34.8	Very low	35.2	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	81%	0.814	S	S	*	*				-109.9	171.1	-108.5	34.4	-24.3	0	0	0	115.9
87	E	32.2	Very low	35.3	Very low	187 Å²	187	146 Å²	146	87%	0.874	81%	0.812	S	S	*	*			trans	-52.6	132.1	171.1	-72.1	177.6	133.9	0	0	113.4
88	E	32.3	Very low	35.5	Very low	190 Å²	190	141.9 Å²	141.9	89%	0.888	81%	0.808	S	S	*	*				166.9	122.8	117.7	-91.3	-174.1	173	0	0	108.1
89	S	34.8	Very low	35.6	Very low	117 Å²	117	143 Å²	143	82%	0.818	80%	0.804	S	S	*	*			trans	-128.8	128.1	172.5	-60.7	0	0	0	0	107.9
90	P	36.5	Very low	35.7	Very low	116 Å²	116	145.9 Å²	145.9	75%	0.753	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.9	133.8	177	27.2	-30.1	0	0	0	110.3	F92	P90-F92 PolarHBondContact O-N 3.18Å
91	A	36.5	Very low	35.6	Very low	102 Å²	102	143.2 Å²	143.2	84%	0.843	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64.4	122.6	-179.5	0	0	0	0	0	111.7
92	F	38.1	Very low	36	Very low	190 Å²	190	144.1 Å²	144.1	83%	0.833	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-78.8	136.7	164.3	-75.2	-87.5	0	0	0	109.4	P90	P90-F92 PolarHBondContact O-N 3.18Å
93	P	50	Low	36.4	Very low	113 Å²	113	149.5 Å²	149.5	73%	0.734	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.1	150.4	177	27.9	-32.7	0	0	0	111.2
94	P	45.1	Very low	37.1	Very low	111 Å²	111	145.9 Å²	145.9	72%	0.721	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.3	149.7	-177.4	26.5	-33.3	0	0	0	111.5	Q96	P94-Q96 PolarHBondContact O-N 3.04Å
95	P	41.3	Very low	37.7	Very low	126 Å²	126	142.5 Å²	142.5	82%	0.818	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.7	126.4	178.4	-11.7	26	0	0	0	109.8
96	Q	37.5	Very low	38.3	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.6	133.4	170.1	-67.6	177.9	-2.9	0	0	109.4	P94 L98	P94-Q96 PolarHBondContact O-N 3.04Å; Q96-L98 PolarHBondContact O-N 3.05Å
97	D	34.7	Very low	38.6	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	80%	0.801	S	S	*	*			trans	-57.3	96.6	175.9	-69.4	-46.9	0	0	0	111	V99	D97-V99 VanDerWaalsContact C-N 3.3Å; D97-V99 PolarHBondContact O-N 2.99Å
98	L	34.8	Very low	39.4	Very low	161 Å²	161	138.7 Å²	138.7	84%	0.843	79%	0.789	S	S	*	*			trans	-71.5	93	164.2	-84.3	164.3	0	0	0	107.8	Q96 V100	Q96-L98 PolarHBondContact O-N 3.05Å; L98-V100 VanDerWaalsContact C-N 3.27Å; L98-V100 PolarHBondContact O-N 3.19Å
99	V	36.1	Very low	40.4	Very low	127 Å²	127	132.1 Å²	132.1	77%	0.77	76%	0.764	S	S	*	*			trans	-59.2	92.7	163.8	179.8	0	0	0	0	108	D97 S101	D97-V99 VanDerWaalsContact C-N 3.3Å; D97-V99 PolarHBondContact O-N 2.99Å; V99-S101 PolarHBondContact O-N 3.38Å
100	V	34.6	Very low	41.4	Very low	129 Å²	129	133.2 Å²	133.2	78%	0.782	77%	0.769	S	S	*	*			trans	-69.4	103.3	169.9	-179.6	0	0	0	0	107.1	L98	L98-V100 VanDerWaalsContact C-N 3.27Å; L98-V100 PolarHBondContact O-N 3.19Å
101	S	33.8	Very low	42.6	Very low	73 Å²	73	133.3 Å²	133.3	51%	0.51	76%	0.763	S	S	.	*			trans	-55.2	133.6	167.8	-64.3	0	0	0	0	109.5	V99 R103	V99-S101 PolarHBondContact O-N 3.38Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 3.45Å
102	P	39.5	Very low	44.1	Very low	134 Å²	134	130 Å²	130	87%	0.87	74%	0.738	S	S	*	*			trans	-73.9	84.4	179	29.8	-31.7	0	0	0	109	L104	P102-L104 PolarHBondContact O-N 2.74Å
103	R	40.3	Very low	46	Very low	227 Å²	227	128.9 Å²	128.9	86%	0.857	74%	0.736	S	S	*	*			trans	-86.3	109.8	171.1	-71.3	-168.6	-170.6	-150.4	3.1	108.9	S101	S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 3.45Å
104	L	43.8	Very low	47.9	Very low	160 Å²	160	124.4 Å²	124.4	84%	0.838	71%	0.71	S	S	*	*			trans	52.3	85.5	162.2	-109	71.1	0	0	0	114.3	P102 G106	P102-L104 PolarHBondContact O-N 2.74Å; L104-G106 VanDerWaalsContact C-N 3.28Å; L104-G106 PolarHBondContact O-N 2.85Å
105	A	43.6	Very low	50.3	Low	104 Å²	104	122 Å²	122	86%	0.86	70%	0.695	S	S	*	*			trans	-52	103.2	146.5	0	0	0	0	0	107	K107	A105-K107 PolarHBondContact O-N 2.92Å
106	G	43.6	Very low	53	Low	58 Å²	58	119.8 Å²	119.8	60%	0.598	67%	0.673	S	S	*	*			trans	-53.3	133.6	174	0	0	0	0	0	108	L104 I108	L104-G106 VanDerWaalsContact C-N 3.28Å; L104-G106 PolarHBondContact O-N 2.85Å; G106-I108 PolarHBondContact O-N 3.14Å
107	K	42.1	Very low	55.9	Low	210 Å²	210	113.4 Å²	113.4	91%	0.913	64%	0.642	S	S	*	*			trans	-45.7	107.7	171.4	-83.5	175.2	172.8	176.4	0	108	A105 S109	A105-K107 PolarHBondContact O-N 2.92Å; K107-S109 PolarHBondContact O-N 3.43Å
108	I	47.4	Very low	58.9	Low	125 Å²	125	108.6 Å²	108.6	64%	0.641	62%	0.616	S	S	*	*			trans	-54.1	117.5	168.6	-64.1	170.3	0	0	0	104.3	G106	G106-I108 PolarHBondContact O-N 3.14Å
109	S	53.3	Low	62	Low	52 Å²	52	101 Å²	101	36%	0.364	58%	0.577	S	S	.	*			trans	-54.4	139.2	175.7	80.5	0	0	0	0	107.2	K107 L111 G112	K107-S109 PolarHBondContact O-N 3.43Å; S109-L111 PolarHBondContact O-N 3.46Å; S109-G112 PolarHBondContact O-N 3.32Å; S109-G112 PolarHBondContact OG-O 3.11Å
110	P	56.3	Low	64.9	Low	141 Å²	141	98.4 Å²	98.4	92%	0.916	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-4.1	-178.6	20.2	-30.2	0	0	0	113.9
111	L	61.9	Low	68	Low	118 Å²	118	92.3 Å²	92.3	62%	0.618	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	4.9	176	-64	166.3	0	0	0	113.9	S109 L173	S109-L111 PolarHBondContact O-N 3.46Å; L111-L173 HydrophobicContact CB-CD1 3.9Å; L111-L173 HydrophobicContact CB-CD2 4.15Å; L111-L173 HydrophobicContact CB-CG 4.43Å; L111-L173 HydrophobicContact CD1-CD1 3.78Å; L111-L173 HydrophobicContact CG-CD1 4.47Å
112	G	67.3	Low	71.1	Confident	32 Å²	32	88.9 Å²	88.9	33%	0.33	50%	0.495	S	S	.	.			trans	85.8	175.5	178.4	0	0	0	0	0	114.8	S109 G114	S109-G112 PolarHBondContact O-N 3.32Å; S109-G112 PolarHBondContact OG-O 3.11Å; G112-G114 PolarHBondContact O-N 3.46Å
113	E	78.4	Confident	73.9	Confident	167 Å²	167	82.5 Å²	82.5	78%	0.78	45%	0.454	S	S	*	.	S	Bend	trans	-77.7	110.9	167.2	-75.3	-172.6	177.4	0	0	108.6
114	G	90.8	Very high	76.7	Confident	18 Å²	18	71.7 Å²	71.7	19%	0.186	41%	0.413	C	S	.	.			trans	-55.1	146.7	-179.5	0	0	0	0	0	113	G112 K171 T172	G112-G114 PolarHBondContact O-N 3.46Å; G114-K171 WeakPolarHBondContact O-CD 3.38Å; G114-T172 CarbonylContact C-O 3.57Å; G114-T172 WeakPolarHBondContact CA-O 3.45Å
115	S	96	Very high	79.3	Confident	60 Å²	60	64.1 Å²	64.1	42%	0.42	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	155.7	-178.3	59.5	0	0	0	0	111.6	K171 T172	S115-K171 WeakPolarHBondContact O-CA 3.45Å; S115-T172 PolarHBondContact N-O 3.05Å; S115-T172 PolarHBondContact O-N 3.49Å; S115-T172 PolarHBondContact O-OG1 3.35Å; S115-T172 VanDerWaalsContact O-OG1 3.1Å
116	K	97.8	Very high	82	Confident	80 Å²	80	59.1 Å²	59.1	35%	0.348	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	115.1	172.5	-64.6	-172.4	-177.1	174.8	0	108.7	R166 D167 M169 K171	K116-R166 HydrophobicContact CB-CG 4.26Å; K116-D167 PolarHBondContact NZ-O 2.96Å; K116-D167 IonicContact NZ-OD1 3.63Å; K116-M169 VanDerWaalsContact CD-O 3.29Å; K116-M169 WeakPolarHBondContact CD-O 3.49Å; K116-M169 WeakPolarHBondContact CE-O 3.49Å; K116-M169 WeakPolarHBondContact CG-O 3.32Å; K116-K171 HydrophobicContact CG-CG 4.09Å
117	K	97.4	Very high	84.6	Confident	51 Å²	51	59.6 Å²	59.6	22%	0.222	32%	0.318	C	S	.	.			trans	-106.9	147.5	176.6	-61.2	-178.1	-179.8	-179.5	0	109.2	M169 E174	K117-M169 WeakPolarHBondContact O-CB 3.29Å; K117-M169 WeakPolarHBondContact O-CG 3.43Å; K117-E174 IonicContact NZ-OE1 2.63Å; K117-E174 IonicContact NZ-OE2 3.04Å; K117-E174 PolarHBondContact NZ-OE2 3.1Å
118	L	98.6	Very high	87.3	Confident	53 Å²	53	51.3 Å²	51.3	28%	0.277	28%	0.282	S	S	.	.			trans	-60.5	150.2	167.2	-72.6	172.2	0	0	0	109.9	Q120 Y165 R166 M198	L118-Q120 PolarHBondContact O-N 3.03Å; L118-Y165 HydrophobicContact CD2-CD1 3.7Å; L118-Y165 HydrophobicContact CD2-CE1 4.28Å; L118-R166 HydrophobicContact CD2-CB 3.86Å; L118-R166 HydrophobicContact CD2-CG 4.45Å; L118-R166 HydrophobicContact CG-CB 4.41Å; L118-M198 HydrophobicContact CB-SD 4.2Å; L118-M198 HydrophobicContact CD1-CG 3.89Å; L118-M198 HydrophobicContact CD1-SD 4.07Å; L118-M198 HydrophobicContact CD2-SD 4.06Å; L118-M198 HydrophobicContact CG-SD 4.35Å
119	P	98.6	Very high	89.7	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.019	25%	0.253	C	S	.	.			trans	-68.9	126.4	-174.3	26.4	-33	0	0	0	112	A121 L122 Y165 M169 T178 E180 M198	P119-A121 VanDerWaalsContact C-N 3.33Å; P119-L122 HydrophobicContact CB-CD2 3.75Å; P119-L122 HydrophobicContact CG-CD2 3.56Å; P119-Y165 HydrophobicContact CG-CE1 3.75Å; P119-Y165 WeakPolarHBondContact CG-OH 3.39Å; P119-M169 HydrophobicContact CB-SD 4.39Å; P119-M169 HydrophobicContact CG-CE 4.49Å; P119-M169 HydrophobicContact CG-SD 4.25Å; P119-T178 VanDerWaalsContact CA-O 3.25Å; P119-T178 WeakPolarHBondContact CA-O 3.42Å; P119-T178 HydrophobicContact CB-CG2 4.34Å; P119-T178 WeakPolarHBondContact CB-O 3.34Å; P119-E180 HydrophobicContact CG-CG 4.42Å; P119-M198 HydrophobicContact CG-CE 4.43Å
120	Q	98.8	Very high	91.8	Very high	72 Å²	72	44.4 Å²	44.4	34%	0.336	25%	0.249	S	C	.	.	S	Bend	trans	-79.7	-21.3	175.1	-55.2	86.7	-12.1	0	0	111.8	L118 I177 T178 K203	L118-Q120 PolarHBondContact O-N 3.03Å; Q120-I177 HydrophobicContact CB-CG2 4.35Å; Q120-T178 PolarHBondContact N-O 3.29Å; Q120-T178 VanDerWaalsContact N-O 3.16Å; Q120-T178 PolarHBondContact OE1-O 3.07Å; Q120-K203 PolarHBondContact O-N 3.17Å
121	A	98.9	Very high	93.9	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.008	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.2	175.7	0	0	0	0	0	112.9	P119 I177 M179 K203 L296	P119-A121 VanDerWaalsContact C-N 3.33Å; A121-I177 HydrophobicContact CB-CG2 4.36Å; A121-M179 HydrophobicContact CB-CE 3.89Å; A121-M179 HydrophobicContact CB-CG 4.21Å; A121-M179 HydrophobicContact CB-SD 4.49Å; A121-M179 WeakPolarHBondContact O-CA 3.47Å; A121-K203 CarbonylContact C-O 3.58Å; A121-K203 WeakPolarHBondContact CA-O 3.47Å; A121-K203 HydrophobicContact CB-CB 4.09Å; A121-L296 HydrophobicContact CB-CD2 3.48Å; A121-L296 VanDerWaalsContact CB-CD2 3.48Å
122	L	98.9	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.6	-176.1	-61	178.1	0	0	0	111.3	P119 I124 F154 E180 I195 T202 K203 L204 I205	P119-L122 HydrophobicContact CB-CD2 3.75Å; P119-L122 HydrophobicContact CG-CD2 3.56Å; L122-I124 HydrophobicContact CB-CG2 3.72Å; L122-I124 PolarHBondContact O-N 2.79Å; L122-F154 HydrophobicContact CD1-CE2 4.13Å; L122-E180 HydrophobicContact CD2-CG 3.47Å; L122-E180 VanDerWaalsContact CD2-CG 3.47Å; L122-I195 HydrophobicContact CD1-CD1 3.85Å; L122-I195 HydrophobicContact CD1-CG1 4.02Å; L122-I195 HydrophobicContact CD1-CG2 3.66Å; L122-T202 HydrophobicContact CD1-CG2 3.87Å; L122-T202 HydrophobicContact CG-CG2 3.87Å; L122-K203 PolarHBondContact N-O 2.93Å; L122-L204 HydrophobicContact CB-CD2 4.23Å; L122-L204 HydrophobicContact CD1-CD2 4.37Å; L122-I205 PolarHBondContact O-N 3.38Å
123	I	98.9	Very high	97	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	94.3	165.1	-57.1	169.7	0	0	0	108.1	T131 L134 L135 L138 M179 E180 K181 T182 I205 V207	I123-T131 HydrophobicContact CG2-CG2 3.74Å; I123-L134 HydrophobicContact CD1-CB 4.47Å; I123-L134 HydrophobicContact CD1-CD2 3.93Å; I123-L134 HydrophobicContact CD1-CG 4.04Å; I123-L134 HydrophobicContact CG1-CD2 4.33Å; I123-L135 HydrophobicContact CD1-CB 4.01Å; I123-L135 HydrophobicContact CD1-CD1 3.97Å; I123-L138 HydrophobicContact CD1-CD1 4.38Å; I123-M179 HydrophobicContact CG1-CE 4.24Å; I123-E180 PolarHBondContact N-O 2.93Å; I123-K181 HydrophobicContact CB-CB 3.61Å; I123-K181 HydrophobicContact CD1-CB 4.33Å; I123-K181 HydrophobicContact CG1-CB 4.47Å; I123-K181 HydrophobicContact CG2-CB 4.07Å; I123-K181 VanDerWaalsContact O-CA 3.32Å; I123-K181 WeakPolarHBondContact O-CA 3.4Å; I123-T182 PolarHBondContact O-N 3.38Å; I123-T182 VanDerWaalsContact O-N 3.07Å; I123-I205 CarbonylContact C-O 3.57Å; I123-I205 WeakPolarHBondContact CA-O 3.48Å; I123-I205 HydrophobicContact CG1-CB 4.17Å; I123-I205 HydrophobicContact CG1-CD1 4.47Å; I123-I205 HydrophobicContact CG1-CG2 4.48Å; I123-V207 HydrophobicContact CG2-CG2 4.28Å
124	I	98.9	Very high	98	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-13.7	-170.6	60.4	170.8	0	0	0	113.5	L122 T182 P183 Y185 F186 I195 L204 I205 V206 W264	L122-I124 HydrophobicContact CB-CG2 3.72Å; L122-I124 PolarHBondContact O-N 2.79Å; I124-T182 CarbonylContact C-O 3.53Å; I124-T182 VanDerWaalsContact O-O 3.07Å; I124-P183 CarbonylContact O-C 3.6Å; I124-Y185 HydrophobicContact CG2-CD2 4.22Å; I124-F186 HydrophobicContact CD1-CD2 4.07Å; I124-F186 HydrophobicContact CG1-CD2 4.43Å; I124-F186 WeakPolarHBondContact O-CB 3.48Å; I124-F186 PolarHBondContact O-N 2.95Å; I124-I195 HydrophobicContact CG2-CD1 4.45Å; I124-L204 HydrophobicContact CD1-CB 4.05Å; I124-L204 HydrophobicContact CD1-CD1 4.26Å; I124-L204 HydrophobicContact CG2-CD2 3.9Å; I124-I205 PolarHBondContact N-O 2.76Å; I124-V206 HydrophobicContact CD1-CG2 3.78Å; I124-V206 HydrophobicContact CG1-CG2 3.77Å; I124-W264 HydrophobicContact CB-CH2 3.99Å; I124-W264 HydrophobicContact CB-CZ2 4.15Å; I124-W264 HydrophobicContact CD1-CD2 3.78Å; I124-W264 HydrophobicContact CD1-CE3 3.83Å; I124-W264 HydrophobicContact CD1-CH2 3.5Å; I124-W264 VanDerWaalsContact CD1-CH2 3.5Å; I124-W264 HydrophobicContact CD1-CZ2 3.48Å; I124-W264 VanDerWaalsContact CD1-CZ2 3.48Å; I124-W264 HydrophobicContact CD1-CZ3 3.68Å; I124-W264 HydrophobicContact CG1-CH2 4.34Å; I124-W264 HydrophobicContact CG1-CZ2 4.33Å; I124-W264 HydrophobicContact CG2-CH2 3.8Å; I124-W264 HydrophobicContact CG2-CZ2 4.46Å; I124-W264 HydrophobicContact CG2-CZ3 4.35Å
125	G	98.8	Very high	98.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-178.2	-173.5	0	0	0	0	0	115.2	T131 V206 V207	G125-T131 VanDerWaalsContact O-CG2 3.23Å; G125-T131 WeakPolarHBondContact O-CG2 3.48Å; G125-V206 CarbonylContact O-C 3.45Å; G125-V206 WeakPolarHBondContact O-CA 3.47Å; G125-V207 PolarHBondContact O-N 3.03Å
126	V	98.8	Very high	98.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.			cis	-97.8	159	-11.6	-54.6	0	0	0	0	111.2	K128 G129 F186 V206 V207 R214 I254 Y257	V126-K128 PolarHBondContact O-N 3.2Å; V126-K128 VanDerWaalsContact O-N 3.14Å; V126-G129 PolarHBondContact O-N 3.49Å; V126-F186 HydrophobicContact CG1-CB 4.49Å; V126-F186 HydrophobicContact CG1-CD1 3.42Å; V126-F186 VanDerWaalsContact CG1-CD1 3.42Å; V126-F186 HydrophobicContact CG1-CE1 3.69Å; V126-F186 HydrophobicContact CG1-CG 3.96Å; V126-F186 HydrophobicContact CG1-CZ 4.45Å; V126-V206 HydrophobicContact CG1-CG1 3.74Å; V126-V207 WeakPolarHBondContact CG2-O 3.39Å; V126-V207 PolarHBondContact N-O 2.83Å; V126-R214 HydrophobicContact CG2-CG 4.39Å; V126-I254 HydrophobicContact CB-CG2 4.49Å; V126-Y257 HydrophobicContact CB-CE1 4.29Å; V126-Y257 HydrophobicContact CG1-CD1 4.16Å; V126-Y257 HydrophobicContact CG1-CE1 3.89Å; V126-Y257 HydrophobicContact CG2-CE1 3.86Å
127	K	98.8	Very high	98.5	Very high	68 Å²	68	21 Å²	21	30%	0.296	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	124.6	170.4	-168.1	-170.5	176.7	-164	0	109.1	G129 P183 R214 D218 I254	K127-G129 VanDerWaalsContact C-N 3.3Å; K127-G129 PolarHBondContact O-N 3.44Å; K127-P183 HydrophobicContact CB-CB 4.33Å; K127-R214 WeakPolarHBondContact O-CG 3.36Å; K127-R214 PolarHBondContact O-NH1 2.91Å; K127-D218 WeakPolarHBondContact CD-OD2 3.37Å; K127-D218 WeakPolarHBondContact CE-OD1 3.29Å; K127-D218 IonicContact NZ-OD1 2.55Å; K127-D218 PolarHBondContact NZ-OD1 3.26Å; K127-D218 IonicContact NZ-OD2 3.74Å; K127-D218 PolarHBondContact NZ-OD2 3.05Å; K127-I254 HydrophobicContact CB-CD1 4.48Å; K127-I254 HydrophobicContact CD-CD1 4.03Å
128	K	98.5	Very high	98.5	Very high	36 Å²	36	18.6 Å²	18.6	16%	0.157	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	6.2	-176.8	-43.5	-56.1	-58.5	-168.5	0	116.7	V126 R209 R214 S217 D218 Q221	V126-K128 PolarHBondContact O-N 3.2Å; V126-K128 VanDerWaalsContact O-N 3.14Å; K128-R209 WeakPolarHBondContact O-CD 3.48Å; K128-R214 HydrophobicContact CB-CG 4.06Å; K128-S217 WeakPolarHBondContact CE-O 3.19Å; K128-S217 WeakPolarHBondContact CE-OG 3.33Å; K128-S217 PolarHBondContact NZ-O 2.03Å; K128-D218 HydrophobicContact CG-CB 3.88Å; K128-Q221 VanDerWaalsContact CD-OE1 3.23Å
129	G	98.3	Very high	98.5	Very high	4 Å²	4	18 Å²	18	4%	0.041	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-23.3	178.1	0	0	0	0	0	114.9	V126 K127 V207	V126-G129 PolarHBondContact O-N 3.49Å; K127-G129 VanDerWaalsContact C-N 3.3Å; K127-G129 PolarHBondContact O-N 3.44Å; G129-V207 WeakPolarHBondContact CA-O 3.38Å; G129-V207 VanDerWaalsContact O-CG1 3.29Å; G129-V207 WeakPolarHBondContact O-CG1 3.42Å
130	G	98.1	Very high	98.4	Very high	27 Å²	27	19.3 Å²	19.3	28%	0.278	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	123.4	11.1	-175.9	0	0	0	0	0	114.4	R132 A133 L134	G130-R132 VanDerWaalsContact C-N 3.28Å; G130-R132 PolarHBondContact O-N 2.91Å; G130-R132 VanDerWaalsContact O-N 3.12Å; G130-A133 WeakPolarHBondContact O-CA 3.43Å; G130-A133 WeakPolarHBondContact O-CB 3.04Å; G130-A133 PolarHBondContact O-N 3.34Å; G130-L134 PolarHBondContact O-N 3.09Å
131	T	98.6	Very high	98.4	Very high	11 Å²	11	15.9 Å²	15.9	7%	0.067	8%	0.083	C	C	.	.	H	α-helix	trans	-51.2	-38.4	-176	59.8	0	0	0	0	114.9	I123 G125 L135 K181 P183 V207	I123-T131 HydrophobicContact CG2-CG2 3.74Å; G125-T131 VanDerWaalsContact O-CG2 3.23Å; G125-T131 WeakPolarHBondContact O-CG2 3.48Å; T131-L135 PolarHBondContact O-N 3.3Å; T131-K181 WeakPolarHBondContact O-CD 3.26Å; T131-P183 HydrophobicContact CG2-CB 4.26Å; T131-P183 HydrophobicContact CG2-CG 4.02Å; T131-P183 WeakPolarHBondContact OG1-CG 3.26Å; T131-V207 HydrophobicContact CG2-CB 4.29Å; T131-V207 HydrophobicContact CG2-CG2 4.25Å
132	R	97.9	Very high	98.3	Very high	50 Å²	50	19.2 Å²	19.2	19%	0.189	10%	0.104	C	C	.	.	H	α-helix	trans	-65.7	-45.6	174.4	177.4	61.8	72.5	-161.1	1.3	111.6	G130 L134 L135 E136 G148 K181 L330 K334	G130-R132 VanDerWaalsContact C-N 3.28Å; G130-R132 PolarHBondContact O-N 2.91Å; G130-R132 VanDerWaalsContact O-N 3.12Å; R132-L134 VanDerWaalsContact C-N 3.32Å; R132-L134 PolarHBondContact O-N 3.17Å; R132-L135 PolarHBondContact O-N 3.42Å; R132-E136 WeakPolarHBondContact CD-OE1 3.32Å; R132-E136 HydrophobicContact CG-CG 4.24Å; R132-E136 IonicContact CZ-OE1 2.69Å; R132-E136 IonicContact NE-OE1 3.24Å; R132-E136 IonicContact NH1-OE1 2.9Å; R132-E136 PolarHBondContact NH1-OE1 2.91Å; R132-E136 WeakPolarHBondContact O-CG 3.45Å; R132-E136 PolarHBondContact O-N 3.02Å; R132-G148 PolarHBondContact NH1-O 3.41Å; R132-G148 PolarHBondContact NH2-O 3.3Å; R132-K181 VanDerWaalsContact CZ-NZ 3.35Å; R132-K181 VanDerWaalsContact NH2-NZ 3.19Å; R132-L330 HydrophobicContact CG-CD2 4.1Å; R132-K334 HydrophobicContact CB-CD 4.49Å
133	A	98	Very high	98.3	Very high	16 Å²	16	22.1 Å²	22.1	13%	0.132	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-48.4	178.7	0	0	0	0	0	110.4	G130 L135 E136 F137 L281 L330	G130-A133 WeakPolarHBondContact O-CA 3.43Å; G130-A133 WeakPolarHBondContact O-CB 3.04Å; G130-A133 PolarHBondContact O-N 3.34Å; A133-L135 PolarHBondContact O-N 2.88Å; A133-E136 PolarHBondContact O-N 3.39Å; A133-F137 HydrophobicContact CB-CE2 4.19Å; A133-F137 HydrophobicContact CB-CZ 4.26Å; A133-F137 WeakPolarHBondContact O-CB 3.32Å; A133-F137 WeakPolarHBondContact O-CD1 3.48Å; A133-F137 WeakPolarHBondContact O-CD2 3.45Å; A133-F137 WeakPolarHBondContact O-CG 3.3Å; A133-F137 PolarHBondContact O-N 3.07Å; A133-L281 HydrophobicContact CB-CD2 4.19Å; A133-L330 HydrophobicContact CB-CD1 3.72Å
134	L	98.7	Very high	98.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-57.1	-48.7	178.2	179	61.1	0	0	0	112.1	I123 G130 R132 F137 L138 I205 V207 V276 L281 L289 V292	I123-L134 HydrophobicContact CD1-CB 4.47Å; I123-L134 HydrophobicContact CD1-CD2 3.93Å; I123-L134 HydrophobicContact CD1-CG 4.04Å; I123-L134 HydrophobicContact CG1-CD2 4.33Å; G130-L134 PolarHBondContact O-N 3.09Å; R132-L134 VanDerWaalsContact C-N 3.32Å; R132-L134 PolarHBondContact O-N 3.17Å; L134-F137 PolarHBondContact O-N 2.84Å; L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CG 4.03Å; L134-L138 HydrophobicContact CD2-CD1 4.47Å; L134-L138 HydrophobicContact CG-CD1 3.86Å; L134-L138 HydrophobicContact CG-CG 4.39Å; L134-L138 WeakPolarHBondContact O-CB 3.36Å; L134-L138 WeakPolarHBondContact O-CG 3.43Å; L134-L138 PolarHBondContact O-N 3.2Å; L134-I205 HydrophobicContact CD2-CG2 3.71Å; L134-V207 HydrophobicContact CB-CG2 4.1Å; L134-V207 HydrophobicContact CD2-CG2 3.39Å; L134-V207 HydrophobicContact CG-CG2 4.37Å; L134-V276 HydrophobicContact CD2-CG2 4.24Å; L134-L281 HydrophobicContact CB-CD2 3.99Å; L134-L281 HydrophobicContact CD1-CD1 4.41Å; L134-L289 HydrophobicContact CD1-CD1 4.04Å; L134-L289 HydrophobicContact CD1-CD2 4.07Å; L134-V292 HydrophobicContact CD1-CG2 4.08Å
135	L	98.6	Very high	98.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-44.2	-178.9	-170.6	63.7	0	0	0	112.2	I123 T131 R132 A133 F137 L138 R139 A146 K181	I123-L135 HydrophobicContact CD1-CB 4.01Å; I123-L135 HydrophobicContact CD1-CD1 3.97Å; T131-L135 PolarHBondContact O-N 3.3Å; R132-L135 PolarHBondContact O-N 3.42Å; A133-L135 PolarHBondContact O-N 2.88Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 PolarHBondContact O-N 3.24Å; L135-L138 PolarHBondContact O-N 3.02Å; L135-R139 VanDerWaalsContact O-CG 3.26Å; L135-R139 WeakPolarHBondContact O-CG 3.32Å; L135-R139 PolarHBondContact O-N 3.03Å; L135-R139 VanDerWaalsContact O-N 3.07Å; L135-A146 HydrophobicContact CD1-CB 3.65Å; L135-A146 HydrophobicContact CD2-CB 4.43Å; L135-A146 HydrophobicContact CG-CB 4.28Å; L135-K181 HydrophobicContact CB-CD 4.14Å; L135-K181 HydrophobicContact CD2-CB 4.21Å; L135-K181 HydrophobicContact CD2-CD 3.94Å; L135-K181 HydrophobicContact CD2-CG 3.87Å
136	E	97.9	Very high	98.2	Very high	42 Å²	42	26 Å²	26	20%	0.196	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-37.2	177.5	-62.7	-47.1	130.5	0	0	111.7	R132 A133 L330	R132-E136 WeakPolarHBondContact CD-OE1 3.32Å; R132-E136 HydrophobicContact CG-CG 4.24Å; R132-E136 IonicContact CZ-OE1 2.69Å; R132-E136 IonicContact NE-OE1 3.24Å; R132-E136 IonicContact NH1-OE1 2.9Å; R132-E136 PolarHBondContact NH1-OE1 2.91Å; R132-E136 WeakPolarHBondContact O-CG 3.45Å; R132-E136 PolarHBondContact O-N 3.02Å; A133-E136 PolarHBondContact O-N 3.39Å; E136-L330 HydrophobicContact CB-CD2 4.34Å; E136-L330 HydrophobicContact CG-CD2 3.8Å
137	F	98.4	Very high	98.1	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-69	-41.1	177.3	-61.2	-12.8	0	0	0	111.8	A133 L134 L135 R139 V140 L281 P285 L289 I302 F307 P316 L318	A133-F137 HydrophobicContact CB-CE2 4.19Å; A133-F137 HydrophobicContact CB-CZ 4.26Å; A133-F137 WeakPolarHBondContact O-CB 3.32Å; A133-F137 WeakPolarHBondContact O-CD1 3.48Å; A133-F137 WeakPolarHBondContact O-CD2 3.45Å; A133-F137 WeakPolarHBondContact O-CG 3.3Å; A133-F137 PolarHBondContact O-N 3.07Å; L134-F137 PolarHBondContact O-N 2.84Å; L135-F137 VanDerWaalsContact C-N 3.29Å; L135-F137 PolarHBondContact O-N 3.24Å; F137-R139 VanDerWaalsContact C-N 3.34Å; F137-R139 PolarHBondContact O-N 3.08Å; F137-V140 WeakPolarHBondContact O-CB 3.33Å; F137-V140 WeakPolarHBondContact O-CG2 3.36Å; F137-V140 PolarHBondContact O-N 3.12Å; F137-L281 HydrophobicContact CD2-CD1 4Å; F137-L281 HydrophobicContact CE2-CD1 4.24Å; F137-L281 HydrophobicContact CE2-CG 4.41Å; F137-P285 HydrophobicContact CD2-CB 4.35Å; F137-P285 HydrophobicContact CE2-CB 4.04Å; F137-L289 HydrophobicContact CB-CD1 4.24Å; F137-L289 HydrophobicContact CB-CD2 4.07Å; F137-L289 HydrophobicContact CB-CG 4.21Å; F137-L289 HydrophobicContact CD2-CD2 3.98Å; F137-I302 VanDerWaalsContact O-CD1 3.26Å; F137-I302 WeakPolarHBondContact O-CD1 3.41Å; F137-F307 HydrophobicContact CB-CE1 4.13Å; F137-F307 HydrophobicContact CB-CZ 4.24Å; F137-F307 AromaticContact CD1-CE1 3.77Å; F137-F307 HydrophobicContact CD1-CE1 3.77Å; F137-F307 AromaticContact CD2-CE1 3.68Å; F137-F307 HydrophobicContact CD2-CE1 3.68Å; F137-F307 HydrophobicContact CD2-CZ 4.18Å; F137-F307 HydrophobicContact CE1-CD1 4.46Å; F137-F307 HydrophobicContact CE1-CE1 4.02Å; F137-F307 AromaticContact CE2-CE1 3.94Å; F137-F307 HydrophobicContact CE2-CE1 3.94Å; F137-F307 AromaticContact CG-CE1 3.6Å; F137-F307 HydrophobicContact CG-CE1 3.6Å; F137-F307 HydrophobicContact CG-CZ 4.14Å; F137-F307 HydrophobicContact CZ-CD1 4.44Å; F137-F307 HydrophobicContact CZ-CE1 4.1Å; F137-P316 HydrophobicContact CZ-CG 4.43Å; F137-L318 HydrophobicContact CD1-CD1 4.07Å; F137-L318 HydrophobicContact CD1-CD2 3.69Å; F137-L318 HydrophobicContact CD1-CG 3.75Å; F137-L318 HydrophobicContact CE1-CD2 4.2Å; F137-L318 HydrophobicContact CE1-CG 4.01Å; F137-L318 HydrophobicContact CG-CD2 4.45Å
138	L	98.3	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-34.9	177.6	-77.8	172	0	0	0	113.1	I123 L134 L135 V140 H141 I144 M179 L289 V292	I123-L138 HydrophobicContact CD1-CD1 4.38Å; L134-L138 HydrophobicContact CD1-CD1 3.93Å; L134-L138 HydrophobicContact CD1-CG 4.03Å; L134-L138 HydrophobicContact CD2-CD1 4.47Å; L134-L138 HydrophobicContact CG-CD1 3.86Å; L134-L138 HydrophobicContact CG-CG 4.39Å; L134-L138 WeakPolarHBondContact O-CB 3.36Å; L134-L138 WeakPolarHBondContact O-CG 3.43Å; L134-L138 PolarHBondContact O-N 3.2Å; L135-L138 PolarHBondContact O-N 3.02Å; L138-V140 PolarHBondContact O-N 2.83Å; L138-H141 VanDerWaalsContact O-CB 3.26Å; L138-H141 WeakPolarHBondContact O-CB 3.36Å; L138-H141 PolarHBondContact O-N 3.23Å; L138-I144 HydrophobicContact CB-CD1 3.76Å; L138-I144 HydrophobicContact CB-CG2 4.43Å; L138-I144 HydrophobicContact CD2-CD1 3.66Å; L138-I144 HydrophobicContact CG-CD1 4.2Å; L138-M179 HydrophobicContact CD1-CE 4.1Å; L138-M179 HydrophobicContact CD1-SD 4.36Å; L138-L289 HydrophobicContact CD2-CD1 3.41Å; L138-L289 VanDerWaalsContact CD2-CD1 3.41Å; L138-L289 HydrophobicContact CG-CD1 3.73Å; L138-V292 HydrophobicContact CD1-CG1 3.95Å; L138-V292 HydrophobicContact CD2-CB 4.31Å; L138-V292 HydrophobicContact CD2-CG1 3.63Å; L138-V292 HydrophobicContact CG-CG1 4.34Å
139	R	97.8	Very high	97.7	Very high	40 Å²	40	26.8 Å²	26.8	15%	0.151	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-11.4	177.1	-73.7	172.7	76.1	119	10.1	114.2	L135 F137 H141 A146 E322	L135-R139 VanDerWaalsContact O-CG 3.26Å; L135-R139 WeakPolarHBondContact O-CG 3.32Å; L135-R139 PolarHBondContact O-N 3.03Å; L135-R139 VanDerWaalsContact O-N 3.07Å; F137-R139 VanDerWaalsContact C-N 3.34Å; F137-R139 PolarHBondContact O-N 3.08Å; R139-H141 VanDerWaalsContact C-N 3.25Å; R139-A146 HydrophobicContact CG-CB 4.19Å; R139-A146 PolarHBondContact NH1-O 3.34Å; R139-E322 HydrophobicContact CB-CB 4.15Å; R139-E322 IonicContact CZ-OE2 2.62Å; R139-E322 IonicContact NE-OE2 3.63Å; R139-E322 PolarHBondContact NE-OE2 2.96Å; R139-E322 IonicContact NH2-OE2 3.62Å; R139-E322 PolarHBondContact NH2-OE2 3Å; R139-E322 WeakPolarHBondContact O-CB 3.49Å; R139-E322 WeakPolarHBondContact O-CG 3.46Å
140	V	97.4	Very high	97.8	Very high	31 Å²	31	29.8 Å²	29.8	19%	0.188	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-25.1	170.8	179.7	0	0	0	0	111.5	F137 L138 I302 L318	F137-V140 WeakPolarHBondContact O-CB 3.33Å; F137-V140 WeakPolarHBondContact O-CG2 3.36Å; F137-V140 PolarHBondContact O-N 3.12Å; L138-V140 PolarHBondContact O-N 2.83Å; V140-I302 HydrophobicContact CB-CD1 4.47Å; V140-I302 HydrophobicContact CB-CG1 4.34Å; V140-I302 HydrophobicContact CG1-CG1 4.49Å; V140-L318 HydrophobicContact CG2-CD1 3.76Å; V140-L318 HydrophobicContact CG2-CD2 3.83Å; V140-L318 HydrophobicContact CG2-CG 4.42Å
141	H	98.2	Very high	97.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	17%	0.166	C	C	.	.	S	Bend	trans	-70.6	129.6	178.1	-164.5	-78.9	0	0	0	110.5	L138 R139 D143 I144 Q293 K299 I302	L138-H141 VanDerWaalsContact O-CB 3.26Å; L138-H141 WeakPolarHBondContact O-CB 3.36Å; L138-H141 PolarHBondContact O-N 3.23Å; R139-H141 VanDerWaalsContact C-N 3.25Å; H141-D143 IonicContact CE1-OD2 2.7Å; H141-D143 PolarHBondContact CE1-OD2 3.4Å; H141-D143 VanDerWaalsContact CE1-OD2 3.32Å; H141-D143 PolarHBondContact ND1-N 2.91Å; H141-D143 IonicContact ND1-OD2 3.65Å; H141-D143 PolarHBondContact O-N 2.86Å; H141-D143 VanDerWaalsContact O-N 3.17Å; H141-I144 HydrophobicContact CB-CB 4.23Å; H141-I144 HydrophobicContact CB-CD1 3.94Å; H141-I144 HydrophobicContact CB-CG1 3.96Å; H141-I144 PolarHBondContact O-N 3.4Å; H141-I144 VanDerWaalsContact O-N 3.09Å; H141-Q293 PolarHBondContact CD2-OE1 3.01Å; H141-K299 PolarHBondContact NE2-O 3.45Å; H141-I302 HydrophobicContact CB-CD1 3.9Å; H141-I302 HydrophobicContact CB-CG1 4.34Å
142	P	97.4	Very high	97.8	Very high	71 Å²	71	29.6 Å²	29.6	46%	0.461	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.2	-177.3	24.7	-35	0	0	0	113.4	Q176 I301	P142-Q176 PolarHBondContact O-NE2 3.21Å; P142-I301 HydrophobicContact CG-CD1 3.69Å
143	D	98.3	Very high	97.8	Very high	60 Å²	60	27.3 Å²	27.3	32%	0.321	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	14	180	-51.8	-36.7	0	0	0	114	H141 Q176 I177 L298	H141-D143 IonicContact CE1-OD2 2.7Å; H141-D143 PolarHBondContact CE1-OD2 3.4Å; H141-D143 VanDerWaalsContact CE1-OD2 3.32Å; H141-D143 PolarHBondContact ND1-N 2.91Å; H141-D143 IonicContact ND1-OD2 3.65Å; H141-D143 PolarHBondContact O-N 2.86Å; H141-D143 VanDerWaalsContact O-N 3.17Å; D143-Q176 CarbonylContact O-C 3.54Å; D143-Q176 WeakPolarHBondContact O-CA 3.35Å; D143-I177 PolarHBondContact O-N 2.91Å; D143-L298 HydrophobicContact CB-CD2 3.89Å
144	I	98.2	Very high	97.9	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128.7	174.2	-67	-177.1	0	0	0	109.8	L138 H141 M179 L296 L298	L138-I144 HydrophobicContact CB-CD1 3.76Å; L138-I144 HydrophobicContact CB-CG2 4.43Å; L138-I144 HydrophobicContact CD2-CD1 3.66Å; L138-I144 HydrophobicContact CG-CD1 4.2Å; H141-I144 HydrophobicContact CB-CB 4.23Å; H141-I144 HydrophobicContact CB-CD1 3.94Å; H141-I144 HydrophobicContact CB-CG1 3.96Å; H141-I144 PolarHBondContact O-N 3.4Å; H141-I144 VanDerWaalsContact O-N 3.09Å; I144-M179 HydrophobicContact CD1-SD 4.24Å; I144-M179 HydrophobicContact CG2-SD 3.97Å; I144-L296 HydrophobicContact CD1-CD1 4.2Å; I144-L298 HydrophobicContact CD1-CD1 3.53Å; I144-L298 HydrophobicContact CG1-CD1 3.6Å
145	R	98.3	Very high	97.9	Very high	76 Å²	76	28.1 Å²	28.1	29%	0.287	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.3	170.2	-61.9	-62.8	-66.2	148.9	-3.6	108.7	P170 T172 I177 T178 M179 E322	R145-P170 HydrophobicContact CB-CB 4.41Å; R145-P170 HydrophobicContact CB-CG 3.84Å; R145-T172 HydrophobicContact CB-CG2 3.61Å; R145-T172 HydrophobicContact CG-CG2 3.89Å; R145-I177 PolarHBondContact N-O 3.34Å; R145-T178 CarbonylContact O-C 3.56Å; R145-T178 VanDerWaalsContact O-CA 3.3Å; R145-T178 WeakPolarHBondContact O-CA 3.44Å; R145-M179 PolarHBondContact O-N 3.46Å; R145-E322 IonicContact CZ-OE1 3.74Å; R145-E322 IonicContact NH1-OE1 3.8Å; R145-E322 PolarHBondContact NH1-OE1 3.37Å; R145-E322 IonicContact NH1-OE2 3.24Å
146	A	98	Very high	97.9	Very high	5 Å²	5	36 Å²	36	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.6	-174.3	0	0	0	0	0	114.5	L135 R139 G148 M179	L135-A146 HydrophobicContact CD1-CB 3.65Å; L135-A146 HydrophobicContact CD2-CB 4.43Å; L135-A146 HydrophobicContact CG-CB 4.28Å; R139-A146 HydrophobicContact CG-CB 4.19Å; R139-A146 PolarHBondContact NH1-O 3.34Å; A146-G148 PolarHBondContact O-N 2.91Å; A146-M179 WeakPolarHBondContact CA-O 3.34Å; A146-M179 HydrophobicContact CB-CB 4.18Å; A146-M179 WeakPolarHBondContact CB-O 3.5Å
147	V	97.5	Very high	97.9	Very high	16 Å²	16	36 Å²	36	10%	0.097	19%	0.193	C	C	.	.			trans	-63.2	133.2	169.3	-172.2	0	0	0	0	109.4	P151 M169 M179 E180	V147-P151 HydrophobicContact CB-CG 4.45Å; V147-P151 HydrophobicContact CG1-CG 4.2Å; V147-M169 HydrophobicContact CG2-CE 3.69Å; V147-M169 HydrophobicContact CG2-SD 3.55Å; V147-M169 VanDerWaalsContact CG2-SD 3.55Å; V147-M179 PolarHBondContact N-O 3.03Å; V147-E180 HydrophobicContact CB-CB 4.15Å; V147-E180 HydrophobicContact CG2-CB 4.15Å
148	G	92.5	Very high	97.9	Very high	38 Å²	38	39.1 Å²	39.1	39%	0.392	21%	0.205	S	C	.	.	S	Bend	trans	-73	-46.8	-179.5	0	0	0	0	0	113	R132 A146	R132-G148 PolarHBondContact NH1-O 3.41Å; R132-G148 PolarHBondContact NH2-O 3.3Å; A146-G148 PolarHBondContact O-N 2.91Å
149	A	96.4	Very high	97.9	Very high	67 Å²	67	46.3 Å²	46.3	55%	0.554	24%	0.244	S	C	*	.	S	Bend	trans	-77.1	168.8	176	0	0	0	0	0	112	P151	A149-P151 WeakPolarHBondContact O-CD 3.38Å
150	E	98.6	Very high	98	Very high	68 Å²	68	51.3 Å²	51.3	32%	0.318	26%	0.264	S	S	.	.			trans	-90.1	112.2	170.8	-59.2	-175.9	169	0	0	107.3	H152 K181 P183	E150-H152 VanDerWaalsContact C-N 3.29Å; E150-H152 PolarHBondContact O-CD2 3.48Å; E150-H152 PolarHBondContact O-N 3.49Å; E150-H152 IonicContact OE2-NE2 3.1Å; E150-K181 WeakPolarHBondContact CA-O 3.44Å; E150-K181 HydrophobicContact CG-CG 4.42Å; E150-K181 VanDerWaalsContact CG-NZ 3.25Å; E150-K181 WeakPolarHBondContact CG-O 3.3Å; E150-K181 IonicContact OE1-NZ 2.74Å; E150-K181 PolarHBondContact OE1-NZ 3.28Å; E150-P183 WeakPolarHBondContact OE1-CD 3.14Å
151	P	98.5	Very high	98	Very high	10 Å²	10	51.3 Å²	51.3	7%	0.065	27%	0.269	C	S	.	.			trans	-62.5	-31.7	-173.5	-28.6	37.4	0	0	0	114.8	V147 A149 F153 N157 Y165 L168 E180 T182	V147-P151 HydrophobicContact CB-CG 4.45Å; V147-P151 HydrophobicContact CG1-CG 4.2Å; A149-P151 WeakPolarHBondContact O-CD 3.38Å; P151-F153 HydrophobicContact CB-CB 4.47Å; P151-F153 PolarHBondContact O-N 2.96Å; P151-N157 PolarHBondContact O-ND2 3.06Å; P151-Y165 HydrophobicContact CB-CD2 4.24Å; P151-Y165 HydrophobicContact CB-CE2 3.78Å; P151-Y165 HydrophobicContact CG-CE2 4.13Å; P151-L168 HydrophobicContact CB-CD1 4.04Å; P151-E180 HydrophobicContact CG-CB 3.88Å; P151-E180 HydrophobicContact CG-CG 4.06Å; P151-T182 WeakPolarHBondContact CD-OG1 3.3Å
152	H	98.8	Very high	98	Very high	24 Å²	24	54.4 Å²	54.4	11%	0.111	29%	0.286	C	S	.	.			trans	53.1	35.2	-174.2	-74.5	-72.1	0	0	0	113.7	E150 D155 R156 N157 T182 S184	E150-H152 VanDerWaalsContact C-N 3.29Å; E150-H152 PolarHBondContact O-CD2 3.48Å; E150-H152 PolarHBondContact O-N 3.49Å; E150-H152 IonicContact OE2-NE2 3.1Å; H152-D155 WeakPolarHBondContact CA-OD1 3.42Å; H152-D155 VanDerWaalsContact CB-OD1 3.24Å; H152-D155 WeakPolarHBondContact CB-OD1 3.46Å; H152-D155 IonicContact CE1-OD2 3.73Å; H152-D155 IonicContact CG-OD1 2.68Å; H152-D155 IonicContact CG-OD2 2.63Å; H152-D155 IonicContact ND1-OD1 3.24Å; H152-D155 PolarHBondContact ND1-OD1 3.29Å; H152-D155 IonicContact ND1-OD2 3.43Å; H152-D155 PolarHBondContact ND1-OD2 3.4Å; H152-R156 HydrophobicContact CB-CB 4.14Å; H152-R156 HydrophobicContact CB-CG 4.18Å; H152-R156 PolarHBondContact CE1-NH2 2.84Å; H152-R156 PolarHBondContact O-N 3.42Å; H152-N157 WeakPolarHBondContact O-CB 3.21Å; H152-N157 PolarHBondContact O-N 3.3Å; H152-N157 PolarHBondContact O-ND2 3.2Å; H152-T182 WeakPolarHBondContact ND1-CG2 3.38Å; H152-S184 PolarHBondContact CE1-OG 3.45Å; H152-S184 VanDerWaalsContact CE1-OG 3.25Å; H152-S184 PolarHBondContact ND1-OG 2.84Å
153	F	98.9	Very high	98.1	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-54.2	-177.5	178.7	-114.2	0	0	0	111.3	P151 D155 N157 Y158 G161 L162 W164 Y165 Y185	P151-F153 HydrophobicContact CB-CB 4.47Å; P151-F153 PolarHBondContact O-N 2.96Å; F153-D155 PolarHBondContact O-N 2.98Å; F153-N157 VanDerWaalsContact CD2-O 3.31Å; F153-N157 WeakPolarHBondContact CD2-O 3.38Å; F153-N157 CarbonylContact O-C 3.53Å; F153-N157 PolarHBondContact O-N 3.04Å; F153-Y158 HydrophobicContact CD1-CD2 4.27Å; F153-Y158 AromaticContact CE1-CD2 3.72Å; F153-Y158 HydrophobicContact CE1-CD2 3.72Å; F153-Y158 AromaticContact CE1-CE2 3.86Å; F153-Y158 HydrophobicContact CE1-CE2 3.86Å; F153-Y158 HydrophobicContact CE2-CD2 4.28Å; F153-Y158 AromaticContact CZ-CD2 3.73Å; F153-Y158 HydrophobicContact CZ-CD2 3.73Å; F153-Y158 HydrophobicContact CZ-CE2 4.01Å; F153-Y158 WeakPolarHBondContact O-CA 3.25Å; F153-Y158 WeakPolarHBondContact O-CB 3.48Å; F153-Y158 PolarHBondContact O-N 2.82Å; F153-G161 VanDerWaalsContact CE2-O 3.29Å; F153-G161 WeakPolarHBondContact CE2-O 3.3Å; F153-L162 HydrophobicContact CE1-CD2 3.67Å; F153-L162 HydrophobicContact CZ-CD2 3.97Å; F153-L162 HydrophobicContact CZ-CG 4.47Å; F153-W164 HydrophobicContact CB-CZ3 4.28Å; F153-W164 AromaticContact CD2-CE3 3.79Å; F153-W164 HydrophobicContact CD2-CE3 3.79Å; F153-W164 AromaticContact CD2-CZ3 3.74Å; F153-W164 HydrophobicContact CD2-CZ3 3.74Å; F153-W164 HydrophobicContact CE2-CE3 4.27Å; F153-W164 HydrophobicContact CG-CZ3 4.43Å; F153-Y165 HydrophobicContact CB-CD2 3.34Å; F153-Y165 HydrophobicContact CB-CE2 3.53Å; F153-Y165 HydrophobicContact CB-CG 3.98Å; F153-Y165 AromaticContact CD1-CD1 3.63Å; F153-Y165 HydrophobicContact CD1-CD1 3.63Å; F153-Y165 AromaticContact CD1-CD2 3.77Å; F153-Y165 HydrophobicContact CD1-CD2 3.77Å; F153-Y165 HydrophobicContact CD1-CE1 4.03Å; F153-Y165 HydrophobicContact CD1-CE2 4.13Å; F153-Y165 AromaticContact CD1-CG 3.48Å; F153-Y165 HydrophobicContact CD1-CG 3.48Å; F153-Y165 VanDerWaalsContact CD1-CG 3.48Å; F153-Y165 HydrophobicContact CD2-CD2 4.2Å; F153-Y165 HydrophobicContact CD2-CG 4.12Å; F153-Y165 AromaticContact CE1-CD1 3.95Å; F153-Y165 HydrophobicContact CE1-CD1 3.95Å; F153-Y165 AromaticContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CG-CD1 4.21Å; F153-Y165 AromaticContact CG-CD2 3.49Å; F153-Y165 HydrophobicContact CG-CD2 3.49Å; F153-Y165 VanDerWaalsContact CG-CD2 3.49Å; F153-Y165 HydrophobicContact CG-CE2 4.04Å; F153-Y165 AromaticContact CG-CG 3.57Å; F153-Y165 HydrophobicContact CG-CG 3.57Å; F153-Y165 HydrophobicContact CZ-CG 4.46Å; F153-Y185 PolarHBondContact N-OH 3.12Å
154	F	98.9	Very high	98.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.1	-174.9	-62.6	-69.2	0	0	0	114.8	L122 Y158 Y165 Y185 A191 R194 I195 M198	L122-F154 HydrophobicContact CD1-CE2 4.13Å; F154-Y158 AromaticContact CD1-CD2 3.98Å; F154-Y158 HydrophobicContact CD1-CD2 3.98Å; F154-Y158 AromaticContact CD1-CE2 3.87Å; F154-Y158 HydrophobicContact CD1-CE2 3.87Å; F154-Y158 HydrophobicContact CE1-CD2 4.49Å; F154-Y158 HydrophobicContact CE1-CE2 4.06Å; F154-Y165 AromaticContact CE2-CE1 3.75Å; F154-Y165 HydrophobicContact CE2-CE1 3.75Å; F154-Y165 AromaticContact CE2-CZ 3.78Å; F154-Y165 HydrophobicContact CZ-CD1 4.49Å; F154-Y165 AromaticContact CZ-CE1 3.94Å; F154-Y165 HydrophobicContact CZ-CE1 3.94Å; F154-Y185 HydrophobicContact CB-CD1 3.96Å; F154-Y185 HydrophobicContact CB-CE1 3.66Å; F154-Y185 HydrophobicContact CB-CE2 4.31Å; F154-Y185 HydrophobicContact CB-CG 4.42Å; F154-Y185 HydrophobicContact CD2-CD2 4.31Å; F154-Y185 HydrophobicContact CD2-CE1 4.38Å; F154-Y185 AromaticContact CD2-CE2 3.64Å; F154-Y185 HydrophobicContact CD2-CE2 3.64Å; F154-Y185 AromaticContact CD2-CZ 3.69Å; F154-Y185 HydrophobicContact CG-CE2 4.46Å; F154-Y185 PolarHBondContact N-OH 2.78Å; F154-A191 HydrophobicContact CB-CB 4.23Å; F154-R194 HydrophobicContact CD1-CB 3.62Å; F154-R194 HydrophobicContact CE1-CB 4.19Å; F154-R194 PolarHBondContact O-NH1 2.95Å; F154-I195 HydrophobicContact CB-CD1 4.46Å; F154-I195 HydrophobicContact CB-CG1 4.24Å; F154-I195 HydrophobicContact CD1-CG1 3.76Å; F154-I195 HydrophobicContact CD2-CD1 3.99Å; F154-I195 HydrophobicContact CD2-CG1 3.48Å; F154-I195 VanDerWaalsContact CD2-CG1 3.48Å; F154-I195 HydrophobicContact CE1-CG1 3.87Å; F154-I195 HydrophobicContact CE2-CD1 4.43Å; F154-I195 HydrophobicContact CE2-CG1 3.62Å; F154-I195 HydrophobicContact CG-CD1 4.18Å; F154-I195 HydrophobicContact CG-CG1 3.55Å; F154-I195 HydrophobicContact CZ-CB 4.48Å; F154-I195 HydrophobicContact CZ-CG1 3.8Å; F154-M198 HydrophobicContact CE1-CB 4.49Å; F154-M198 HydrophobicContact CE2-CE 4.49Å; F154-M198 HydrophobicContact CZ-CB 4.32Å; F154-M198 HydrophobicContact CZ-CE 4.03Å; F154-M198 HydrophobicContact CZ-SD 3.73Å
155	D	98.5	Very high	98.1	Very high	33 Å²	33	57.1 Å²	57.1	18%	0.176	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-45.7	176.5	64.9	-21	0	0	0	114.2	H152 F153 S184 Y185 T188	H152-D155 WeakPolarHBondContact CA-OD1 3.42Å; H152-D155 VanDerWaalsContact CB-OD1 3.24Å; H152-D155 WeakPolarHBondContact CB-OD1 3.46Å; H152-D155 IonicContact CE1-OD2 3.73Å; H152-D155 IonicContact CG-OD1 2.68Å; H152-D155 IonicContact CG-OD2 2.63Å; H152-D155 IonicContact ND1-OD1 3.24Å; H152-D155 PolarHBondContact ND1-OD1 3.29Å; H152-D155 IonicContact ND1-OD2 3.43Å; H152-D155 PolarHBondContact ND1-OD2 3.4Å; F153-D155 PolarHBondContact O-N 2.98Å; D155-S184 WeakPolarHBondContact OD2-CB 3.39Å; D155-S184 PolarHBondContact OD2-OG 2.84Å; D155-Y185 HydrophobicContact CB-CD1 4.1Å; D155-Y185 HydrophobicContact CB-CE1 4.27Å; D155-Y185 WeakPolarHBondContact OD1-CE1 3.36Å; D155-T188 HydrophobicContact CB-CG2 3.82Å; D155-T188 WeakPolarHBondContact CB-OG1 3.44Å
156	R	98.5	Very high	98.1	Very high	165 Å²	165	57.8 Å²	57.8	62%	0.623	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-35.3	-173	-57.7	-178.7	-172.5	161	7.3	114.9	H152	H152-R156 HydrophobicContact CB-CB 4.14Å; H152-R156 HydrophobicContact CB-CG 4.18Å; H152-R156 PolarHBondContact CE1-NH2 2.84Å; H152-R156 PolarHBondContact O-N 3.42Å
157	N	98.6	Very high	98.2	Very high	44 Å²	44	62 Å²	62	24%	0.235	31%	0.311	C	S	.	.			trans	-115	23.3	-165.2	-57	-37.2	0	0	0	112.4	P151 H152 F153 D159 Y160 W164	P151-N157 PolarHBondContact O-ND2 3.06Å; H152-N157 WeakPolarHBondContact O-CB 3.21Å; H152-N157 PolarHBondContact O-N 3.3Å; H152-N157 PolarHBondContact O-ND2 3.2Å; F153-N157 VanDerWaalsContact CD2-O 3.31Å; F153-N157 WeakPolarHBondContact CD2-O 3.38Å; F153-N157 CarbonylContact O-C 3.53Å; F153-N157 PolarHBondContact O-N 3.04Å; N157-D159 PolarHBondContact O-N 3.46Å; N157-Y160 HydrophobicContact CB-CD2 3.79Å; N157-Y160 HydrophobicContact CB-CE2 4.04Å; N157-Y160 PolarHBondContact O-N 2.82Å; N157-W164 HydrophobicContact CB-CH2 3.73Å; N157-W164 HydrophobicContact CB-CZ3 3.79Å
158	Y	98.7	Very high	98.2	Very high	70 Å²	70	64.5 Å²	64.5	28%	0.275	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-63.5	-32.9	-171.5	-168.7	-111.5	0	0	0	112.4	F153 F154 Y160 G161 R194	F153-Y158 HydrophobicContact CD1-CD2 4.27Å; F153-Y158 AromaticContact CE1-CD2 3.72Å; F153-Y158 HydrophobicContact CE1-CD2 3.72Å; F153-Y158 AromaticContact CE1-CE2 3.86Å; F153-Y158 HydrophobicContact CE1-CE2 3.86Å; F153-Y158 HydrophobicContact CE2-CD2 4.28Å; F153-Y158 AromaticContact CZ-CD2 3.73Å; F153-Y158 HydrophobicContact CZ-CD2 3.73Å; F153-Y158 HydrophobicContact CZ-CE2 4.01Å; F153-Y158 WeakPolarHBondContact O-CA 3.25Å; F153-Y158 WeakPolarHBondContact O-CB 3.48Å; F153-Y158 PolarHBondContact O-N 2.82Å; F154-Y158 AromaticContact CD1-CD2 3.98Å; F154-Y158 HydrophobicContact CD1-CD2 3.98Å; F154-Y158 AromaticContact CD1-CE2 3.87Å; F154-Y158 HydrophobicContact CD1-CE2 3.87Å; F154-Y158 HydrophobicContact CE1-CD2 4.49Å; F154-Y158 HydrophobicContact CE1-CE2 4.06Å; Y158-Y160 PolarHBondContact O-N 2.89Å; Y158-Y160 VanDerWaalsContact O-N 3.17Å; Y158-G161 PolarHBondContact O-N 2.94Å; Y158-G161 VanDerWaalsContact O-N 3.11Å; Y158-R194 HydrophobicContact CD1-CG 4.33Å; Y158-R194 HydrophobicContact CD2-CB 4.27Å; Y158-R194 HydrophobicContact CD2-CG 4.18Å; Y158-R194 HydrophobicContact CE1-CG 3.9Å; Y158-R194 HydrophobicContact CE2-CB 3.63Å; Y158-R194 HydrophobicContact CE2-CG 3.73Å; Y158-R194 HydrophobicContact CG-CG 4.45Å
159	D	98.6	Very high	98.5	Very high	151 Å²	151	62.8 Å²	62.8	81%	0.807	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-69.3	-11.9	-177.3	-57.3	-30.4	0	0	0	113.4	N157 G161	N157-D159 PolarHBondContact O-N 3.46Å; D159-G161 PolarHBondContact O-N 3.37Å
160	Y	98.6	Very high	98.5	Very high	146 Å²	146	60.8 Å²	60.8	57%	0.573	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-75.7	-8.9	172.9	-60.9	-24.7	0	0	0	113.5	N157 Y158 W164	N157-Y160 HydrophobicContact CB-CD2 3.79Å; N157-Y160 HydrophobicContact CB-CE2 4.04Å; N157-Y160 PolarHBondContact O-N 2.82Å; Y158-Y160 PolarHBondContact O-N 2.89Å; Y158-Y160 VanDerWaalsContact O-N 3.17Å; Y160-W164 AromaticContact CD2-CD2 3.81Å; Y160-W164 HydrophobicContact CD2-CD2 3.81Å; Y160-W164 AromaticContact CD2-CE2 3.57Å; Y160-W164 HydrophobicContact CD2-CE3 4.13Å; Y160-W164 HydrophobicContact CD2-CG 4.36Å; Y160-W164 HydrophobicContact CD2-CH2 4.04Å; Y160-W164 AromaticContact CD2-CZ2 3.71Å; Y160-W164 HydrophobicContact CD2-CZ2 3.71Å; Y160-W164 HydrophobicContact CD2-CZ3 4.25Å; Y160-W164 AromaticContact CD2-NE1 3.97Å; Y160-W164 HydrophobicContact CE2-CZ2 4.21Å; Y160-W164 HydrophobicContact CG-CD2 4.2Å; Y160-W164 HydrophobicContact CG-CG 4.37Å; Y160-W164 VanDerWaalsContact O-CB 3.24Å; Y160-W164 WeakPolarHBondContact O-CB 3.3Å
161	G	98.5	Very high	98.5	Very high	30 Å²	30	64 Å²	64	31%	0.309	30%	0.3	S	S	.	.	H	α-helix	trans	79.7	164.2	174.6	0	0	0	0	0	114.7	F153 Y158 D159 E163 W164 Y165	F153-G161 VanDerWaalsContact CE2-O 3.29Å; F153-G161 WeakPolarHBondContact CE2-O 3.3Å; Y158-G161 PolarHBondContact O-N 2.94Å; Y158-G161 VanDerWaalsContact O-N 3.11Å; D159-G161 PolarHBondContact O-N 3.37Å; G161-E163 VanDerWaalsContact C-N 3.28Å; G161-E163 PolarHBondContact O-N 2.84Å; G161-W164 PolarHBondContact O-N 2.83Å; G161-Y165 PolarHBondContact O-N 2.82Å
162	L	98.4	Very high	98.4	Very high	67 Å²	67	63.6 Å²	63.6	35%	0.351	30%	0.297	S	S	.	.	H	α-helix	trans	-66.8	-27.3	-175	-74.5	174.3	0	0	0	113.7	F153 Y165 R166 M198	F153-L162 HydrophobicContact CE1-CD2 3.67Å; F153-L162 HydrophobicContact CZ-CD2 3.97Å; F153-L162 HydrophobicContact CZ-CG 4.47Å; L162-Y165 HydrophobicContact CD2-CD1 4.43Å; L162-Y165 PolarHBondContact O-N 3.24Å; L162-R166 WeakPolarHBondContact O-CB 3.15Å; L162-R166 PolarHBondContact O-N 2.85Å; L162-M198 HydrophobicContact CD2-CB 4.2Å; L162-M198 HydrophobicContact CD2-CG 3.86Å; L162-M198 HydrophobicContact CD2-SD 4.12Å
163	E	98.5	Very high	98.4	Very high	106 Å²	106	64.6 Å²	64.6	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-48.8	176.1	-72.8	-61.3	141.6	0	0	111.2	G161 Y165 R166 D167	G161-E163 VanDerWaalsContact C-N 3.28Å; G161-E163 PolarHBondContact O-N 2.84Å; E163-Y165 VanDerWaalsContact C-N 3.28Å; E163-Y165 PolarHBondContact O-N 3.06Å; E163-R166 VanDerWaalsContact CD-CZ 3.41Å; E163-R166 PolarHBondContact O-N 3.44Å; E163-R166 IonicContact OE1-CZ 3.58Å; E163-R166 IonicContact OE1-NE 3.28Å; E163-R166 IonicContact OE1-NH1 3.98Å; E163-R166 PolarHBondContact OE1-NH1 3.1Å; E163-R166 IonicContact OE1-NH2 2.89Å; E163-R166 PolarHBondContact OE1-NH2 3.23Å; E163-R166 IonicContact OE2-CZ 2.83Å; E163-R166 IonicContact OE2-NE 3.93Å; E163-R166 IonicContact OE2-NH1 3.84Å; E163-R166 IonicContact OE2-NH2 3.22Å; E163-R166 PolarHBondContact OE2-NH2 3.16Å; E163-D167 PolarHBondContact O-N 2.85Å
164	W	98.6	Very high	98.1	Very high	82 Å²	82	71.7 Å²	71.7	31%	0.311	34%	0.336	S	S	.	.	H	α-helix	trans	-56.7	-43.5	172.6	176.7	89	0	0	0	111.7	F153 N157 Y160 G161 D167 L168	F153-W164 HydrophobicContact CB-CZ3 4.28Å; F153-W164 AromaticContact CD2-CE3 3.79Å; F153-W164 HydrophobicContact CD2-CE3 3.79Å; F153-W164 AromaticContact CD2-CZ3 3.74Å; F153-W164 HydrophobicContact CD2-CZ3 3.74Å; F153-W164 HydrophobicContact CE2-CE3 4.27Å; F153-W164 HydrophobicContact CG-CZ3 4.43Å; N157-W164 HydrophobicContact CB-CH2 3.73Å; N157-W164 HydrophobicContact CB-CZ3 3.79Å; Y160-W164 AromaticContact CD2-CD2 3.81Å; Y160-W164 HydrophobicContact CD2-CD2 3.81Å; Y160-W164 AromaticContact CD2-CE2 3.57Å; Y160-W164 HydrophobicContact CD2-CE3 4.13Å; Y160-W164 HydrophobicContact CD2-CG 4.36Å; Y160-W164 HydrophobicContact CD2-CH2 4.04Å; Y160-W164 AromaticContact CD2-CZ2 3.71Å; Y160-W164 HydrophobicContact CD2-CZ2 3.71Å; Y160-W164 HydrophobicContact CD2-CZ3 4.25Å; Y160-W164 AromaticContact CD2-NE1 3.97Å; Y160-W164 HydrophobicContact CE2-CZ2 4.21Å; Y160-W164 HydrophobicContact CG-CD2 4.2Å; Y160-W164 HydrophobicContact CG-CG 4.37Å; Y160-W164 VanDerWaalsContact O-CB 3.24Å; Y160-W164 WeakPolarHBondContact O-CB 3.3Å; G161-W164 PolarHBondContact O-N 2.83Å; W164-D167 PolarHBondContact O-N 3.37Å; W164-L168 HydrophobicContact CE3-CD1 4.18Å; W164-L168 HydrophobicContact CH2-CD1 3.57Å; W164-L168 HydrophobicContact CZ2-CD1 3.96Å; W164-L168 HydrophobicContact CZ2-CD2 4.5Å; W164-L168 HydrophobicContact CZ3-CD1 3.67Å; W164-L168 PolarHBondContact O-N 3.43Å
165	Y	98.8	Very high	97.9	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-43.1	178.4	-177.2	-128.4	0	0	0	112.6	L118 P119 P151 F153 F154 G161 L162 E163 D167 L168 M169 E180 M198	L118-Y165 HydrophobicContact CD2-CD1 3.7Å; L118-Y165 HydrophobicContact CD2-CE1 4.28Å; P119-Y165 HydrophobicContact CG-CE1 3.75Å; P119-Y165 WeakPolarHBondContact CG-OH 3.39Å; P151-Y165 HydrophobicContact CB-CD2 4.24Å; P151-Y165 HydrophobicContact CB-CE2 3.78Å; P151-Y165 HydrophobicContact CG-CE2 4.13Å; F153-Y165 HydrophobicContact CB-CD2 3.34Å; F153-Y165 HydrophobicContact CB-CE2 3.53Å; F153-Y165 HydrophobicContact CB-CG 3.98Å; F153-Y165 AromaticContact CD1-CD1 3.63Å; F153-Y165 HydrophobicContact CD1-CD1 3.63Å; F153-Y165 AromaticContact CD1-CD2 3.77Å; F153-Y165 HydrophobicContact CD1-CD2 3.77Å; F153-Y165 HydrophobicContact CD1-CE1 4.03Å; F153-Y165 HydrophobicContact CD1-CE2 4.13Å; F153-Y165 AromaticContact CD1-CG 3.48Å; F153-Y165 HydrophobicContact CD1-CG 3.48Å; F153-Y165 VanDerWaalsContact CD1-CG 3.48Å; F153-Y165 HydrophobicContact CD2-CD2 4.2Å; F153-Y165 HydrophobicContact CD2-CG 4.12Å; F153-Y165 AromaticContact CE1-CD1 3.95Å; F153-Y165 HydrophobicContact CE1-CD1 3.95Å; F153-Y165 AromaticContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CE1-CG 3.97Å; F153-Y165 HydrophobicContact CG-CD1 4.21Å; F153-Y165 AromaticContact CG-CD2 3.49Å; F153-Y165 HydrophobicContact CG-CD2 3.49Å; F153-Y165 VanDerWaalsContact CG-CD2 3.49Å; F153-Y165 HydrophobicContact CG-CE2 4.04Å; F153-Y165 AromaticContact CG-CG 3.57Å; F153-Y165 HydrophobicContact CG-CG 3.57Å; F153-Y165 HydrophobicContact CZ-CG 4.46Å; F154-Y165 AromaticContact CE2-CE1 3.75Å; F154-Y165 HydrophobicContact CE2-CE1 3.75Å; F154-Y165 AromaticContact CE2-CZ 3.78Å; F154-Y165 HydrophobicContact CZ-CD1 4.49Å; F154-Y165 AromaticContact CZ-CE1 3.94Å; F154-Y165 HydrophobicContact CZ-CE1 3.94Å; G161-Y165 PolarHBondContact O-N 2.82Å; L162-Y165 HydrophobicContact CD2-CD1 4.43Å; L162-Y165 PolarHBondContact O-N 3.24Å; E163-Y165 VanDerWaalsContact C-N 3.28Å; E163-Y165 PolarHBondContact O-N 3.06Å; Y165-D167 VanDerWaalsContact C-N 3.25Å; Y165-D167 PolarHBondContact O-N 2.9Å; Y165-L168 WeakPolarHBondContact O-CB 3.13Å; Y165-L168 PolarHBondContact O-N 2.86Å; Y165-M169 HydrophobicContact CD2-CE 3.78Å; Y165-M169 HydrophobicContact CE1-CE 4.22Å; Y165-M169 HydrophobicContact CE2-CE 3.46Å; Y165-M169 VanDerWaalsContact CE2-CE 3.46Å; Y165-M169 HydrophobicContact CG-CE 4.31Å; Y165-M169 VanDerWaalsContact O-CE 3.32Å; Y165-M169 WeakPolarHBondContact O-CE 3.37Å; Y165-E180 VanDerWaalsContact OH-CG 3.24Å; Y165-E180 WeakPolarHBondContact OH-CG 3.35Å; Y165-E180 PolarHBondContact OH-OE1 2.89Å; Y165-M198 HydrophobicContact CD1-SD 4.26Å; Y165-M198 HydrophobicContact CE1-SD 3.9Å
166	R	98.6	Very high	97.9	Very high	90 Å²	90	74.2 Å²	74.2	34%	0.34	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-36.5	175.3	-174.3	174.4	71.3	-159.9	13.4	111.4	K116 L118 L162 E163 L168 M169	K116-R166 HydrophobicContact CB-CG 4.26Å; L118-R166 HydrophobicContact CD2-CB 3.86Å; L118-R166 HydrophobicContact CD2-CG 4.45Å; L118-R166 HydrophobicContact CG-CB 4.41Å; L162-R166 WeakPolarHBondContact O-CB 3.15Å; L162-R166 PolarHBondContact O-N 2.85Å; E163-R166 VanDerWaalsContact CD-CZ 3.41Å; E163-R166 PolarHBondContact O-N 3.44Å; E163-R166 IonicContact OE1-CZ 3.58Å; E163-R166 IonicContact OE1-NE 3.28Å; E163-R166 IonicContact OE1-NH1 3.98Å; E163-R166 PolarHBondContact OE1-NH1 3.1Å; E163-R166 IonicContact OE1-NH2 2.89Å; E163-R166 PolarHBondContact OE1-NH2 3.23Å; E163-R166 IonicContact OE2-CZ 2.83Å; E163-R166 IonicContact OE2-NE 3.93Å; E163-R166 IonicContact OE2-NH1 3.84Å; E163-R166 IonicContact OE2-NH2 3.22Å; E163-R166 PolarHBondContact OE2-NH2 3.16Å; R166-L168 PolarHBondContact O-N 2.88Å; R166-M169 VanDerWaalsContact O-CB 3.24Å; R166-M169 WeakPolarHBondContact O-CB 3.48Å; R166-M169 WeakPolarHBondContact O-CG 3.46Å; R166-M169 PolarHBondContact O-N 2.91Å
167	D	98.4	Very high	97.9	Very high	93 Å²	93	67.4 Å²	67.4	50%	0.497	34%	0.337	S	S	.	.	H	α-helix	trans	-67.7	-21.3	179.1	-84.7	-27.8	0	0	0	114.3	K116 E163 W164 Y165 M169	K116-D167 PolarHBondContact NZ-O 2.96Å; K116-D167 IonicContact NZ-OD1 3.63Å; E163-D167 PolarHBondContact O-N 2.85Å; W164-D167 PolarHBondContact O-N 3.37Å; Y165-D167 VanDerWaalsContact C-N 3.25Å; Y165-D167 PolarHBondContact O-N 2.9Å; D167-M169 VanDerWaalsContact C-N 3.26Å; D167-M169 PolarHBondContact O-N 2.75Å
168	L	98.4	Very high	97.9	Very high	69 Å²	69	65.3 Å²	65.3	36%	0.361	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-19.1	171	-58.3	179.1	0	0	0	112.9	P151 W164 Y165 R166	P151-L168 HydrophobicContact CB-CD1 4.04Å; W164-L168 HydrophobicContact CE3-CD1 4.18Å; W164-L168 HydrophobicContact CH2-CD1 3.57Å; W164-L168 HydrophobicContact CZ2-CD1 3.96Å; W164-L168 HydrophobicContact CZ2-CD2 4.5Å; W164-L168 HydrophobicContact CZ3-CD1 3.67Å; W164-L168 PolarHBondContact O-N 3.43Å; Y165-L168 WeakPolarHBondContact O-CB 3.13Å; Y165-L168 PolarHBondContact O-N 2.86Å; R166-L168 PolarHBondContact O-N 2.88Å
169	M	98.6	Very high	97.9	Very high	3 Å²	3	62 Å²	62	2%	0.015	31%	0.313	C	S	.	.	S	Bend	trans	-72.4	142.1	-174.1	-59.3	-60.9	130.2	0	0	111.3	K116 K117 P119 V147 Y165 R166 D167 T178	K116-M169 VanDerWaalsContact CD-O 3.29Å; K116-M169 WeakPolarHBondContact CD-O 3.49Å; K116-M169 WeakPolarHBondContact CE-O 3.49Å; K116-M169 WeakPolarHBondContact CG-O 3.32Å; K117-M169 WeakPolarHBondContact O-CB 3.29Å; K117-M169 WeakPolarHBondContact O-CG 3.43Å; P119-M169 HydrophobicContact CB-SD 4.39Å; P119-M169 HydrophobicContact CG-CE 4.49Å; P119-M169 HydrophobicContact CG-SD 4.25Å; V147-M169 HydrophobicContact CG2-CE 3.69Å; V147-M169 HydrophobicContact CG2-SD 3.55Å; V147-M169 VanDerWaalsContact CG2-SD 3.55Å; Y165-M169 HydrophobicContact CD2-CE 3.78Å; Y165-M169 HydrophobicContact CE1-CE 4.22Å; Y165-M169 HydrophobicContact CE2-CE 3.46Å; Y165-M169 VanDerWaalsContact CE2-CE 3.46Å; Y165-M169 HydrophobicContact CG-CE 4.31Å; Y165-M169 VanDerWaalsContact O-CE 3.32Å; Y165-M169 WeakPolarHBondContact O-CE 3.37Å; R166-M169 VanDerWaalsContact O-CB 3.24Å; R166-M169 WeakPolarHBondContact O-CB 3.48Å; R166-M169 WeakPolarHBondContact O-CG 3.46Å; R166-M169 PolarHBondContact O-N 2.91Å; D167-M169 VanDerWaalsContact C-N 3.26Å; D167-M169 PolarHBondContact O-N 2.75Å; M169-T178 HydrophobicContact CB-CG2 3.94Å; M169-T178 HydrophobicContact CG-CG2 4.02Å; M169-T178 HydrophobicContact SD-CG2 3.63Å
170	P	97.8	Very high	97.9	Very high	25 Å²	25	54.8 Å²	54.8	16%	0.162	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-64.1	151.1	170.7	29.2	-34.8	0	0	0	110.3	R145	R145-P170 HydrophobicContact CB-CB 4.41Å; R145-P170 HydrophobicContact CB-CG 3.84Å
171	K	97.4	Very high	97.9	Very high	134 Å²	134	47.9 Å²	47.9	58%	0.583	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	138.1	165.3	-72.4	-176.7	170.6	-165.3	0	109.3	G114 S115 K116	G114-K171 WeakPolarHBondContact O-CD 3.38Å; S115-K171 WeakPolarHBondContact O-CA 3.45Å; K116-K171 HydrophobicContact CG-CG 4.09Å
172	T	97.5	Very high	97.9	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.3	-179.5	53.1	0	0	0	0	110.4	G114 S115 R145 Q176 T178	G114-T172 CarbonylContact C-O 3.57Å; G114-T172 WeakPolarHBondContact CA-O 3.45Å; S115-T172 PolarHBondContact N-O 3.05Å; S115-T172 PolarHBondContact O-N 3.49Å; S115-T172 PolarHBondContact O-OG1 3.35Å; S115-T172 VanDerWaalsContact O-OG1 3.1Å; R145-T172 HydrophobicContact CB-CG2 3.61Å; R145-T172 HydrophobicContact CG-CG2 3.89Å; T172-Q176 HydrophobicContact CG2-CB 4.46Å; T172-T178 WeakPolarHBondContact CG2-OG1 3.41Å
173	L	96.9	Very high	98	Very high	45 Å²	45	43.7 Å²	43.7	24%	0.236	22%	0.219	C	C	.	.			trans	-86.4	168.2	170	-59.4	174.9	0	0	0	110	L111 Q176	L111-L173 HydrophobicContact CB-CD1 3.9Å; L111-L173 HydrophobicContact CB-CD2 4.15Å; L111-L173 HydrophobicContact CB-CG 4.43Å; L111-L173 HydrophobicContact CD1-CD1 3.78Å; L111-L173 HydrophobicContact CG-CD1 4.47Å; L173-Q176 HydrophobicContact CB-CG 4.28Å; L173-Q176 PolarHBondContact O-N 3.44Å
174	E	94.3	Very high	98	Very high	150 Å²	150	40 Å²	40	70%	0.701	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	141.3	175.1	-163.2	48.9	-122.7	0	0	111.1	K117 Q176	K117-E174 IonicContact NZ-OE1 2.63Å; K117-E174 IonicContact NZ-OE2 3.04Å; K117-E174 PolarHBondContact NZ-OE2 3.1Å; E174-Q176 VanDerWaalsContact C-N 3.27Å; E174-Q176 PolarHBondContact O-N 3.45Å
175	G	94.3	Very high	98	Very high	53 Å²	53	36.1 Å²	36.1	55%	0.546	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-16.2	-172.9	0	0	0	0	0	116.1
176	Q	97.9	Very high	98	Very high	33 Å²	33	36.3 Å²	36.3	15%	0.154	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-80.8	144.5	175.9	-57.1	-170.3	-57.1	0	0	112.2	P142 D143 T172 L173 E174	P142-Q176 PolarHBondContact O-NE2 3.21Å; D143-Q176 CarbonylContact O-C 3.54Å; D143-Q176 WeakPolarHBondContact O-CA 3.35Å; T172-Q176 HydrophobicContact CG2-CB 4.46Å; L173-Q176 HydrophobicContact CB-CG 4.28Å; L173-Q176 PolarHBondContact O-N 3.44Å; E174-Q176 VanDerWaalsContact C-N 3.27Å; E174-Q176 PolarHBondContact O-N 3.45Å
177	I	98.5	Very high	98	Very high	23 Å²	23	34.3 Å²	34.3	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.1	175.1	-58.6	-178.8	0	0	0	109.4	Q120 A121 D143 R145 M179 L296 L298	Q120-I177 HydrophobicContact CB-CG2 4.35Å; A121-I177 HydrophobicContact CB-CG2 4.36Å; D143-I177 PolarHBondContact O-N 2.91Å; R145-I177 PolarHBondContact N-O 3.34Å; I177-M179 HydrophobicContact CG2-CG 3.81Å; I177-M179 HydrophobicContact CG2-SD 4.44Å; I177-L296 HydrophobicContact CD1-CB 4Å; I177-L296 WeakPolarHBondContact CD1-O 3.32Å; I177-L298 HydrophobicContact CD1-CD1 4.13Å; I177-L298 HydrophobicContact CD1-CD2 3.69Å; I177-L298 HydrophobicContact CD1-CG 3.86Å; I177-L298 HydrophobicContact CG1-CD2 4.24Å
178	T	98.8	Very high	98	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	131.2	169	-57.4	0	0	0	0	109.9	P119 Q120 R145 M169 T172	P119-T178 VanDerWaalsContact CA-O 3.25Å; P119-T178 WeakPolarHBondContact CA-O 3.42Å; P119-T178 HydrophobicContact CB-CG2 4.34Å; P119-T178 WeakPolarHBondContact CB-O 3.34Å; Q120-T178 PolarHBondContact N-O 3.29Å; Q120-T178 VanDerWaalsContact N-O 3.16Å; Q120-T178 PolarHBondContact OE1-O 3.07Å; R145-T178 CarbonylContact O-C 3.56Å; R145-T178 VanDerWaalsContact O-CA 3.3Å; R145-T178 WeakPolarHBondContact O-CA 3.44Å; M169-T178 HydrophobicContact CB-CG2 3.94Å; M169-T178 HydrophobicContact CG-CG2 4.02Å; M169-T178 HydrophobicContact SD-CG2 3.63Å; T172-T178 WeakPolarHBondContact CG2-OG1 3.41Å
179	M	98.8	Very high	98	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159	179	-57.5	-175.7	71.1	0	0	113.1	A121 I123 L138 I144 R145 A146 V147 I177 I205 L296	A121-M179 HydrophobicContact CB-CE 3.89Å; A121-M179 HydrophobicContact CB-CG 4.21Å; A121-M179 HydrophobicContact CB-SD 4.49Å; A121-M179 WeakPolarHBondContact O-CA 3.47Å; I123-M179 HydrophobicContact CG1-CE 4.24Å; L138-M179 HydrophobicContact CD1-CE 4.1Å; L138-M179 HydrophobicContact CD1-SD 4.36Å; I144-M179 HydrophobicContact CD1-SD 4.24Å; I144-M179 HydrophobicContact CG2-SD 3.97Å; R145-M179 PolarHBondContact O-N 3.46Å; A146-M179 WeakPolarHBondContact CA-O 3.34Å; A146-M179 HydrophobicContact CB-CB 4.18Å; A146-M179 WeakPolarHBondContact CB-O 3.5Å; V147-M179 PolarHBondContact N-O 3.03Å; I177-M179 HydrophobicContact CG2-CG 3.81Å; I177-M179 HydrophobicContact CG2-SD 4.44Å; M179-I205 HydrophobicContact CE-CD1 3.9Å; M179-L296 HydrophobicContact CE-CD1 4.21Å; M179-L296 HydrophobicContact SD-CD1 4.03Å
180	E	98.8	Very high	98.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	169.6	161.3	62.3	101.4	131.1	0	0	110.7	P119 L122 I123 V147 P151 Y165 T182 Y185	P119-E180 HydrophobicContact CG-CG 4.42Å; L122-E180 HydrophobicContact CD2-CG 3.47Å; L122-E180 VanDerWaalsContact CD2-CG 3.47Å; I123-E180 PolarHBondContact N-O 2.93Å; V147-E180 HydrophobicContact CB-CB 4.15Å; V147-E180 HydrophobicContact CG2-CB 4.15Å; P151-E180 HydrophobicContact CG-CB 3.88Å; P151-E180 HydrophobicContact CG-CG 4.06Å; Y165-E180 VanDerWaalsContact OH-CG 3.24Å; Y165-E180 WeakPolarHBondContact OH-CG 3.35Å; Y165-E180 PolarHBondContact OH-OE1 2.89Å; E180-T182 PolarHBondContact OE2-N 2.62Å; E180-T182 VanDerWaalsContact OE2-N 3.08Å; E180-T182 PolarHBondContact OE2-OG1 2.97Å; E180-Y185 WeakPolarHBondContact OE1-CE2 3.22Å; E180-Y185 PolarHBondContact OE1-OH 3.46Å
181	K	98.9	Very high	98.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.2	165.7	81.8	175.9	167.3	42.9	0	110.7	I123 T131 R132 L135 E150	I123-K181 HydrophobicContact CB-CB 3.61Å; I123-K181 HydrophobicContact CD1-CB 4.33Å; I123-K181 HydrophobicContact CG1-CB 4.47Å; I123-K181 HydrophobicContact CG2-CB 4.07Å; I123-K181 VanDerWaalsContact O-CA 3.32Å; I123-K181 WeakPolarHBondContact O-CA 3.4Å; T131-K181 WeakPolarHBondContact O-CD 3.26Å; R132-K181 VanDerWaalsContact CZ-NZ 3.35Å; R132-K181 VanDerWaalsContact NH2-NZ 3.19Å; L135-K181 HydrophobicContact CB-CD 4.14Å; L135-K181 HydrophobicContact CD2-CB 4.21Å; L135-K181 HydrophobicContact CD2-CD 3.94Å; L135-K181 HydrophobicContact CD2-CG 3.87Å; E150-K181 WeakPolarHBondContact CA-O 3.44Å; E150-K181 HydrophobicContact CG-CG 4.42Å; E150-K181 VanDerWaalsContact CG-NZ 3.25Å; E150-K181 WeakPolarHBondContact CG-O 3.3Å; E150-K181 IonicContact OE1-NZ 2.74Å; E150-K181 PolarHBondContact OE1-NZ 3.28Å
182	T	98.9	Very high	98.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.173	C	C	.	.			trans	-145.8	97.4	168.5	-56.4	0	0	0	0	108.4	I123 I124 P151 H152 E180 S184 Y185	I123-T182 PolarHBondContact O-N 3.38Å; I123-T182 VanDerWaalsContact O-N 3.07Å; I124-T182 CarbonylContact C-O 3.53Å; I124-T182 VanDerWaalsContact O-O 3.07Å; P151-T182 WeakPolarHBondContact CD-OG1 3.3Å; H152-T182 WeakPolarHBondContact ND1-CG2 3.38Å; E180-T182 PolarHBondContact OE2-N 2.62Å; E180-T182 VanDerWaalsContact OE2-N 3.08Å; E180-T182 PolarHBondContact OE2-OG1 2.97Å; T182-S184 WeakPolarHBondContact CG2-OG 3.49Å; T182-S184 PolarHBondContact O-N 2.82Å; T182-Y185 VanDerWaalsContact CB-CE2 3.43Å; T182-Y185 HydrophobicContact CG2-CD1 3.64Å; T182-Y185 HydrophobicContact CG2-CD2 4.44Å; T182-Y185 HydrophobicContact CG2-CE1 3.38Å; T182-Y185 HydrophobicContact CG2-CE2 4.24Å; T182-Y185 HydrophobicContact CG2-CG 4.16Å; T182-Y185 PolarHBondContact O-N 3.08Å; T182-Y185 VanDerWaalsContact O-N 3.11Å; T182-Y185 PolarHBondContact OG1-OH 3.47Å
183	P	98.9	Very high	98.2	Very high	10 Å²	10	35.1 Å²	35.1	7%	0.065	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.3	-169.1	-24.1	35	0	0	0	115.9	I124 K127 T131 E150	I124-P183 CarbonylContact O-C 3.6Å; K127-P183 HydrophobicContact CB-CB 4.33Å; T131-P183 HydrophobicContact CG2-CB 4.26Å; T131-P183 HydrophobicContact CG2-CG 4.02Å; T131-P183 WeakPolarHBondContact OG1-CG 3.26Å; E150-P183 WeakPolarHBondContact OE1-CD 3.14Å
184	S	98.9	Very high	98.3	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.4	176.7	41.2	0	0	0	0	113.4	H152 D155 T182 F186 V187 T188	H152-S184 PolarHBondContact CE1-OG 3.45Å; H152-S184 VanDerWaalsContact CE1-OG 3.25Å; H152-S184 PolarHBondContact ND1-OG 2.84Å; D155-S184 WeakPolarHBondContact OD2-CB 3.39Å; D155-S184 PolarHBondContact OD2-OG 2.84Å; T182-S184 WeakPolarHBondContact CG2-OG 3.49Å; T182-S184 PolarHBondContact O-N 2.82Å; S184-F186 PolarHBondContact O-N 3.15Å; S184-V187 WeakPolarHBondContact O-CG2 3.41Å; S184-V187 PolarHBondContact O-N 3Å; S184-T188 PolarHBondContact O-N 3.02Å; S184-T188 PolarHBondContact O-OG1 3.14Å
185	Y	98.9	Very high	98.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-56.5	-41.8	178.7	-68.2	-13.9	0	0	0	111.2	I124 F153 F154 D155 E180 T182 V187 T188 I195 W264	I124-Y185 HydrophobicContact CG2-CD2 4.22Å; F153-Y185 PolarHBondContact N-OH 3.12Å; F154-Y185 HydrophobicContact CB-CD1 3.96Å; F154-Y185 HydrophobicContact CB-CE1 3.66Å; F154-Y185 HydrophobicContact CB-CE2 4.31Å; F154-Y185 HydrophobicContact CB-CG 4.42Å; F154-Y185 HydrophobicContact CD2-CD2 4.31Å; F154-Y185 HydrophobicContact CD2-CE1 4.38Å; F154-Y185 AromaticContact CD2-CE2 3.64Å; F154-Y185 HydrophobicContact CD2-CE2 3.64Å; F154-Y185 AromaticContact CD2-CZ 3.69Å; F154-Y185 HydrophobicContact CG-CE2 4.46Å; F154-Y185 PolarHBondContact N-OH 2.78Å; D155-Y185 HydrophobicContact CB-CD1 4.1Å; D155-Y185 HydrophobicContact CB-CE1 4.27Å; D155-Y185 WeakPolarHBondContact OD1-CE1 3.36Å; E180-Y185 WeakPolarHBondContact OE1-CE2 3.22Å; E180-Y185 PolarHBondContact OE1-OH 3.46Å; T182-Y185 VanDerWaalsContact CB-CE2 3.43Å; T182-Y185 HydrophobicContact CG2-CD1 3.64Å; T182-Y185 HydrophobicContact CG2-CD2 4.44Å; T182-Y185 HydrophobicContact CG2-CE1 3.38Å; T182-Y185 HydrophobicContact CG2-CE2 4.24Å; T182-Y185 HydrophobicContact CG2-CG 4.16Å; T182-Y185 PolarHBondContact O-N 3.08Å; T182-Y185 VanDerWaalsContact O-N 3.11Å; T182-Y185 PolarHBondContact OG1-OH 3.47Å; Y185-V187 PolarHBondContact O-N 3.24Å; Y185-T188 WeakPolarHBondContact O-CB 3.25Å; Y185-T188 PolarHBondContact O-N 3.23Å; Y185-I195 HydrophobicContact CD2-CD1 4.38Å; Y185-W264 WeakPolarHBondContact O-CZ2 3.26Å
186	F	98.9	Very high	98.8	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.013	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-52.5	-31.9	-177.4	-172.4	-110	0	0	0	114.2	I124 V126 S184 V206 Y257 H260 W264	I124-F186 HydrophobicContact CD1-CD2 4.07Å; I124-F186 HydrophobicContact CG1-CD2 4.43Å; I124-F186 WeakPolarHBondContact O-CB 3.48Å; I124-F186 PolarHBondContact O-N 2.95Å; V126-F186 HydrophobicContact CG1-CB 4.49Å; V126-F186 HydrophobicContact CG1-CD1 3.42Å; V126-F186 VanDerWaalsContact CG1-CD1 3.42Å; V126-F186 HydrophobicContact CG1-CE1 3.69Å; V126-F186 HydrophobicContact CG1-CG 3.96Å; V126-F186 HydrophobicContact CG1-CZ 4.45Å; S184-F186 PolarHBondContact O-N 3.15Å; F186-V206 HydrophobicContact CD2-CG1 4.04Å; F186-V206 HydrophobicContact CD2-CG2 4.02Å; F186-V206 HydrophobicContact CE2-CG1 3.94Å; F186-V206 HydrophobicContact CE2-CG2 3.99Å; F186-V206 HydrophobicContact CG-CG1 4.49Å; F186-V206 HydrophobicContact CZ-CG1 4.29Å; F186-Y257 HydrophobicContact CE1-CD1 4.1Å; F186-H260 HydrophobicContact CD1-CB 3.87Å; F186-H260 HydrophobicContact CE1-CB 3.38Å; F186-H260 AromaticContact CE1-CG 3.96Å; F186-H260 HydrophobicContact CE2-CB 4.33Å; F186-H260 HydrophobicContact CZ-CB 3.64Å; F186-W264 AromaticContact CD2-CD1 3.92Å; F186-W264 AromaticContact CD2-NE1 3.56Å; F186-W264 AromaticContact CE2-CD1 3.96Å; F186-W264 PolarHBondContact O-NE1 2.77Å
187	V	98.8	Very high	98.8	Very high	49 Å²	49	29 Å²	29	30%	0.297	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-107.6	0.7	-178.9	-55.2	0	0	0	0	113.5	S184 Y185 I254 H260	S184-V187 WeakPolarHBondContact O-CG2 3.41Å; S184-V187 PolarHBondContact O-N 3Å; Y185-V187 PolarHBondContact O-N 3.24Å; V187-I254 HydrophobicContact CG1-CB 4.4Å; V187-I254 HydrophobicContact CG1-CG1 4.04Å; V187-I254 HydrophobicContact CG1-CG2 4.25Å; V187-H260 WeakPolarHBondContact CG1-CE1 3.32Å
188	T	98.8	Very high	98.8	Very high	21 Å²	21	29.3 Å²	29.3	13%	0.129	16%	0.157	C	C	.	.			trans	-82.1	121.1	176.7	-60.3	0	0	0	0	108.5	D155 S184 Y185 E190 A191	D155-T188 HydrophobicContact CB-CG2 3.82Å; D155-T188 WeakPolarHBondContact CB-OG1 3.44Å; S184-T188 PolarHBondContact O-N 3.02Å; S184-T188 PolarHBondContact O-OG1 3.14Å; Y185-T188 WeakPolarHBondContact O-CB 3.25Å; Y185-T188 PolarHBondContact O-N 3.23Å; T188-E190 VanDerWaalsContact C-N 3.31Å; T188-E190 PolarHBondContact O-N 3.46Å; T188-A191 HydrophobicContact CG2-CB 3.98Å; T188-A191 PolarHBondContact O-N 3.18Å
189	R	98.5	Very high	98.8	Very high	197 Å²	197	31.5 Å²	31.5	74%	0.743	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-41.6	-171.6	-178	-177.1	-178.5	-171.6	-0.6	112.4	P192 N263	R189-P192 WeakPolarHBondContact O-CD 3.47Å; R189-N263 PolarHBondContact O-ND2 3.41Å
190	E	98.8	Very high	98.7	Very high	89 Å²	89	40.6 Å²	40.6	42%	0.416	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.4	-174.5	-56.7	72.4	-157.7	0	0	113	T188 A193 R194	T188-E190 VanDerWaalsContact C-N 3.31Å; T188-E190 PolarHBondContact O-N 3.46Å; E190-A193 PolarHBondContact O-N 2.96Å; E190-R194 HydrophobicContact CB-CG 4.48Å; E190-R194 VanDerWaalsContact O-CG 3.3Å; E190-R194 WeakPolarHBondContact O-CG 3.38Å; E190-R194 PolarHBondContact O-N 3.06Å; E190-R194 VanDerWaalsContact O-N 3.07Å
191	A	98.9	Very high	98.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-43.3	-172.6	0	0	0	0	0	113.8	F154 T188 A193 R194 I195 W264	F154-A191 HydrophobicContact CB-CB 4.23Å; T188-A191 HydrophobicContact CG2-CB 3.98Å; T188-A191 PolarHBondContact O-N 3.18Å; A191-A193 PolarHBondContact O-N 3.46Å; A191-R194 PolarHBondContact O-N 3Å; A191-I195 HydrophobicContact CB-CD1 4.39Å; A191-I195 WeakPolarHBondContact O-CB 3.43Å; A191-I195 WeakPolarHBondContact O-CD1 3.41Å; A191-I195 VanDerWaalsContact O-CG1 3.24Å; A191-I195 WeakPolarHBondContact O-CG1 3.04Å; A191-I195 PolarHBondContact O-N 3.48Å; A191-W264 HydrophobicContact CB-CH2 4.36Å; A191-W264 HydrophobicContact CB-CZ2 4.38Å
192	P	98.9	Very high	98.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-46.4	178	-25.9	36	0	0	0	113	R189 R194 I195 S196 N263 W264 Y267 F268	R189-P192 WeakPolarHBondContact O-CD 3.47Å; P192-R194 PolarHBondContact O-N 3.34Å; P192-I195 PolarHBondContact O-N 3.46Å; P192-S196 VanDerWaalsContact O-CB 3.25Å; P192-S196 WeakPolarHBondContact O-CB 3.33Å; P192-S196 PolarHBondContact O-N 3.48Å; P192-N263 WeakPolarHBondContact CG-ND2 3.36Å; P192-W264 HydrophobicContact CB-CD2 4.21Å; P192-W264 HydrophobicContact CB-CE3 3.96Å; P192-W264 HydrophobicContact CB-CZ3 4.31Å; P192-W264 HydrophobicContact CG-CD2 3.63Å; P192-W264 HydrophobicContact CG-CE3 3.84Å; P192-W264 HydrophobicContact CG-CG 4.04Å; P192-W264 HydrophobicContact CG-CH2 4.35Å; P192-W264 HydrophobicContact CG-CZ2 4.11Å; P192-W264 HydrophobicContact CG-CZ3 4.21Å; P192-Y267 HydrophobicContact CB-CD2 3.48Å; P192-Y267 VanDerWaalsContact CB-CD2 3.48Å; P192-Y267 HydrophobicContact CB-CE2 4.12Å; P192-Y267 HydrophobicContact CB-CG 3.97Å; P192-F268 WeakPolarHBondContact O-CE2 3.45Å
193	A	98.9	Very high	98.7	Very high	35 Å²	35	50.5 Å²	50.5	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-62	-45.3	178.7	0	0	0	0	0	111.7	E190 A191 S196 A197 Y267	E190-A193 PolarHBondContact O-N 2.96Å; A191-A193 PolarHBondContact O-N 3.46Å; A193-S196 PolarHBondContact O-N 2.83Å; A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 2.9Å; A193-Y267 HydrophobicContact CB-CD1 4.13Å; A193-Y267 HydrophobicContact CB-CE1 3.49Å; A193-Y267 VanDerWaalsContact CB-CE1 3.49Å; A193-Y267 HydrophobicContact CB-CE2 4.38Å
194	R	98.9	Very high	98.7	Very high	57 Å²	57	50 Å²	50	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-41.7	-179.3	-67.2	171.4	169.6	171.3	-3.8	112.6	F154 Y158 E190 A191 P192 A197 M198	F154-R194 HydrophobicContact CD1-CB 3.62Å; F154-R194 HydrophobicContact CE1-CB 4.19Å; F154-R194 PolarHBondContact O-NH1 2.95Å; Y158-R194 HydrophobicContact CD1-CG 4.33Å; Y158-R194 HydrophobicContact CD2-CB 4.27Å; Y158-R194 HydrophobicContact CD2-CG 4.18Å; Y158-R194 HydrophobicContact CE1-CG 3.9Å; Y158-R194 HydrophobicContact CE2-CB 3.63Å; Y158-R194 HydrophobicContact CE2-CG 3.73Å; Y158-R194 HydrophobicContact CG-CG 4.45Å; E190-R194 HydrophobicContact CB-CG 4.48Å; E190-R194 VanDerWaalsContact O-CG 3.3Å; E190-R194 WeakPolarHBondContact O-CG 3.38Å; E190-R194 PolarHBondContact O-N 3.06Å; E190-R194 VanDerWaalsContact O-N 3.07Å; A191-R194 PolarHBondContact O-N 3Å; P192-R194 PolarHBondContact O-N 3.34Å; R194-A197 PolarHBondContact O-N 3.02Å; R194-M198 PolarHBondContact O-N 3.14Å; R194-M198 VanDerWaalsContact O-N 3.14Å
195	I	98.9	Very high	98.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-68.6	-42.4	177.9	-64	162.8	0	0	0	110	L122 I124 F154 Y185 A191 P192 A197 M198 S199 T202 L204 W264 F268	L122-I195 HydrophobicContact CD1-CD1 3.85Å; L122-I195 HydrophobicContact CD1-CG1 4.02Å; L122-I195 HydrophobicContact CD1-CG2 3.66Å; I124-I195 HydrophobicContact CG2-CD1 4.45Å; F154-I195 HydrophobicContact CB-CD1 4.46Å; F154-I195 HydrophobicContact CB-CG1 4.24Å; F154-I195 HydrophobicContact CD1-CG1 3.76Å; F154-I195 HydrophobicContact CD2-CD1 3.99Å; F154-I195 HydrophobicContact CD2-CG1 3.48Å; F154-I195 VanDerWaalsContact CD2-CG1 3.48Å; F154-I195 HydrophobicContact CE1-CG1 3.87Å; F154-I195 HydrophobicContact CE2-CD1 4.43Å; F154-I195 HydrophobicContact CE2-CG1 3.62Å; F154-I195 HydrophobicContact CG-CD1 4.18Å; F154-I195 HydrophobicContact CG-CG1 3.55Å; F154-I195 HydrophobicContact CZ-CB 4.48Å; F154-I195 HydrophobicContact CZ-CG1 3.8Å; Y185-I195 HydrophobicContact CD2-CD1 4.38Å; A191-I195 HydrophobicContact CB-CD1 4.39Å; A191-I195 WeakPolarHBondContact O-CB 3.43Å; A191-I195 WeakPolarHBondContact O-CD1 3.41Å; A191-I195 VanDerWaalsContact O-CG1 3.24Å; A191-I195 WeakPolarHBondContact O-CG1 3.04Å; A191-I195 PolarHBondContact O-N 3.48Å; P192-I195 PolarHBondContact O-N 3.46Å; I195-A197 VanDerWaalsContact C-N 3.26Å; I195-A197 PolarHBondContact O-N 3.07Å; I195-M198 WeakPolarHBondContact O-CB 3.41Å; I195-M198 PolarHBondContact O-N 3.36Å; I195-S199 PolarHBondContact O-N 3.41Å; I195-T202 HydrophobicContact CG2-CG2 3.92Å; I195-L204 HydrophobicContact CG2-CD2 4.32Å; I195-W264 HydrophobicContact CD1-CH2 3.53Å; I195-W264 HydrophobicContact CD1-CZ3 3.82Å; I195-F268 HydrophobicContact CB-CE2 4.35Å; I195-F268 HydrophobicContact CB-CZ 4.07Å; I195-F268 HydrophobicContact CG2-CE2 4.36Å; I195-F268 HydrophobicContact CG2-CZ 3.69Å
196	S	98.8	Very high	98.7	Very high	18 Å²	18	48.6 Å²	48.6	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-35.1	176.7	-174.3	0	0	0	0	112.1	P192 A193 S199 R200	P192-S196 VanDerWaalsContact O-CB 3.25Å; P192-S196 WeakPolarHBondContact O-CB 3.33Å; P192-S196 PolarHBondContact O-N 3.48Å; A193-S196 PolarHBondContact O-N 2.83Å; S196-S199 CarbonylContact O-C 3.57Å; S196-R200 PolarHBondContact O-N 3.33Å
197	A	98.7	Very high	98.7	Very high	79 Å²	79	48.5 Å²	48.5	65%	0.653	24%	0.242	S	C	*	.	H	α-helix	trans	-68.7	-31	173.8	0	0	0	0	0	113.3	A193 R194 I195	A193-A197 WeakPolarHBondContact O-CB 3.46Å; A193-A197 PolarHBondContact O-N 2.9Å; R194-A197 PolarHBondContact O-N 3.02Å; I195-A197 VanDerWaalsContact C-N 3.26Å; I195-A197 PolarHBondContact O-N 3.07Å
198	M	98.6	Very high	98.7	Very high	29 Å²	29	46.1 Å²	46.1	14%	0.143	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-50.7	172.3	179	-171.5	68.1	0	0	111	L118 P119 F154 L162 Y165 R194 I195	L118-M198 HydrophobicContact CB-SD 4.2Å; L118-M198 HydrophobicContact CD1-CG 3.89Å; L118-M198 HydrophobicContact CD1-SD 4.07Å; L118-M198 HydrophobicContact CD2-SD 4.06Å; L118-M198 HydrophobicContact CG-SD 4.35Å; P119-M198 HydrophobicContact CG-CE 4.43Å; F154-M198 HydrophobicContact CE1-CB 4.49Å; F154-M198 HydrophobicContact CE2-CE 4.49Å; F154-M198 HydrophobicContact CZ-CB 4.32Å; F154-M198 HydrophobicContact CZ-CE 4.03Å; F154-M198 HydrophobicContact CZ-SD 3.73Å; L162-M198 HydrophobicContact CD2-CB 4.2Å; L162-M198 HydrophobicContact CD2-CG 3.86Å; L162-M198 HydrophobicContact CD2-SD 4.12Å; Y165-M198 HydrophobicContact CD1-SD 4.26Å; Y165-M198 HydrophobicContact CE1-SD 3.9Å; R194-M198 PolarHBondContact O-N 3.14Å; R194-M198 VanDerWaalsContact O-N 3.14Å; I195-M198 WeakPolarHBondContact O-CB 3.41Å; I195-M198 PolarHBondContact O-N 3.36Å
199	S	98.1	Very high	98.7	Very high	46 Å²	46	47.7 Å²	47.7	32%	0.322	23%	0.232	S	C	.	.			trans	-161	131.7	172.3	177.4	0	0	0	0	110.1	I195 S196 D201 T202	I195-S199 PolarHBondContact O-N 3.41Å; S196-S199 CarbonylContact O-C 3.57Å; S199-D201 PolarHBondContact O-N 2.74Å; S199-D201 PolarHBondContact OG-N 3.03Å; S199-T202 PolarHBondContact O-OG1 2.6Å
200	R	97.5	Very high	98.7	Very high	191 Å²	191	39 Å²	39	72%	0.721	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.3	176.3	-65.8	-172.6	179.2	-168.1	0.3	112.5	S196 Q272	S196-R200 PolarHBondContact O-N 3.33Å; R200-Q272 PolarHBondContact O-NE2 3.48Å; R200-Q272 PolarHBondContact O-OE1 3.02Å
201	D	98.3	Very high	98.7	Very high	131 Å²	131	34.8 Å²	34.8	70%	0.701	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	1.4	-176.2	-55.9	-39.5	0	0	0	113.1	S199 K203 Q272	S199-D201 PolarHBondContact O-N 2.74Å; S199-D201 PolarHBondContact OG-N 3.03Å; D201-K203 PolarHBondContact O-N 3.23Å; D201-Q272 VanDerWaalsContact C-NE2 3.28Å
202	T	98.8	Very high	98.7	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	18%	0.181	C	C	.	.			trans	-58.2	128.6	178.9	-64	0	0	0	0	110.7	L122 I195 S199 L204 Q272	L122-T202 HydrophobicContact CD1-CG2 3.87Å; L122-T202 HydrophobicContact CG-CG2 3.87Å; I195-T202 HydrophobicContact CG2-CG2 3.92Å; S199-T202 PolarHBondContact O-OG1 2.6Å; T202-L204 HydrophobicContact CG2-CD2 4Å; T202-Q272 PolarHBondContact O-NE2 3.15Å
203	K	98.9	Very high	98.7	Very high	74 Å²	74	36.6 Å²	36.6	32%	0.322	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	137.4	174.3	-67.2	-168.7	177.7	-173	0	110.8	Q120 A121 L122 D201 F295 L296	Q120-K203 PolarHBondContact O-N 3.17Å; A121-K203 CarbonylContact C-O 3.58Å; A121-K203 WeakPolarHBondContact CA-O 3.47Å; A121-K203 HydrophobicContact CB-CB 4.09Å; L122-K203 PolarHBondContact N-O 2.93Å; D201-K203 PolarHBondContact O-N 3.23Å; K203-F295 HydrophobicContact CB-CE1 3.76Å; K203-F295 HydrophobicContact CB-CZ 3.83Å; K203-F295 HydrophobicContact CD-CE1 4.13Å; K203-F295 HydrophobicContact CD-CZ 4.17Å; K203-F295 WeakPolarHBondContact CD-O 3.36Å; K203-F295 HydrophobicContact CG-CE1 4.38Å; K203-F295 HydrophobicContact CG-CZ 4.21Å; K203-F295 PolarHBondContact NZ-O 3.48Å; K203-L296 HydrophobicContact CD-CD2 4.44Å
204	L	98.9	Very high	98.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.8	-175.3	-54.5	177.3	0	0	0	110.1	L122 I124 I195 T202 W264 F268 Q272 I273 L274	L122-L204 HydrophobicContact CB-CD2 4.23Å; L122-L204 HydrophobicContact CD1-CD2 4.37Å; I124-L204 HydrophobicContact CD1-CB 4.05Å; I124-L204 HydrophobicContact CD1-CD1 4.26Å; I124-L204 HydrophobicContact CG2-CD2 3.9Å; I195-L204 HydrophobicContact CG2-CD2 4.32Å; T202-L204 HydrophobicContact CG2-CD2 4Å; L204-W264 HydrophobicContact CD1-CD2 4.49Å; L204-W264 HydrophobicContact CD1-CE3 3.39Å; L204-W264 HydrophobicContact CD1-CZ3 3.48Å; L204-W264 VanDerWaalsContact CD1-CZ3 3.48Å; L204-W264 HydrophobicContact CD2-CZ3 4.13Å; L204-W264 HydrophobicContact CG-CZ3 4.44Å; L204-F268 HydrophobicContact CD1-CB 4.12Å; L204-F268 HydrophobicContact CD1-CD1 3.94Å; L204-F268 HydrophobicContact CD1-CD2 3.63Å; L204-F268 HydrophobicContact CD1-CE1 4.27Å; L204-F268 HydrophobicContact CD1-CE2 3.98Å; L204-F268 HydrophobicContact CD1-CG 3.6Å; L204-F268 HydrophobicContact CD1-CZ 4.29Å; L204-F268 HydrophobicContact CG-CD1 4.48Å; L204-Q272 PolarHBondContact N-O 3.03Å; L204-I273 HydrophobicContact CB-CG1 4.24Å; L204-I273 HydrophobicContact CB-CG2 4.32Å; L204-I273 HydrophobicContact CD1-CD1 4.35Å; L204-I273 HydrophobicContact CD1-CG1 4.12Å; L204-I273 CarbonylContact O-C 3.56Å; L204-I273 WeakPolarHBondContact O-CA 3.32Å; L204-L274 PolarHBondContact O-N 3.18Å
205	I	99	Very high	98.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.1	176.6	-57.6	172.6	0	0	0	109.4	L122 I123 I124 L134 M179 L274 V276 V292 F295 L296	L122-I205 PolarHBondContact O-N 3.38Å; I123-I205 CarbonylContact C-O 3.57Å; I123-I205 WeakPolarHBondContact CA-O 3.48Å; I123-I205 HydrophobicContact CG1-CB 4.17Å; I123-I205 HydrophobicContact CG1-CD1 4.47Å; I123-I205 HydrophobicContact CG1-CG2 4.48Å; I124-I205 PolarHBondContact N-O 2.76Å; L134-I205 HydrophobicContact CD2-CG2 3.71Å; M179-I205 HydrophobicContact CE-CD1 3.9Å; I205-L274 WeakPolarHBondContact CA-O 3.17Å; I205-L274 HydrophobicContact CG1-CB 4.37Å; I205-V276 HydrophobicContact CG2-CG2 3.76Å; I205-V292 HydrophobicContact CD1-CG1 3.88Å; I205-F295 HydrophobicContact CD1-CD1 4.44Å; I205-F295 HydrophobicContact CD1-CE1 4.44Å; I205-F295 HydrophobicContact CG1-CD1 4.17Å; I205-F295 HydrophobicContact CG1-CE1 3.8Å; I205-L296 HydrophobicContact CD1-CD1 4.46Å; I205-L296 HydrophobicContact CD1-CD2 4.26Å
206	V	98.9	Very high	98.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	111	177.1	-168.6	0	0	0	0	109.1	I124 G125 V126 F186 V208 I273 L274 F275 V276	I124-V206 HydrophobicContact CD1-CG2 3.78Å; I124-V206 HydrophobicContact CG1-CG2 3.77Å; G125-V206 CarbonylContact O-C 3.45Å; G125-V206 WeakPolarHBondContact O-CA 3.47Å; V126-V206 HydrophobicContact CG1-CG1 3.74Å; F186-V206 HydrophobicContact CD2-CG1 4.04Å; F186-V206 HydrophobicContact CD2-CG2 4.02Å; F186-V206 HydrophobicContact CE2-CG1 3.94Å; F186-V206 HydrophobicContact CE2-CG2 3.99Å; F186-V206 HydrophobicContact CG-CG1 4.49Å; F186-V206 HydrophobicContact CZ-CG1 4.29Å; V206-V208 HydrophobicContact CG1-CG1 3.79Å; V206-V208 PolarHBondContact O-N 3.36Å; V206-I273 HydrophobicContact CG2-CG2 3.97Å; V206-L274 PolarHBondContact N-O 3.05Å; V206-F275 HydrophobicContact CB-CD1 3.76Å; V206-F275 HydrophobicContact CB-CE1 3.99Å; V206-F275 HydrophobicContact CG1-CD1 4.28Å; V206-F275 HydrophobicContact CG1-CE1 4.43Å; V206-F275 HydrophobicContact CG2-CD1 4.21Å; V206-F275 HydrophobicContact CG2-CE1 3.96Å; V206-F275 CarbonylContact O-C 3.59Å; V206-F275 WeakPolarHBondContact O-CA 3.41Å; V206-V276 PolarHBondContact O-N 3.09Å
207	V	98.9	Very high	98.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	102.2	170.8	-165.1	0	0	0	0	108.3	I123 G125 V126 G129 T131 L134 V276 L281	I123-V207 HydrophobicContact CG2-CG2 4.28Å; G125-V207 PolarHBondContact O-N 3.03Å; V126-V207 WeakPolarHBondContact CG2-O 3.39Å; V126-V207 PolarHBondContact N-O 2.83Å; G129-V207 WeakPolarHBondContact CA-O 3.38Å; G129-V207 VanDerWaalsContact O-CG1 3.29Å; G129-V207 WeakPolarHBondContact O-CG1 3.42Å; T131-V207 HydrophobicContact CG2-CB 4.29Å; T131-V207 HydrophobicContact CG2-CG2 4.25Å; L134-V207 HydrophobicContact CB-CG2 4.1Å; L134-V207 HydrophobicContact CD2-CG2 3.39Å; L134-V207 HydrophobicContact CG-CG2 4.37Å; V207-V276 WeakPolarHBondContact CA-O 3.24Å; V207-V276 HydrophobicContact CG1-CB 4.39Å; V207-V276 HydrophobicContact CG1-CG1 4.27Å; V207-V276 HydrophobicContact CG2-CB 4.28Å; V207-L281 HydrophobicContact CG1-CD2 4.2Å
208	V	98.9	Very high	98.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	163.2	178.8	-66.5	0	0	0	0	111.2	V206 Y257 F275 V276 G278 F360 F368 W370	V206-V208 HydrophobicContact CG1-CG1 3.79Å; V206-V208 PolarHBondContact O-N 3.36Å; V208-Y257 HydrophobicContact CB-CD2 4.43Å; V208-Y257 HydrophobicContact CB-CE2 4.08Å; V208-Y257 HydrophobicContact CG1-CD2 4.22Å; V208-Y257 HydrophobicContact CG1-CE2 4.26Å; V208-Y257 HydrophobicContact CG1-CG 4.5Å; V208-F275 HydrophobicContact CG1-CD1 4.34Å; V208-V276 WeakPolarHBondContact CG2-O 3.32Å; V208-V276 PolarHBondContact N-O 3.32Å; V208-G278 VanDerWaalsContact O-CA 3.29Å; V208-G278 WeakPolarHBondContact O-CA 3.5Å; V208-G278 PolarHBondContact O-N 3.36Å; V208-F360 HydrophobicContact CG1-CE1 4.14Å; V208-F360 HydrophobicContact CG1-CZ 3.79Å; V208-F360 HydrophobicContact CG2-CE1 4.36Å; V208-F368 HydrophobicContact CG2-CD1 3.71Å; V208-F368 HydrophobicContact CG2-CE1 3.35Å; V208-F368 HydrophobicContact CG2-CE2 4.43Å; V208-F368 HydrophobicContact CG2-CG 4.4Å; V208-F368 HydrophobicContact CG2-CZ 3.76Å; V208-W370 HydrophobicContact CB-CH2 3.77Å; V208-W370 HydrophobicContact CB-CZ2 3.95Å; V208-W370 HydrophobicContact CG2-CH2 3.73Å; V208-W370 HydrophobicContact CG2-CZ2 3.71Å
209	R	98.7	Very high	98.7	Very high	53 Å²	53	28.2 Å²	28.2	20%	0.2	13%	0.134	C	C	.	.			trans	-151.6	159.3	-178.1	179.2	-179.7	176.7	165.4	6.3	107.9	K128 P211 T213 R214 Y257 E279	K128-R209 WeakPolarHBondContact O-CD 3.48Å; R209-P211 VanDerWaalsContact O-CD 3.3Å; R209-P211 WeakPolarHBondContact O-CD 3.21Å; R209-T213 PolarHBondContact NE-OG1 3.47Å; R209-R214 HydrophobicContact CB-CB 4.3Å; R209-R214 HydrophobicContact CG-CB 4.32Å; R209-Y257 VanDerWaalsContact O-CE2 3.26Å; R209-Y257 WeakPolarHBondContact O-CE2 3.38Å; R209-Y257 PolarHBondContact O-OH 2.98Å; R209-E279 VanDerWaalsContact CA-OE1 3.31Å; R209-E279 WeakPolarHBondContact CA-OE1 3.32Å; R209-E279 WeakPolarHBondContact CG-OE1 3.43Å
210	D	98.8	Very high	98.7	Very high	15 Å²	15	26.6 Å²	26.6	8%	0.08	12%	0.122	C	C	.	.			trans	-45.5	116.6	168.7	175.2	-24.1	0	0	0	109.1	V212 T213 R214 E279 R350 W370	D210-V212 PolarHBondContact O-N 3.31Å; D210-V212 VanDerWaalsContact O-N 3.13Å; D210-V212 WeakPolarHBondContact OD1-CB 3.24Å; D210-V212 PolarHBondContact OD1-N 3.04Å; D210-T213 HydrophobicContact CB-CG2 4.14Å; D210-T213 PolarHBondContact O-N 2.75Å; D210-T213 VanDerWaalsContact O-N 3.14Å; D210-T213 PolarHBondContact O-OG1 3.06Å; D210-R214 VanDerWaalsContact O-CB 3.26Å; D210-R214 WeakPolarHBondContact O-CB 3.35Å; D210-R214 PolarHBondContact O-N 3.04Å; D210-E279 PolarHBondContact N-OE1 3Å; D210-R350 IonicContact OD1-NH1 3.03Å; D210-R350 IonicContact OD2-CZ 3.17Å; D210-R350 IonicContact OD2-NH1 3.98Å; D210-R350 PolarHBondContact OD2-NH1 3.29Å; D210-R350 IonicContact OD2-NH2 2.76Å; D210-R350 PolarHBondContact OD2-NH2 3.27Å; D210-R350 VanDerWaalsContact OD2-NH2 3.16Å; D210-W370 HydrophobicContact CB-CB 4.22Å; D210-W370 HydrophobicContact CB-CG 3.89Å
211	P	98.8	Very high	98.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-54.2	-33.4	-175.4	-29.2	35.2	0	0	0	114	R209 A215 Y257 Y353 N357 W370	R209-P211 VanDerWaalsContact O-CD 3.3Å; R209-P211 WeakPolarHBondContact O-CD 3.21Å; P211-A215 WeakPolarHBondContact O-CB 3.44Å; P211-A215 PolarHBondContact O-N 3.34Å; P211-Y257 HydrophobicContact CG-CD2 4.34Å; P211-Y257 HydrophobicContact CG-CE2 3.79Å; P211-Y353 HydrophobicContact CB-CD1 3.72Å; P211-Y353 HydrophobicContact CB-CD2 3.61Å; P211-Y353 HydrophobicContact CB-CE1 3.8Å; P211-Y353 HydrophobicContact CB-CE2 3.67Å; P211-Y353 HydrophobicContact CB-CG 3.62Å; P211-Y353 HydrophobicContact CG-CD1 4.27Å; P211-Y353 HydrophobicContact CG-CG 4.21Å; P211-N357 WeakPolarHBondContact CG-OD1 3.26Å; P211-W370 HydrophobicContact CG-CE3 4.28Å; P211-W370 HydrophobicContact CG-CZ3 4.48Å
212	V	98.7	Very high	98.7	Very high	3 Å²	3	16.1 Å²	16.1	2%	0.018	8%	0.081	C	C	.	.	H	α-helix	trans	-68.5	-53.7	178.5	-177.2	0	0	0	0	109.9	D210 R214 A215 I216 V346 L349 R350 Y353	D210-V212 PolarHBondContact O-N 3.31Å; D210-V212 VanDerWaalsContact O-N 3.13Å; D210-V212 WeakPolarHBondContact OD1-CB 3.24Å; D210-V212 PolarHBondContact OD1-N 3.04Å; V212-R214 PolarHBondContact O-N 2.96Å; V212-A215 PolarHBondContact O-N 2.87Å; V212-A215 VanDerWaalsContact O-N 3.15Å; V212-I216 HydrophobicContact CG1-CD1 4.09Å; V212-I216 WeakPolarHBondContact O-CG1 3.31Å; V212-I216 PolarHBondContact O-N 3.36Å; V212-V346 HydrophobicContact CG1-CG1 4.19Å; V212-L349 HydrophobicContact CG1-CB 4.33Å; V212-L349 HydrophobicContact CG1-CD1 4.43Å; V212-L349 HydrophobicContact CG2-CB 3.95Å; V212-R350 HydrophobicContact CG2-CG 3.83Å; V212-Y353 HydrophobicContact CG2-CD2 3.86Å; V212-Y353 HydrophobicContact CG2-CE2 4.32Å
213	T	98.6	Very high	98.6	Very high	35 Å²	35	18.5 Å²	18.5	22%	0.215	9%	0.093	C	C	.	.	H	α-helix	trans	-66.1	-30	179.7	73.7	0	0	0	0	112	R209 D210 S217	R209-T213 PolarHBondContact NE-OG1 3.47Å; D210-T213 HydrophobicContact CB-CG2 4.14Å; D210-T213 PolarHBondContact O-N 2.75Å; D210-T213 VanDerWaalsContact O-N 3.14Å; D210-T213 PolarHBondContact O-OG1 3.06Å; T213-S217 VanDerWaalsContact O-CB 3.32Å; T213-S217 WeakPolarHBondContact O-CB 3.29Å; T213-S217 PolarHBondContact O-N 3.06Å
214	R	98.8	Very high	98.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.1	-46.7	172.5	-172.5	-131	74.5	77.2	0.5	111.3	V126 K127 K128 R209 D210 V212 S217 D218 A251 Y257	V126-R214 HydrophobicContact CG2-CG 4.39Å; K127-R214 WeakPolarHBondContact O-CG 3.36Å; K127-R214 PolarHBondContact O-NH1 2.91Å; K128-R214 HydrophobicContact CB-CG 4.06Å; R209-R214 HydrophobicContact CB-CB 4.3Å; R209-R214 HydrophobicContact CG-CB 4.32Å; D210-R214 VanDerWaalsContact O-CB 3.26Å; D210-R214 WeakPolarHBondContact O-CB 3.35Å; D210-R214 PolarHBondContact O-N 3.04Å; V212-R214 PolarHBondContact O-N 2.96Å; R214-S217 PolarHBondContact O-N 3.32Å; R214-D218 IonicContact CZ-OD2 2.72Å; R214-D218 IonicContact NH1-OD2 3.57Å; R214-D218 PolarHBondContact NH1-OD2 3.12Å; R214-D218 IonicContact NH2-OD2 3.03Å; R214-D218 PolarHBondContact NH2-OD2 3Å; R214-D218 WeakPolarHBondContact O-CB 3.29Å; R214-D218 PolarHBondContact O-N 3.4Å; R214-A251 VanDerWaalsContact NH2-C 3.32Å; R214-A251 VanDerWaalsContact NH2-CA 3.34Å; R214-A251 PolarHBondContact NH2-O 3.42Å; R214-Y257 VanDerWaalsContact CD-OH 3.27Å; R214-Y257 WeakPolarHBondContact CD-OH 3.33Å
215	A	98.8	Very high	98.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-46.8	176.7	0	0	0	0	0	111.7	P211 V212 S217 D218 Y219 F232 A251 I252	P211-A215 WeakPolarHBondContact O-CB 3.44Å; P211-A215 PolarHBondContact O-N 3.34Å; V212-A215 PolarHBondContact O-N 2.87Å; V212-A215 VanDerWaalsContact O-N 3.15Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.12Å; A215-D218 WeakPolarHBondContact O-CB 3.16Å; A215-D218 PolarHBondContact O-N 3.49Å; A215-D218 VanDerWaalsContact O-N 3.1Å; A215-Y219 PolarHBondContact O-N 2.76Å; A215-F232 HydrophobicContact CB-CE2 4.25Å; A215-F232 HydrophobicContact CB-CZ 4.23Å; A215-A251 HydrophobicContact CB-CB 4.45Å; A215-A251 VanDerWaalsContact CB-O 3.28Å; A215-A251 WeakPolarHBondContact CB-O 3.46Å; A215-I252 HydrophobicContact CB-CD1 4.43Å
216	I	98.8	Very high	98.2	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.077	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-42	175.6	-62.6	167.5	0	0	0	110.6	V212 D218 Y219 T220 F232 H338 I341	V212-I216 HydrophobicContact CG1-CD1 4.09Å; V212-I216 WeakPolarHBondContact O-CG1 3.31Å; V212-I216 PolarHBondContact O-N 3.36Å; I216-D218 VanDerWaalsContact C-N 3.29Å; I216-D218 PolarHBondContact O-N 2.74Å; I216-Y219 PolarHBondContact O-N 2.79Å; I216-T220 WeakPolarHBondContact O-CB 3.46Å; I216-T220 PolarHBondContact O-N 3.44Å; I216-T220 PolarHBondContact O-OG1 3.23Å; I216-F232 HydrophobicContact CB-CE2 4.37Å; I216-F232 HydrophobicContact CG1-CD2 4.37Å; I216-F232 HydrophobicContact CG1-CE1 4.08Å; I216-F232 HydrophobicContact CG1-CE2 3.82Å; I216-F232 HydrophobicContact CG1-CZ 3.66Å; I216-H338 HydrophobicContact CG2-CB 3.81Å; I216-I341 HydrophobicContact CD1-CG1 3.87Å; I216-I341 HydrophobicContact CG1-CG1 4.05Å; I216-I341 HydrophobicContact CG2-CG1 4.18Å
217	S	98.6	Very high	98	Very high	11 Å²	11	36.6 Å²	36.6	8%	0.077	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-32.5	177.4	-159.6	0	0	0	0	113	K128 T213 R214 A215 Q221 H338	K128-S217 WeakPolarHBondContact CE-O 3.19Å; K128-S217 WeakPolarHBondContact CE-OG 3.33Å; K128-S217 PolarHBondContact NZ-O 2.03Å; T213-S217 VanDerWaalsContact O-CB 3.32Å; T213-S217 WeakPolarHBondContact O-CB 3.29Å; T213-S217 PolarHBondContact O-N 3.06Å; R214-S217 PolarHBondContact O-N 3.32Å; A215-S217 VanDerWaalsContact C-N 3.3Å; A215-S217 PolarHBondContact O-N 3.12Å; S217-Q221 PolarHBondContact O-N 3.33Å; S217-H338 WeakPolarHBondContact CB-NE2 3.49Å; S217-H338 PolarHBondContact OG-NE2 3.18Å
218	D	98.7	Very high	97.9	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.011	23%	0.23	C	C	.	.	H	α-helix	trans	-69.5	-49	176.8	-156.4	-19.3	0	0	0	110.9	K127 K128 R214 A215 I216 T220 Q221 T222 A251	K127-D218 WeakPolarHBondContact CD-OD2 3.37Å; K127-D218 WeakPolarHBondContact CE-OD1 3.29Å; K127-D218 IonicContact NZ-OD1 2.55Å; K127-D218 PolarHBondContact NZ-OD1 3.26Å; K127-D218 IonicContact NZ-OD2 3.74Å; K127-D218 PolarHBondContact NZ-OD2 3.05Å; K128-D218 HydrophobicContact CG-CB 3.88Å; R214-D218 IonicContact CZ-OD2 2.72Å; R214-D218 IonicContact NH1-OD2 3.57Å; R214-D218 PolarHBondContact NH1-OD2 3.12Å; R214-D218 IonicContact NH2-OD2 3.03Å; R214-D218 PolarHBondContact NH2-OD2 3Å; R214-D218 WeakPolarHBondContact O-CB 3.29Å; R214-D218 PolarHBondContact O-N 3.4Å; A215-D218 WeakPolarHBondContact O-CB 3.16Å; A215-D218 PolarHBondContact O-N 3.49Å; A215-D218 VanDerWaalsContact O-N 3.1Å; I216-D218 VanDerWaalsContact C-N 3.29Å; I216-D218 PolarHBondContact O-N 2.74Å; D218-T220 PolarHBondContact O-N 3.45Å; D218-Q221 PolarHBondContact O-N 2.89Å; D218-T222 PolarHBondContact O-N 2.8Å; D218-T222 VanDerWaalsContact O-N 3.08Å; D218-T222 PolarHBondContact O-OG1 2.84Å; D218-T222 VanDerWaalsContact O-OG1 3.07Å; D218-A251 HydrophobicContact CB-CB 4.25Å
219	Y	98.6	Very high	97.8	Very high	15 Å²	15	46 Å²	46	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-54.8	-50.6	171.6	172.7	-102.3	0	0	0	111.7	A215 I216 Q221 T222 L223 I229 P230 S231 F232 L235 W249 P339	A215-Y219 PolarHBondContact O-N 2.76Å; I216-Y219 PolarHBondContact O-N 2.79Å; Y219-Q221 PolarHBondContact O-N 3.5Å; Y219-T222 CarbonylContact O-C 3.48Å; Y219-T222 WeakPolarHBondContact O-CA 3.08Å; Y219-T222 WeakPolarHBondContact O-CB 3.37Å; Y219-T222 PolarHBondContact O-N 2.69Å; Y219-L223 HydrophobicContact CE1-CD2 4.04Å; Y219-L223 PolarHBondContact O-N 2.89Å; Y219-I229 HydrophobicContact CD2-CD1 3.95Å; Y219-I229 HydrophobicContact CE2-CD1 3.52Å; Y219-I229 HydrophobicContact CE2-CG1 4.03Å; Y219-P230 VanDerWaalsContact CE2-O 3.25Å; Y219-P230 WeakPolarHBondContact CE2-O 3.38Å; Y219-P230 PolarHBondContact OH-O 3.37Å; Y219-S231 WeakPolarHBondContact OH-CA 3.41Å; Y219-F232 HydrophobicContact CD1-CB 3.9Å; Y219-F232 AromaticContact CD1-CD2 3.92Å; Y219-F232 HydrophobicContact CD1-CD2 3.92Å; Y219-F232 HydrophobicContact CD1-CG 4.39Å; Y219-F232 HydrophobicContact CD2-CB 4.43Å; Y219-F232 HydrophobicContact CD2-CD2 4.26Å; Y219-F232 HydrophobicContact CE1-CB 3.88Å; Y219-F232 HydrophobicContact CE2-CB 4.41Å; Y219-F232 HydrophobicContact CG-CB 4.18Å; Y219-F232 AromaticContact CG-CD2 3.66Å; Y219-F232 HydrophobicContact CG-CD2 3.66Å; Y219-F232 HydrophobicContact CG-CG 4.42Å; Y219-F232 PolarHBondContact OH-N 3.25Å; Y219-L235 HydrophobicContact CD2-CD1 4.09Å; Y219-L235 HydrophobicContact CE2-CD1 3.92Å; Y219-W249 HydrophobicContact CD2-CH2 4.32Å; Y219-W249 HydrophobicContact CD2-CZ2 4.1Å; Y219-P339 HydrophobicContact CD1-CG 4.16Å; Y219-P339 HydrophobicContact CE1-CG 4.03Å
220	T	98.5	Very high	97.7	Very high	11 Å²	11	46.9 Å²	46.9	7%	0.067	25%	0.252	C	S	.	.	H	α-helix	trans	-56.8	-38.5	179.6	-56.7	0	0	0	0	112.2	I216 D218 S224 R336 T337 P339	I216-T220 WeakPolarHBondContact O-CB 3.46Å; I216-T220 PolarHBondContact O-N 3.44Å; I216-T220 PolarHBondContact O-OG1 3.23Å; D218-T220 PolarHBondContact O-N 3.45Å; T220-S224 PolarHBondContact O-N 3.16Å; T220-R336 HydrophobicContact CG2-CB 3.97Å; T220-T337 WeakPolarHBondContact CG2-O 3.35Å; T220-P339 WeakPolarHBondContact OG1-CD 3.43Å
221	Q	98	Very high	97.7	Very high	47 Å²	47	48.2 Å²	48.2	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-37.8	175.2	173.9	172.5	-15.6	0	0	112	K128 S217 D218 Y219 S224	K128-Q221 VanDerWaalsContact CD-OE1 3.23Å; S217-Q221 PolarHBondContact O-N 3.33Å; D218-Q221 PolarHBondContact O-N 2.89Å; Y219-Q221 PolarHBondContact O-N 3.5Å; Q221-S224 PolarHBondContact O-OG 2.96Å
222	T	97.6	Very high	97.6	Very high	55 Å²	55	48.3 Å²	48.3	34%	0.337	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-46.2	177	-53.4	0	0	0	0	110.3	D218 Y219 S224 K225 K226 I229	D218-T222 PolarHBondContact O-N 2.8Å; D218-T222 VanDerWaalsContact O-N 3.08Å; D218-T222 PolarHBondContact O-OG1 2.84Å; D218-T222 VanDerWaalsContact O-OG1 3.07Å; Y219-T222 CarbonylContact O-C 3.48Å; Y219-T222 WeakPolarHBondContact O-CA 3.08Å; Y219-T222 WeakPolarHBondContact O-CB 3.37Å; Y219-T222 PolarHBondContact O-N 2.69Å; T222-S224 VanDerWaalsContact C-N 3.31Å; T222-S224 PolarHBondContact O-N 3.46Å; T222-K225 PolarHBondContact O-N 3.01Å; T222-K226 PolarHBondContact O-N 3.37Å; T222-I229 HydrophobicContact CG2-CD1 3.89Å
223	L	97.6	Very high	97.6	Very high	52 Å²	52	49.5 Å²	49.5	27%	0.272	27%	0.269	S	S	.	.	H	α-helix	trans	-55.6	-43.5	175.4	-174	64.2	0	0	0	111.9	Y219 K225 K226 P227 I229	Y219-L223 HydrophobicContact CE1-CD2 4.04Å; Y219-L223 PolarHBondContact O-N 2.89Å; L223-K225 PolarHBondContact O-N 3.31Å; L223-K225 VanDerWaalsContact O-N 3.09Å; L223-K226 CarbonylContact O-C 3.19Å; L223-K226 PolarHBondContact O-N 2.97Å; L223-P227 WeakPolarHBondContact CD1-O 3.26Å; L223-P227 WeakPolarHBondContact O-CA 3.49Å; L223-I229 HydrophobicContact CB-CD1 3.96Å; L223-I229 HydrophobicContact CB-CG1 4.46Å; L223-I229 HydrophobicContact CD1-CD1 4.16Å; L223-I229 HydrophobicContact CD1-CG1 3.72Å
224	S	96.6	Very high	97.5	Very high	67 Å²	67	51.1 Å²	51.1	47%	0.469	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-16	177.7	73.5	0	0	0	0	115	T220 Q221 T222 R336	T220-S224 PolarHBondContact O-N 3.16Å; Q221-S224 PolarHBondContact O-OG 2.96Å; T222-S224 VanDerWaalsContact C-N 3.31Å; T222-S224 PolarHBondContact O-N 3.46Å; S224-R336 PolarHBondContact OG-NE 3.42Å
225	K	96.3	Very high	97.4	Very high	154 Å²	154	53.4 Å²	53.4	67%	0.67	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-27.1	177.6	-66.6	-177.2	175.6	-164.9	0	112.5	T222 L223	T222-K225 PolarHBondContact O-N 3.01Å; L223-K225 PolarHBondContact O-N 3.31Å; L223-K225 VanDerWaalsContact O-N 3.09Å
226	K	96.1	Very high	97.3	Very high	139 Å²	139	53.4 Å²	53.4	60%	0.604	29%	0.293	S	S	*	.			trans	-138.3	88.3	-178.1	-64.2	-172.8	178	-171.9	0	107.5	T222 L223 D228 I229	T222-K226 PolarHBondContact O-N 3.37Å; L223-K226 CarbonylContact O-C 3.19Å; L223-K226 PolarHBondContact O-N 2.97Å; K226-D228 PolarHBondContact O-N 3.32Å; K226-I229 HydrophobicContact CB-CG2 3.74Å; K226-I229 WeakPolarHBondContact O-CG1 3.33Å; K226-I229 WeakPolarHBondContact O-CG2 3.03Å
227	P	93.8	Very high	97.2	Very high	94 Å²	94	53.6 Å²	53.6	61%	0.61	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-27.9	-176	-25.3	36.3	0	0	0	113.7	L223 I229	L223-P227 WeakPolarHBondContact CD1-O 3.26Å; L223-P227 WeakPolarHBondContact O-CA 3.49Å; P227-I229 VanDerWaalsContact C-N 3.27Å; P227-I229 PolarHBondContact O-N 2.9Å
228	D	96	Very high	96.9	Very high	159 Å²	159	60.7 Å²	60.7	85%	0.85	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	16.2	-173	-46.6	-52.3	0	0	0	114.3	K226	K226-D228 PolarHBondContact O-N 3.32Å
229	I	97	Very high	96.4	Very high	38 Å²	38	63.8 Å²	63.8	20%	0.195	34%	0.34	C	S	.	.	S	Bend	trans	-74.9	152.4	175.5	64	176.5	0	0	0	110.9	Y219 T222 L223 K226 P227	Y219-I229 HydrophobicContact CD2-CD1 3.95Å; Y219-I229 HydrophobicContact CE2-CD1 3.52Å; Y219-I229 HydrophobicContact CE2-CG1 4.03Å; T222-I229 HydrophobicContact CG2-CD1 3.89Å; L223-I229 HydrophobicContact CB-CD1 3.96Å; L223-I229 HydrophobicContact CB-CG1 4.46Å; L223-I229 HydrophobicContact CD1-CD1 4.16Å; L223-I229 HydrophobicContact CD1-CG1 3.72Å; K226-I229 HydrophobicContact CB-CG2 3.74Å; K226-I229 WeakPolarHBondContact O-CG1 3.33Å; K226-I229 WeakPolarHBondContact O-CG2 3.03Å; P227-I229 VanDerWaalsContact C-N 3.27Å; P227-I229 PolarHBondContact O-N 2.9Å
230	P	97.5	Very high	95.9	Very high	72 Å²	72	69.5 Å²	69.5	47%	0.468	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-58.4	165.2	175.1	-22.9	33.3	0	0	0	113	Y219 L235	Y219-P230 VanDerWaalsContact CE2-O 3.25Å; Y219-P230 WeakPolarHBondContact CE2-O 3.38Å; Y219-P230 PolarHBondContact OH-O 3.37Å; P230-L235 HydrophobicContact CB-CD2 4.05Å; P230-L235 HydrophobicContact CB-CG 4.1Å; P230-L235 HydrophobicContact CG-CD2 4.02Å
231	S	97.6	Very high	95.4	Very high	44 Å²	44	75.5 Å²	75.5	31%	0.308	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-61.5	158.5	177.3	91.2	0	0	0	0	111.7	Y219 E233 S234 L235	Y219-S231 WeakPolarHBondContact OH-CA 3.41Å; S231-E233 VanDerWaalsContact C-N 3.27Å; S231-E233 VanDerWaalsContact CB-OE2 3.22Å; S231-E233 WeakPolarHBondContact CB-OE2 3.44Å; S231-E233 PolarHBondContact O-N 3.45Å; S231-E233 PolarHBondContact OG-N 3.17Å; S231-E233 PolarHBondContact OG-OE2 3.32Å; S231-S234 PolarHBondContact O-N 3.15Å; S231-S234 VanDerWaalsContact O-N 3.15Å; S231-S234 PolarHBondContact OG-N 3.3Å; S231-S234 VanDerWaalsContact OG-N 3.12Å; S231-S234 PolarHBondContact OG-OG 3.26Å; S231-L235 PolarHBondContact O-N 2.96Å; S231-L235 VanDerWaalsContact O-N 3.12Å
232	F	98.2	Very high	95	Very high	2 Å²	2	78 Å²	78	1%	0.009	42%	0.417	C	S	.	.	H	α-helix	trans	-56.8	-43.5	175.8	-179	-92.4	0	0	0	111.5	A215 I216 Y219 S234 L235 T236 W249 I341 V345 L349	A215-F232 HydrophobicContact CB-CE2 4.25Å; A215-F232 HydrophobicContact CB-CZ 4.23Å; I216-F232 HydrophobicContact CB-CE2 4.37Å; I216-F232 HydrophobicContact CG1-CD2 4.37Å; I216-F232 HydrophobicContact CG1-CE1 4.08Å; I216-F232 HydrophobicContact CG1-CE2 3.82Å; I216-F232 HydrophobicContact CG1-CZ 3.66Å; Y219-F232 HydrophobicContact CD1-CB 3.9Å; Y219-F232 AromaticContact CD1-CD2 3.92Å; Y219-F232 HydrophobicContact CD1-CD2 3.92Å; Y219-F232 HydrophobicContact CD1-CG 4.39Å; Y219-F232 HydrophobicContact CD2-CB 4.43Å; Y219-F232 HydrophobicContact CD2-CD2 4.26Å; Y219-F232 HydrophobicContact CE1-CB 3.88Å; Y219-F232 HydrophobicContact CE2-CB 4.41Å; Y219-F232 HydrophobicContact CG-CB 4.18Å; Y219-F232 AromaticContact CG-CD2 3.66Å; Y219-F232 HydrophobicContact CG-CD2 3.66Å; Y219-F232 HydrophobicContact CG-CG 4.42Å; Y219-F232 PolarHBondContact OH-N 3.25Å; F232-S234 VanDerWaalsContact C-N 3.31Å; F232-S234 PolarHBondContact O-N 3.32Å; F232-L235 PolarHBondContact O-N 2.89Å; F232-T236 WeakPolarHBondContact CE1-OG1 3.47Å; F232-T236 WeakPolarHBondContact O-CB 3.03Å; F232-T236 PolarHBondContact O-N 3.32Å; F232-T236 PolarHBondContact O-OG1 3.31Å; F232-W249 AromaticContact CD2-CH2 3.6Å; F232-W249 HydrophobicContact CD2-CH2 3.6Å; F232-W249 HydrophobicContact CD2-CZ3 4.23Å; F232-W249 AromaticContact CE2-CH2 3.56Å; F232-W249 HydrophobicContact CE2-CH2 3.56Å; F232-W249 AromaticContact CE2-CZ3 3.93Å; F232-W249 HydrophobicContact CE2-CZ3 3.93Å; F232-W249 HydrophobicContact CG-CH2 4.43Å; F232-W249 HydrophobicContact CZ-CH2 4.39Å; F232-W249 HydrophobicContact CZ-CZ3 4.33Å; F232-I341 HydrophobicContact CB-CD1 3.6Å; F232-I341 HydrophobicContact CD1-CD1 3.93Å; F232-I341 HydrophobicContact CD1-CG1 4.21Å; F232-I341 HydrophobicContact CD1-CG2 3.69Å; F232-I341 HydrophobicContact CE1-CG2 4.08Å; F232-I341 HydrophobicContact CG-CD1 3.81Å; F232-I341 HydrophobicContact CG-CG1 4.47Å; F232-V345 HydrophobicContact CD1-CG1 4.44Å; F232-V345 HydrophobicContact CE1-CG1 4.33Å; F232-L349 HydrophobicContact CE1-CD1 3.53Å; F232-L349 HydrophobicContact CZ-CD1 3.64Å
233	E	97.2	Very high	94.6	Very high	27 Å²	27	76.4 Å²	76.4	13%	0.126	41%	0.411	C	S	.	.	H	α-helix	trans	-60.9	-42.2	177.7	-56.5	78	-172.5	0	0	111	S231 L235 T236 F237 D342 V345	S231-E233 VanDerWaalsContact C-N 3.27Å; S231-E233 VanDerWaalsContact CB-OE2 3.22Å; S231-E233 WeakPolarHBondContact CB-OE2 3.44Å; S231-E233 PolarHBondContact O-N 3.45Å; S231-E233 PolarHBondContact OG-N 3.17Å; S231-E233 PolarHBondContact OG-OE2 3.32Å; E233-L235 VanDerWaalsContact C-N 3.34Å; E233-L235 PolarHBondContact O-N 3.48Å; E233-T236 PolarHBondContact O-N 2.91Å; E233-F237 WeakPolarHBondContact O-CD2 3.45Å; E233-D342 HydrophobicContact CG-CB 4.02Å; E233-D342 PolarHBondContact OE1-N 3.43Å; E233-V345 HydrophobicContact CB-CG2 4.15Å; E233-V345 HydrophobicContact CG-CB 4.28Å; E233-V345 HydrophobicContact CG-CG1 4.36Å; E233-V345 HydrophobicContact CG-CG2 3.77Å
234	S	96.3	Very high	94.4	Very high	69 Å²	69	78.4 Å²	78.4	48%	0.483	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-37.9	-179.2	-55.8	0	0	0	0	112	S231 F232	S231-S234 PolarHBondContact O-N 3.15Å; S231-S234 VanDerWaalsContact O-N 3.15Å; S231-S234 PolarHBondContact OG-N 3.3Å; S231-S234 VanDerWaalsContact OG-N 3.12Å; S231-S234 PolarHBondContact OG-OG 3.26Å; F232-S234 VanDerWaalsContact C-N 3.31Å; F232-S234 PolarHBondContact O-N 3.32Å
235	L	97.3	Very high	94.4	Very high	48 Å²	48	76 Å²	76	25%	0.251	40%	0.403	S	S	.	.	H	α-helix	trans	-80.4	-18.9	177.8	-63.1	175.2	0	0	0	113.4	Y219 P230 S231 F232 E233 W249	Y219-L235 HydrophobicContact CD2-CD1 4.09Å; Y219-L235 HydrophobicContact CE2-CD1 3.92Å; P230-L235 HydrophobicContact CB-CD2 4.05Å; P230-L235 HydrophobicContact CB-CG 4.1Å; P230-L235 HydrophobicContact CG-CD2 4.02Å; S231-L235 PolarHBondContact O-N 2.96Å; S231-L235 VanDerWaalsContact O-N 3.12Å; F232-L235 PolarHBondContact O-N 2.89Å; E233-L235 VanDerWaalsContact C-N 3.34Å; E233-L235 PolarHBondContact O-N 3.48Å; L235-W249 HydrophobicContact CB-CD2 4.06Å; L235-W249 HydrophobicContact CB-CE3 4.02Å; L235-W249 HydrophobicContact CB-CH2 3.97Å; L235-W249 HydrophobicContact CB-CZ2 3.96Å; L235-W249 HydrophobicContact CB-CZ3 4.01Å; L235-W249 HydrophobicContact CD1-CZ2 3.94Å; L235-W249 VanDerWaalsContact O-CE3 3.27Å
236	T	97.6	Very high	94.5	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-72.2	-33.4	-176	-67.4	0	0	0	0	112.4	F232 E233 I245 D246 V345 L349	F232-T236 WeakPolarHBondContact CE1-OG1 3.47Å; F232-T236 WeakPolarHBondContact O-CB 3.03Å; F232-T236 PolarHBondContact O-N 3.32Å; F232-T236 PolarHBondContact O-OG1 3.31Å; E233-T236 PolarHBondContact O-N 2.91Å; T236-I245 HydrophobicContact CG2-CG1 4.42Å; T236-I245 CarbonylContact O-C 3.55Å; T236-I245 WeakPolarHBondContact O-CA 3.43Å; T236-D246 PolarHBondContact O-N 2.83Å; T236-V345 HydrophobicContact CG2-CG1 4Å; T236-L349 HydrophobicContact CG2-CD1 4.03Å; T236-L349 HydrophobicContact CG2-CD2 3.8Å; T236-L349 HydrophobicContact CG2-CG 3.92Å
237	F	95.4	Very high	94.5	Very high	19 Å²	19	67.3 Å²	67.3	8%	0.083	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.5	-173.5	-59.3	-79	0	0	0	111.9	E233 N239 R240 L244 I245 V345 R348	E233-F237 WeakPolarHBondContact O-CD2 3.45Å; F237-N239 VanDerWaalsContact C-N 3.33Å; F237-R240 HydrophobicContact CB-CB 4.31Å; F237-R240 HydrophobicContact CD2-CG 4.33Å; F237-L244 CarbonylContact C-O 3.53Å; F237-L244 WeakPolarHBondContact CA-O 3.36Å; F237-I245 HydrophobicContact CD1-CG1 4.06Å; F237-I245 HydrophobicContact CE1-CG1 3.88Å; F237-V345 HydrophobicContact CE2-CB 4.28Å; F237-V345 HydrophobicContact CE2-CG1 3.79Å; F237-V345 HydrophobicContact CE2-CG2 3.72Å; F237-V345 HydrophobicContact CZ-CB 4.47Å; F237-V345 HydrophobicContact CZ-CG1 4.07Å; F237-V345 HydrophobicContact CZ-CG2 4.17Å; F237-R348 HydrophobicContact CE1-CB 4.43Å; F237-R348 HydrophobicContact CZ-CB 4.31Å
238	K	92.6	Very high	94.7	Very high	160 Å²	160	67.4 Å²	67.4	70%	0.696	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	-33.3	163.4	-172.2	172.5	-177.8	177.3	0	110.7	L244 D246	K238-L244 HydrophobicContact CB-CD2 4.25Å; K238-L244 HydrophobicContact CB-CG 4.33Å; K238-L244 HydrophobicContact CD-CD2 4.21Å; K238-L244 HydrophobicContact CG-CD2 4.47Å; K238-L244 PolarHBondContact N-O 2.9Å; K238-D246 HydrophobicContact CB-CB 4.09Å
239	N	89.6	Confident	94.8	Very high	67 Å²	67	61.8 Å²	61.8	36%	0.358	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	111.8	170.9	-177.5	-36.3	0	0	0	109.2	F237 T241 T242 G243 L244	F237-N239 VanDerWaalsContact C-N 3.33Å; N239-T241 WeakPolarHBondContact OD1-CB 3.26Å; N239-T241 PolarHBondContact OD1-N 3.07Å; N239-T242 WeakPolarHBondContact CB-OG1 3.49Å; N239-T242 PolarHBondContact O-OG1 3.22Å; N239-T242 PolarHBondContact OD1-N 2.9Å; N239-G243 PolarHBondContact O-N 2.9Å; N239-G243 VanDerWaalsContact O-N 3.1Å; N239-L244 HydrophobicContact CB-CB 4.3Å; N239-L244 PolarHBondContact N-O 2.94Å; N239-L244 PolarHBondContact O-N 2.92Å
240	R	86.9	Confident	94.8	Very high	136 Å²	136	63 Å²	63	51%	0.513	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-38.3	-176.9	-171	171.9	-177.8	158.8	2.5	112.2	F237 T242 G243 D342	F237-R240 HydrophobicContact CB-CB 4.31Å; F237-R240 HydrophobicContact CD2-CG 4.33Å; R240-T242 PolarHBondContact O-N 2.72Å; R240-G243 PolarHBondContact O-N 2.83Å; R240-D342 IonicContact NH2-OD2 3.16Å
241	T	87.7	Confident	94.9	Very high	137 Å²	137	59.7 Å²	59.7	84%	0.84	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-42.9	-178.8	-47.9	0	0	0	0	111.8	N239 G243	N239-T241 WeakPolarHBondContact OD1-CB 3.26Å; N239-T241 PolarHBondContact OD1-N 3.07Å; T241-G243 VanDerWaalsContact C-N 3.34Å
242	T	89.7	Confident	94.9	Very high	99 Å²	99	57.6 Å²	57.6	61%	0.607	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-10.7	177.3	65	0	0	0	0	113.3	N239 R240 L244	N239-T242 WeakPolarHBondContact CB-OG1 3.49Å; N239-T242 PolarHBondContact O-OG1 3.22Å; N239-T242 PolarHBondContact OD1-N 2.9Å; R240-T242 PolarHBondContact O-N 2.72Å; T242-L244 PolarHBondContact O-N 3.4Å; T242-L244 WeakPolarHBondContact OG1-CB 3.37Å; T242-L244 PolarHBondContact OG1-N 3.26Å
243	G	89.7	Confident	94.9	Very high	21 Å²	21	59.4 Å²	59.4	22%	0.216	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	16.5	-173	0	0	0	0	0	114.7	N239 R240 T241 I245	N239-G243 PolarHBondContact O-N 2.9Å; N239-G243 VanDerWaalsContact O-N 3.1Å; R240-G243 PolarHBondContact O-N 2.83Å; T241-G243 VanDerWaalsContact C-N 3.34Å; G243-I245 PolarHBondContact O-N 2.84Å; G243-I245 VanDerWaalsContact O-N 3.12Å
244	L	93.6	Very high	95	Very high	94 Å²	94	58.7 Å²	58.7	49%	0.492	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	108.3	178.5	-177.6	65.6	0	0	0	110.4	F237 K238 N239 T242	F237-L244 CarbonylContact C-O 3.53Å; F237-L244 WeakPolarHBondContact CA-O 3.36Å; K238-L244 HydrophobicContact CB-CD2 4.25Å; K238-L244 HydrophobicContact CB-CG 4.33Å; K238-L244 HydrophobicContact CD-CD2 4.21Å; K238-L244 HydrophobicContact CG-CD2 4.47Å; K238-L244 PolarHBondContact N-O 2.9Å; N239-L244 HydrophobicContact CB-CB 4.3Å; N239-L244 PolarHBondContact N-O 2.94Å; N239-L244 PolarHBondContact O-N 2.92Å; T242-L244 PolarHBondContact O-N 3.4Å; T242-L244 WeakPolarHBondContact OG1-CB 3.37Å; T242-L244 PolarHBondContact OG1-N 3.26Å
245	I	97.1	Very high	95.1	Very high	18 Å²	18	55.4 Å²	55.4	9%	0.092	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	136.8	176.4	-72.2	160.3	0	0	0	110.6	T236 F237 G243 T247 I252 L349 F352	T236-I245 HydrophobicContact CG2-CG1 4.42Å; T236-I245 CarbonylContact O-C 3.55Å; T236-I245 WeakPolarHBondContact O-CA 3.43Å; F237-I245 HydrophobicContact CD1-CG1 4.06Å; F237-I245 HydrophobicContact CE1-CG1 3.88Å; G243-I245 PolarHBondContact O-N 2.84Å; G243-I245 VanDerWaalsContact O-N 3.12Å; I245-T247 PolarHBondContact O-N 2.99Å; I245-I252 HydrophobicContact CG2-CG1 4.31Å; I245-I252 HydrophobicContact CG2-CG2 3.89Å; I245-L349 HydrophobicContact CD1-CD2 4.07Å; I245-L349 HydrophobicContact CG1-CD2 4.46Å; I245-L349 HydrophobicContact CG2-CD2 4.37Å; I245-F352 HydrophobicContact CB-CD2 4.37Å; I245-F352 HydrophobicContact CD1-CB 3.29Å; I245-F352 HydrophobicContact CD1-CD1 4.29Å; I245-F352 HydrophobicContact CD1-CD2 3.88Å; I245-F352 HydrophobicContact CD1-CG 3.56Å; I245-F352 HydrophobicContact CG2-CD2 4.4Å; I245-F352 HydrophobicContact CG2-CE2 4.4Å; I245-F352 HydrophobicContact CG2-CG 4.46Å; I245-F352 HydrophobicContact CG2-CZ 4.47Å
246	D	97.7	Very high	95.2	Very high	37 Å²	37	53.6 Å²	53.6	20%	0.198	29%	0.292	C	S	.	.			trans	-80.3	93.4	174.9	-175.2	9.8	0	0	0	111.1	T236 K238 S248 W249	T236-D246 PolarHBondContact O-N 2.83Å; K238-D246 HydrophobicContact CB-CB 4.09Å; D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 3.34Å; D246-S248 WeakPolarHBondContact OD1-CA 3.42Å; D246-S248 VanDerWaalsContact OD1-CB 3.26Å; D246-S248 WeakPolarHBondContact OD1-CB 3.36Å; D246-S248 PolarHBondContact OD1-N 3.09Å; D246-S248 PolarHBondContact OD1-OG 2.55Å; D246-S248 PolarHBondContact OD2-OG 2.8Å; D246-W249 HydrophobicContact CB-CB 4.49Å; D246-W249 PolarHBondContact O-N 3.33Å
247	T	97.1	Very high	95.3	Very high	73 Å²	73	53.7 Å²	53.7	45%	0.448	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-8.7	176.1	63.5	0	0	0	0	113.8	I245 W249 F352	I245-T247 PolarHBondContact O-N 2.99Å; T247-W249 VanDerWaalsContact C-N 3.34Å; T247-F352 HydrophobicContact CG2-CE2 3.69Å; T247-F352 HydrophobicContact CG2-CZ 3.57Å
248	S	97	Very high	95.4	Very high	96 Å²	96	52.8 Å²	52.8	67%	0.671	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.9	174	80.1	0	0	0	0	111.9	D246 S250	D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 3.34Å; D246-S248 WeakPolarHBondContact OD1-CA 3.42Å; D246-S248 VanDerWaalsContact OD1-CB 3.26Å; D246-S248 WeakPolarHBondContact OD1-CB 3.36Å; D246-S248 PolarHBondContact OD1-N 3.09Å; D246-S248 PolarHBondContact OD1-OG 2.55Å; D246-S248 PolarHBondContact OD2-OG 2.8Å; S248-S250 PolarHBondContact O-N 2.84Å
249	W	98.2	Very high	95.7	Very high	41 Å²	41	51 Å²	51	16%	0.155	28%	0.281	C	S	.	.	S	Bend	trans	-66.4	122.6	175.1	-178.1	37.5	0	0	0	110.8	Y219 F232 L235 D246 T247 A251 I252 Q253	Y219-W249 HydrophobicContact CD2-CH2 4.32Å; Y219-W249 HydrophobicContact CD2-CZ2 4.1Å; F232-W249 AromaticContact CD2-CH2 3.6Å; F232-W249 HydrophobicContact CD2-CH2 3.6Å; F232-W249 HydrophobicContact CD2-CZ3 4.23Å; F232-W249 AromaticContact CE2-CH2 3.56Å; F232-W249 HydrophobicContact CE2-CH2 3.56Å; F232-W249 AromaticContact CE2-CZ3 3.93Å; F232-W249 HydrophobicContact CE2-CZ3 3.93Å; F232-W249 HydrophobicContact CG-CH2 4.43Å; F232-W249 HydrophobicContact CZ-CH2 4.39Å; F232-W249 HydrophobicContact CZ-CZ3 4.33Å; L235-W249 HydrophobicContact CB-CD2 4.06Å; L235-W249 HydrophobicContact CB-CE3 4.02Å; L235-W249 HydrophobicContact CB-CH2 3.97Å; L235-W249 HydrophobicContact CB-CZ2 3.96Å; L235-W249 HydrophobicContact CB-CZ3 4.01Å; L235-W249 HydrophobicContact CD1-CZ2 3.94Å; L235-W249 VanDerWaalsContact O-CE3 3.27Å; D246-W249 HydrophobicContact CB-CB 4.49Å; D246-W249 PolarHBondContact O-N 3.33Å; T247-W249 VanDerWaalsContact C-N 3.34Å; W249-A251 HydrophobicContact CD2-CB 3.74Å; W249-A251 HydrophobicContact CE3-CB 4.1Å; W249-A251 HydrophobicContact CG-CB 4.42Å; W249-A251 HydrophobicContact CH2-CB 3.71Å; W249-A251 HydrophobicContact CZ2-CB 3.34Å; W249-A251 HydrophobicContact CZ3-CB 4.07Å; W249-A251 PolarHBondContact O-N 2.85Å; W249-A251 VanDerWaalsContact O-N 3.11Å; W249-I252 HydrophobicContact CB-CG1 4.48Å; W249-I252 HydrophobicContact CD2-CG1 4.34Å; W249-I252 HydrophobicContact CE3-CD1 3.93Å; W249-I252 HydrophobicContact CE3-CG1 3.55Å; W249-I252 HydrophobicContact CZ3-CD1 4.01Å; W249-I252 HydrophobicContact CZ3-CG1 4.16Å; W249-I252 WeakPolarHBondContact O-CA 3.48Å; W249-I252 PolarHBondContact O-N 3.15Å; W249-Q253 PolarHBondContact O-N 2.8Å
250	S	97.8	Very high	96.1	Very high	64 Å²	64	48.5 Å²	48.5	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-55.6	-32.7	-176.2	63.3	0	0	0	0	113.8	S248 I252 Q253 I254	S248-S250 PolarHBondContact O-N 2.84Å; S250-I252 PolarHBondContact O-N 3.13Å; S250-Q253 PolarHBondContact O-N 2.95Å; S250-I254 WeakPolarHBondContact O-CB 3.46Å; S250-I254 VanDerWaalsContact O-CD1 3.31Å; S250-I254 WeakPolarHBondContact O-CD1 3.43Å; S250-I254 WeakPolarHBondContact O-CG1 3.3Å; S250-I254 PolarHBondContact O-N 3.29Å; S250-I254 VanDerWaalsContact O-N 3.1Å
251	A	98.1	Very high	96.7	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-26.6	176.9	0	0	0	0	0	112.5	R214 A215 D218 W249	R214-A251 VanDerWaalsContact NH2-C 3.32Å; R214-A251 VanDerWaalsContact NH2-CA 3.34Å; R214-A251 PolarHBondContact NH2-O 3.42Å; A215-A251 HydrophobicContact CB-CB 4.45Å; A215-A251 VanDerWaalsContact CB-O 3.28Å; A215-A251 WeakPolarHBondContact CB-O 3.46Å; D218-A251 HydrophobicContact CB-CB 4.25Å; W249-A251 HydrophobicContact CD2-CB 3.74Å; W249-A251 HydrophobicContact CE3-CB 4.1Å; W249-A251 HydrophobicContact CG-CB 4.42Å; W249-A251 HydrophobicContact CH2-CB 3.71Å; W249-A251 HydrophobicContact CZ2-CB 3.34Å; W249-A251 HydrophobicContact CZ3-CB 4.07Å; W249-A251 PolarHBondContact O-N 2.85Å; W249-A251 VanDerWaalsContact O-N 3.11Å
252	I	98.6	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-83.2	-49.6	172.3	-58.6	-51.6	0	0	0	110.3	A215 I245 W249 S250 I254 G255 L349 F352 Y353	A215-I252 HydrophobicContact CB-CD1 4.43Å; I245-I252 HydrophobicContact CG2-CG1 4.31Å; I245-I252 HydrophobicContact CG2-CG2 3.89Å; W249-I252 HydrophobicContact CB-CG1 4.48Å; W249-I252 HydrophobicContact CD2-CG1 4.34Å; W249-I252 HydrophobicContact CE3-CD1 3.93Å; W249-I252 HydrophobicContact CE3-CG1 3.55Å; W249-I252 HydrophobicContact CZ3-CD1 4.01Å; W249-I252 HydrophobicContact CZ3-CG1 4.16Å; W249-I252 WeakPolarHBondContact O-CA 3.48Å; W249-I252 PolarHBondContact O-N 3.15Å; S250-I252 PolarHBondContact O-N 3.13Å; I252-I254 VanDerWaalsContact C-N 3.33Å; I252-I254 PolarHBondContact O-N 3.14Å; I252-G255 PolarHBondContact O-N 2.77Å; I252-L349 HydrophobicContact CD1-CD1 4.41Å; I252-L349 HydrophobicContact CD1-CD2 3.54Å; I252-F352 HydrophobicContact CG2-CD1 4.39Å; I252-F352 HydrophobicContact CG2-CE1 3.59Å; I252-F352 HydrophobicContact CG2-CZ 4.02Å; I252-Y353 WeakPolarHBondContact CA-OH 3.44Å; I252-Y353 PolarHBondContact O-OH 3.27Å
253	Q	98.6	Very high	97.7	Very high	39 Å²	39	35.7 Å²	35.7	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-40.7	-171.7	-160.4	-70.1	-39.1	0	0	113.1	W249 S250 G255 I256 H260	W249-Q253 PolarHBondContact O-N 2.8Å; S250-Q253 PolarHBondContact O-N 2.95Å; Q253-G255 PolarHBondContact O-N 2.81Å; Q253-I256 PolarHBondContact O-N 3Å; Q253-H260 VanDerWaalsContact CD-CE1 3.5Å; Q253-H260 PolarHBondContact NE2-CE1 3.05Å; Q253-H260 PolarHBondContact NE2-NE2 3.07Å; Q253-H260 VanDerWaalsContact NE2-NE2 3.18Å; Q253-H260 PolarHBondContact O-NE2 3.16Å; Q253-H260 PolarHBondContact OE1-CE1 2.96Å; Q253-H260 PolarHBondContact OE1-NE2 2.83Å
254	I	98.8	Very high	98.1	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.062	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-30.8	179.1	-67.3	164.2	0	0	0	111.8	V126 K127 V187 S250 I252 I256 Y257	V126-I254 HydrophobicContact CB-CG2 4.49Å; K127-I254 HydrophobicContact CB-CD1 4.48Å; K127-I254 HydrophobicContact CD-CD1 4.03Å; V187-I254 HydrophobicContact CG1-CB 4.4Å; V187-I254 HydrophobicContact CG1-CG1 4.04Å; V187-I254 HydrophobicContact CG1-CG2 4.25Å; S250-I254 WeakPolarHBondContact O-CB 3.46Å; S250-I254 VanDerWaalsContact O-CD1 3.31Å; S250-I254 WeakPolarHBondContact O-CD1 3.43Å; S250-I254 WeakPolarHBondContact O-CG1 3.3Å; S250-I254 PolarHBondContact O-N 3.29Å; S250-I254 VanDerWaalsContact O-N 3.1Å; I252-I254 VanDerWaalsContact C-N 3.33Å; I252-I254 PolarHBondContact O-N 3.14Å; I254-I256 VanDerWaalsContact C-N 3.25Å; I254-I256 PolarHBondContact O-N 3.08Å; I254-Y257 WeakPolarHBondContact O-CD1 3.39Å; I254-Y257 VanDerWaalsContact O-CE1 3.32Å; I254-Y257 WeakPolarHBondContact O-CE1 3.24Å
255	G	98.7	Very high	98.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.5	-178.7	0	0	0	0	0	114.5	I252 Q253 Y257	I252-G255 PolarHBondContact O-N 2.77Å; Q253-G255 PolarHBondContact O-N 2.81Å; G255-Y257 PolarHBondContact O-N 2.96Å
256	I	98.8	Very high	98.4	Very high	11 Å²	11	38.8 Å²	38.8	6%	0.056	21%	0.207	C	C	.	.			trans	-82.6	67	179.9	-48.6	176.3	0	0	0	109	Q253 I254 A258 K259 H260 F352 Y353 F356	Q253-I256 PolarHBondContact O-N 3Å; I254-I256 VanDerWaalsContact C-N 3.25Å; I254-I256 PolarHBondContact O-N 3.08Å; I256-A258 VanDerWaalsContact C-N 3.34Å; I256-A258 PolarHBondContact O-N 3.2Å; I256-K259 HydrophobicContact CB-CB 4.37Å; I256-K259 HydrophobicContact CG2-CB 3.7Å; I256-K259 WeakPolarHBondContact O-CB 3.45Å; I256-K259 PolarHBondContact O-N 3.2Å; I256-K259 VanDerWaalsContact O-N 3.15Å; I256-H260 PolarHBondContact O-CD2 2.67Å; I256-H260 VanDerWaalsContact O-CD2 3.26Å; I256-H260 PolarHBondContact O-N 3.33Å; I256-F352 HydrophobicContact CD1-CE1 4.42Å; I256-F352 HydrophobicContact CD1-CZ 4.06Å; I256-F352 HydrophobicContact CG1-CE1 4.42Å; I256-Y353 HydrophobicContact CG1-CE1 4.05Å; I256-F356 HydrophobicContact CG2-CB 4.2Å; I256-F356 HydrophobicContact CG2-CD1 3.65Å; I256-F356 HydrophobicContact CG2-CD2 4.28Å; I256-F356 HydrophobicContact CG2-CE1 4.05Å; I256-F356 HydrophobicContact CG2-CG 3.79Å
257	Y	98.9	Very high	98.5	Very high	1 Å²	1	41.7 Å²	41.7	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-59	-40.6	-168.3	-56.8	-36.8	0	0	0	113.8	V126 F186 V208 R209 P211 R214 I254 G255 K259 H260 L261 F360 W370	V126-Y257 HydrophobicContact CB-CE1 4.29Å; V126-Y257 HydrophobicContact CG1-CD1 4.16Å; V126-Y257 HydrophobicContact CG1-CE1 3.89Å; V126-Y257 HydrophobicContact CG2-CE1 3.86Å; F186-Y257 HydrophobicContact CE1-CD1 4.1Å; V208-Y257 HydrophobicContact CB-CD2 4.43Å; V208-Y257 HydrophobicContact CB-CE2 4.08Å; V208-Y257 HydrophobicContact CG1-CD2 4.22Å; V208-Y257 HydrophobicContact CG1-CE2 4.26Å; V208-Y257 HydrophobicContact CG1-CG 4.5Å; R209-Y257 VanDerWaalsContact O-CE2 3.26Å; R209-Y257 WeakPolarHBondContact O-CE2 3.38Å; R209-Y257 PolarHBondContact O-OH 2.98Å; P211-Y257 HydrophobicContact CG-CD2 4.34Å; P211-Y257 HydrophobicContact CG-CE2 3.79Å; R214-Y257 VanDerWaalsContact CD-OH 3.27Å; R214-Y257 WeakPolarHBondContact CD-OH 3.33Å; I254-Y257 WeakPolarHBondContact O-CD1 3.39Å; I254-Y257 VanDerWaalsContact O-CE1 3.32Å; I254-Y257 WeakPolarHBondContact O-CE1 3.24Å; G255-Y257 PolarHBondContact O-N 2.96Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.38Å; Y257-H260 PolarHBondContact O-N 3.43Å; Y257-L261 WeakPolarHBondContact O-CB 3.39Å; Y257-L261 PolarHBondContact O-N 2.92Å; Y257-F360 HydrophobicContact CD2-CD1 4.43Å; Y257-F360 HydrophobicContact CD2-CE1 4.4Å; Y257-W370 AromaticContact CD2-CH2 3.85Å; Y257-W370 HydrophobicContact CD2-CH2 3.85Å; Y257-W370 AromaticContact CD2-CZ3 3.78Å; Y257-W370 HydrophobicContact CD2-CZ3 3.78Å; Y257-W370 AromaticContact CE2-CH2 3.64Å; Y257-W370 HydrophobicContact CE2-CH2 3.64Å; Y257-W370 HydrophobicContact CE2-CZ2 4.45Å; Y257-W370 AromaticContact CE2-CZ3 3.77Å; Y257-W370 HydrophobicContact CE2-CZ3 3.77Å
258	A	98.8	Very high	98.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56	-42.3	177.8	0	0	0	0	0	112.5	I256 H260 L261 D262 K359 F360 M363	I256-A258 VanDerWaalsContact C-N 3.34Å; I256-A258 PolarHBondContact O-N 3.2Å; A258-H260 VanDerWaalsContact C-N 3.35Å; A258-H260 PolarHBondContact O-N 3.27Å; A258-L261 PolarHBondContact O-N 3.14Å; A258-D262 PolarHBondContact O-N 3.49Å; A258-K359 HydrophobicContact CB-CB 4.12Å; A258-K359 HydrophobicContact CB-CD 3.9Å; A258-K359 HydrophobicContact CB-CG 3.94Å; A258-F360 HydrophobicContact CB-CB 4.15Å; A258-M363 HydrophobicContact CB-SD 3.86Å
259	K	98.6	Very high	98.6	Very high	123 Å²	123	36.7 Å²	36.7	54%	0.535	18%	0.182	S	C	.	.	H	α-helix	trans	-61.9	-43.2	178.6	173.7	-179.6	175.6	175.9	0	111.8	I256 Y257	I256-K259 HydrophobicContact CB-CB 4.37Å; I256-K259 HydrophobicContact CG2-CB 3.7Å; I256-K259 WeakPolarHBondContact O-CB 3.45Å; I256-K259 PolarHBondContact O-N 3.2Å; I256-K259 VanDerWaalsContact O-N 3.15Å; Y257-K259 VanDerWaalsContact C-N 3.29Å; Y257-K259 PolarHBondContact O-N 3.38Å
260	H	98.9	Very high	98.6	Very high	15 Å²	15	37.8 Å²	37.8	7%	0.069	19%	0.19	C	C	.	.	H	α-helix	trans	-70.5	-40.9	179.5	-65.9	-63.7	0	0	0	110.6	F186 V187 Q253 I256 Y257 A258 D262 N263 W264	F186-H260 HydrophobicContact CD1-CB 3.87Å; F186-H260 HydrophobicContact CE1-CB 3.38Å; F186-H260 AromaticContact CE1-CG 3.96Å; F186-H260 HydrophobicContact CE2-CB 4.33Å; F186-H260 HydrophobicContact CZ-CB 3.64Å; V187-H260 WeakPolarHBondContact CG1-CE1 3.32Å; Q253-H260 VanDerWaalsContact CD-CE1 3.5Å; Q253-H260 PolarHBondContact NE2-CE1 3.05Å; Q253-H260 PolarHBondContact NE2-NE2 3.07Å; Q253-H260 VanDerWaalsContact NE2-NE2 3.18Å; Q253-H260 PolarHBondContact O-NE2 3.16Å; Q253-H260 PolarHBondContact OE1-CE1 2.96Å; Q253-H260 PolarHBondContact OE1-NE2 2.83Å; I256-H260 PolarHBondContact O-CD2 2.67Å; I256-H260 VanDerWaalsContact O-CD2 3.26Å; I256-H260 PolarHBondContact O-N 3.33Å; Y257-H260 PolarHBondContact O-N 3.43Å; A258-H260 VanDerWaalsContact C-N 3.35Å; A258-H260 PolarHBondContact O-N 3.27Å; H260-D262 VanDerWaalsContact C-N 3.31Å; H260-D262 PolarHBondContact O-N 2.72Å; H260-N263 WeakPolarHBondContact O-CA 3.49Å; H260-N263 VanDerWaalsContact O-CB 3.26Å; H260-N263 WeakPolarHBondContact O-CB 3.36Å; H260-N263 PolarHBondContact O-N 3.02Å; H260-W264 VanDerWaalsContact O-CD1 3.23Å; H260-W264 PolarHBondContact O-N 3.3Å
261	L	98.9	Very high	98.7	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-38.2	177.2	-177.5	54.3	0	0	0	112.6	Y257 A258 N263 W264 L265 M270 I273 F275 F360 M363 T364	Y257-L261 WeakPolarHBondContact O-CB 3.39Å; Y257-L261 PolarHBondContact O-N 2.92Å; A258-L261 PolarHBondContact O-N 3.14Å; L261-N263 PolarHBondContact O-N 2.98Å; L261-N263 VanDerWaalsContact O-N 3.16Å; L261-W264 HydrophobicContact CD1-CB 4.37Å; L261-W264 PolarHBondContact O-N 2.63Å; L261-L265 HydrophobicContact CD1-CD1 4.24Å; L261-L265 HydrophobicContact CD1-CD2 4.15Å; L261-L265 HydrophobicContact CD1-CG 3.86Å; L261-L265 HydrophobicContact CG-CD1 3.93Å; L261-L265 HydrophobicContact CG-CG 4.07Å; L261-L265 WeakPolarHBondContact O-CG 3.3Å; L261-L265 PolarHBondContact O-N 2.97Å; L261-M270 HydrophobicContact CD2-CE 4.1Å; L261-I273 HydrophobicContact CD1-CD1 4.11Å; L261-F275 HydrophobicContact CD1-CE1 4.3Å; L261-F275 HydrophobicContact CD1-CZ 3.6Å; L261-F275 HydrophobicContact CD2-CE1 4.3Å; L261-F275 HydrophobicContact CD2-CE2 4.45Å; L261-F275 HydrophobicContact CD2-CZ 3.72Å; L261-F275 HydrophobicContact CG-CZ 4.29Å; L261-F360 HydrophobicContact CD2-CD2 3.99Å; L261-F360 HydrophobicContact CD2-CE2 3.86Å; L261-M363 HydrophobicContact CB-CE 3.93Å; L261-M363 HydrophobicContact CD2-CB 3.98Å; L261-M363 HydrophobicContact CD2-CE 3.74Å; L261-M363 HydrophobicContact CD2-SD 4.22Å; L261-M363 HydrophobicContact CG-CE 3.64Å; L261-T364 HydrophobicContact CD2-CG2 3.93Å
262	D	98.6	Very high	98.7	Very high	64 Å²	64	42.2 Å²	42.2	34%	0.342	21%	0.207	S	C	.	.	H	α-helix	trans	-54.9	-32.3	172.5	-71.5	-36.4	0	0	0	112.2	A258 H260 Q266 K359 M363	A258-D262 PolarHBondContact O-N 3.49Å; H260-D262 VanDerWaalsContact C-N 3.31Å; H260-D262 PolarHBondContact O-N 2.72Å; D262-Q266 PolarHBondContact O-NE2 2.85Å; D262-Q266 VanDerWaalsContact O-NE2 3.15Å; D262-K359 IonicContact OD1-NZ 2.98Å; D262-K359 IonicContact OD2-NZ 3.5Å; D262-K359 PolarHBondContact OD2-NZ 3.09Å; D262-M363 WeakPolarHBondContact OD1-CE 3.38Å
263	N	98.6	Very high	98.7	Very high	38 Å²	38	42.7 Å²	42.7	20%	0.203	21%	0.21	C	C	.	.	H	α-helix	trans	-72.7	-39.4	175	-167.5	47.8	0	0	0	112.4	R189 P192 H260 L261 Y267	R189-N263 PolarHBondContact O-ND2 3.41Å; P192-N263 WeakPolarHBondContact CG-ND2 3.36Å; H260-N263 WeakPolarHBondContact O-CA 3.49Å; H260-N263 VanDerWaalsContact O-CB 3.26Å; H260-N263 WeakPolarHBondContact O-CB 3.36Å; H260-N263 PolarHBondContact O-N 3.02Å; L261-N263 PolarHBondContact O-N 2.98Å; L261-N263 VanDerWaalsContact O-N 3.16Å; N263-Y267 WeakPolarHBondContact O-CD2 3.26Å
264	W	98.9	Very high	98.7	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-70	-38.5	179.5	-74.2	91.3	0	0	0	112.6	I124 Y185 F186 A191 P192 I195 L204 H260 L261 Q266 Y267 F268 I273	I124-W264 HydrophobicContact CB-CH2 3.99Å; I124-W264 HydrophobicContact CB-CZ2 4.15Å; I124-W264 HydrophobicContact CD1-CD2 3.78Å; I124-W264 HydrophobicContact CD1-CE3 3.83Å; I124-W264 HydrophobicContact CD1-CH2 3.5Å; I124-W264 VanDerWaalsContact CD1-CH2 3.5Å; I124-W264 HydrophobicContact CD1-CZ2 3.48Å; I124-W264 VanDerWaalsContact CD1-CZ2 3.48Å; I124-W264 HydrophobicContact CD1-CZ3 3.68Å; I124-W264 HydrophobicContact CG1-CH2 4.34Å; I124-W264 HydrophobicContact CG1-CZ2 4.33Å; I124-W264 HydrophobicContact CG2-CH2 3.8Å; I124-W264 HydrophobicContact CG2-CZ2 4.46Å; I124-W264 HydrophobicContact CG2-CZ3 4.35Å; Y185-W264 WeakPolarHBondContact O-CZ2 3.26Å; F186-W264 AromaticContact CD2-CD1 3.92Å; F186-W264 AromaticContact CD2-NE1 3.56Å; F186-W264 AromaticContact CE2-CD1 3.96Å; F186-W264 PolarHBondContact O-NE1 2.77Å; A191-W264 HydrophobicContact CB-CH2 4.36Å; A191-W264 HydrophobicContact CB-CZ2 4.38Å; P192-W264 HydrophobicContact CB-CD2 4.21Å; P192-W264 HydrophobicContact CB-CE3 3.96Å; P192-W264 HydrophobicContact CB-CZ3 4.31Å; P192-W264 HydrophobicContact CG-CD2 3.63Å; P192-W264 HydrophobicContact CG-CE3 3.84Å; P192-W264 HydrophobicContact CG-CG 4.04Å; P192-W264 HydrophobicContact CG-CH2 4.35Å; P192-W264 HydrophobicContact CG-CZ2 4.11Å; P192-W264 HydrophobicContact CG-CZ3 4.21Å; I195-W264 HydrophobicContact CD1-CH2 3.53Å; I195-W264 HydrophobicContact CD1-CZ3 3.82Å; L204-W264 HydrophobicContact CD1-CD2 4.49Å; L204-W264 HydrophobicContact CD1-CE3 3.39Å; L204-W264 HydrophobicContact CD1-CZ3 3.48Å; L204-W264 VanDerWaalsContact CD1-CZ3 3.48Å; L204-W264 HydrophobicContact CD2-CZ3 4.13Å; L204-W264 HydrophobicContact CG-CZ3 4.44Å; H260-W264 VanDerWaalsContact O-CD1 3.23Å; H260-W264 PolarHBondContact O-N 3.3Å; L261-W264 HydrophobicContact CD1-CB 4.37Å; L261-W264 PolarHBondContact O-N 2.63Å; W264-Q266 PolarHBondContact O-N 3.13Å; W264-Y267 PolarHBondContact O-N 3.4Å; W264-F268 HydrophobicContact CE3-CD2 4.03Å; W264-F268 HydrophobicContact CE3-CE2 4.26Å; W264-F268 HydrophobicContact CZ3-CD2 4.43Å; W264-F268 HydrophobicContact CZ3-CE2 4.23Å; W264-F268 PolarHBondContact O-N 2.89Å; W264-I273 HydrophobicContact CB-CD1 4.13Å
265	L	98.8	Very high	98.7	Very high	62 Å²	62	41.6 Å²	41.6	33%	0.325	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-10.3	-178.4	-66.4	177.9	0	0	0	114.3	L261 Y267 F268 M270 I273 M363	L261-L265 HydrophobicContact CD1-CD1 4.24Å; L261-L265 HydrophobicContact CD1-CD2 4.15Å; L261-L265 HydrophobicContact CD1-CG 3.86Å; L261-L265 HydrophobicContact CG-CD1 3.93Å; L261-L265 HydrophobicContact CG-CG 4.07Å; L261-L265 WeakPolarHBondContact O-CG 3.3Å; L261-L265 PolarHBondContact O-N 2.97Å; L265-Y267 PolarHBondContact O-N 2.89Å; L265-F268 WeakPolarHBondContact CA-O 3.27Å; L265-M270 HydrophobicContact CD1-CE 3.64Å; L265-M270 HydrophobicContact CD2-CB 4.38Å; L265-M270 HydrophobicContact CD2-CE 3.57Å; L265-M270 HydrophobicContact CD2-SD 4.38Å; L265-M270 HydrophobicContact CG-CE 4.17Å; L265-I273 HydrophobicContact CD2-CD1 4.15Å; L265-M363 HydrophobicContact CD1-CE 3.72Å
266	Q	98.6	Very high	98.7	Very high	134 Å²	134	41.6 Å²	41.6	63%	0.626	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.3	169.1	-71.4	169.6	62.6	0	0	112.7	D262 W264	D262-Q266 PolarHBondContact O-NE2 2.85Å; D262-Q266 VanDerWaalsContact O-NE2 3.15Å; W264-Q266 PolarHBondContact O-N 3.13Å
267	Y	98.8	Very high	98.7	Very high	99 Å²	99	41.4 Å²	41.4	39%	0.388	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-25.5	-171.9	-62.1	-89	0	0	0	114	P192 A193 N263 W264 L265	P192-Y267 HydrophobicContact CB-CD2 3.48Å; P192-Y267 VanDerWaalsContact CB-CD2 3.48Å; P192-Y267 HydrophobicContact CB-CE2 4.12Å; P192-Y267 HydrophobicContact CB-CG 3.97Å; A193-Y267 HydrophobicContact CB-CD1 4.13Å; A193-Y267 HydrophobicContact CB-CE1 3.49Å; A193-Y267 VanDerWaalsContact CB-CE1 3.49Å; A193-Y267 HydrophobicContact CB-CE2 4.38Å; N263-Y267 WeakPolarHBondContact O-CD2 3.26Å; W264-Y267 PolarHBondContact O-N 3.4Å; L265-Y267 PolarHBondContact O-N 2.89Å
268	F	98.8	Very high	98.7	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.013	21%	0.207	C	C	.	.	S	Bend	trans	-127.6	135.2	-178.1	-68.1	-86.1	0	0	0	110.8	P192 I195 L204 W264 L265 I273	P192-F268 WeakPolarHBondContact O-CE2 3.45Å; I195-F268 HydrophobicContact CB-CE2 4.35Å; I195-F268 HydrophobicContact CB-CZ 4.07Å; I195-F268 HydrophobicContact CG2-CE2 4.36Å; I195-F268 HydrophobicContact CG2-CZ 3.69Å; L204-F268 HydrophobicContact CD1-CB 4.12Å; L204-F268 HydrophobicContact CD1-CD1 3.94Å; L204-F268 HydrophobicContact CD1-CD2 3.63Å; L204-F268 HydrophobicContact CD1-CE1 4.27Å; L204-F268 HydrophobicContact CD1-CE2 3.98Å; L204-F268 HydrophobicContact CD1-CG 3.6Å; L204-F268 HydrophobicContact CD1-CZ 4.29Å; L204-F268 HydrophobicContact CG-CD1 4.48Å; W264-F268 HydrophobicContact CE3-CD2 4.03Å; W264-F268 HydrophobicContact CE3-CE2 4.26Å; W264-F268 HydrophobicContact CZ3-CD2 4.43Å; W264-F268 HydrophobicContact CZ3-CE2 4.23Å; W264-F268 PolarHBondContact O-N 2.89Å; L265-F268 WeakPolarHBondContact CA-O 3.27Å; F268-I273 HydrophobicContact CB-CD1 4.23Å; F268-I273 HydrophobicContact CB-CG1 4.4Å
269	P	98.5	Very high	98.7	Very high	61 Å²	61	44.4 Å²	44.4	40%	0.396	22%	0.22	S	C	.	.			trans	-68.1	155.6	170.9	32.4	-36.3	0	0	0	111	D271 Q272	P269-D271 VanDerWaalsContact C-N 3.25Å; P269-D271 WeakPolarHBondContact CB-OD1 3.47Å; P269-D271 WeakPolarHBondContact CG-OD1 3.23Å; P269-D271 PolarHBondContact O-N 3.49Å; P269-Q272 HydrophobicContact CG-CB 4.22Å; P269-Q272 HydrophobicContact CG-CG 3.9Å; P269-Q272 PolarHBondContact O-N 3.44Å; P269-Q272 VanDerWaalsContact O-N 3.12Å
270	M	98.4	Very high	98.7	Very high	63 Å²	63	42.8 Å²	42.8	31%	0.31	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-60.3	-33.8	-174.9	-176.2	56.7	70.8	0	0	113	L261 L265 Q272 I273 F275 M363	L261-M270 HydrophobicContact CD2-CE 4.1Å; L265-M270 HydrophobicContact CD1-CE 3.64Å; L265-M270 HydrophobicContact CD2-CB 4.38Å; L265-M270 HydrophobicContact CD2-CE 3.57Å; L265-M270 HydrophobicContact CD2-SD 4.38Å; L265-M270 HydrophobicContact CG-CE 4.17Å; M270-Q272 PolarHBondContact O-N 3.18Å; M270-I273 PolarHBondContact O-N 3.08Å; M270-F275 HydrophobicContact SD-CE2 3.75Å; M270-F275 HydrophobicContact SD-CZ 4.45Å; M270-M363 WeakPolarHBondContact CE-O 3.36Å
271	D	98.2	Very high	98.6	Very high	127 Å²	127	42.3 Å²	42.3	68%	0.679	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-69.1	-17.1	179.5	64.4	-17.7	0	0	0	113.8	P269 I273 F295	P269-D271 VanDerWaalsContact C-N 3.25Å; P269-D271 WeakPolarHBondContact CB-OD1 3.47Å; P269-D271 WeakPolarHBondContact CG-OD1 3.23Å; P269-D271 PolarHBondContact O-N 3.49Å; D271-I273 VanDerWaalsContact C-N 3.33Å; D271-F295 WeakPolarHBondContact O-CE2 3.18Å
272	Q	98.8	Very high	98.5	Very high	32 Å²	32	45.2 Å²	45.2	15%	0.15	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-86.7	1	170.3	-75	-175.8	-110	0	0	113.5	R200 D201 T202 L204 P269 M270 F295	R200-Q272 PolarHBondContact O-NE2 3.48Å; R200-Q272 PolarHBondContact O-OE1 3.02Å; D201-Q272 VanDerWaalsContact C-NE2 3.28Å; T202-Q272 PolarHBondContact O-NE2 3.15Å; L204-Q272 PolarHBondContact N-O 3.03Å; P269-Q272 HydrophobicContact CG-CB 4.22Å; P269-Q272 HydrophobicContact CG-CG 3.9Å; P269-Q272 PolarHBondContact O-N 3.44Å; P269-Q272 VanDerWaalsContact O-N 3.12Å; M270-Q272 PolarHBondContact O-N 3.18Å; Q272-F295 WeakPolarHBondContact O-CZ 3.18Å
273	I	98.9	Very high	98.5	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.051	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.7	-178.7	-46.3	-177.6	0	0	0	110.6	L204 V206 L261 W264 L265 F268 M270 D271 F275	L204-I273 HydrophobicContact CB-CG1 4.24Å; L204-I273 HydrophobicContact CB-CG2 4.32Å; L204-I273 HydrophobicContact CD1-CD1 4.35Å; L204-I273 HydrophobicContact CD1-CG1 4.12Å; L204-I273 CarbonylContact O-C 3.56Å; L204-I273 WeakPolarHBondContact O-CA 3.32Å; V206-I273 HydrophobicContact CG2-CG2 3.97Å; L261-I273 HydrophobicContact CD1-CD1 4.11Å; W264-I273 HydrophobicContact CB-CD1 4.13Å; L265-I273 HydrophobicContact CD2-CD1 4.15Å; F268-I273 HydrophobicContact CB-CD1 4.23Å; F268-I273 HydrophobicContact CB-CG1 4.4Å; M270-I273 PolarHBondContact O-N 3.08Å; D271-I273 VanDerWaalsContact C-N 3.33Å; I273-F275 HydrophobicContact CB-CE2 4.15Å; I273-F275 HydrophobicContact CB-CZ 4.25Å; I273-F275 HydrophobicContact CG2-CD2 4.48Å; I273-F275 HydrophobicContact CG2-CE1 4.02Å; I273-F275 HydrophobicContact CG2-CE2 3.73Å; I273-F275 HydrophobicContact CG2-CZ 3.47Å; I273-F275 VanDerWaalsContact CG2-CZ 3.47Å
274	L	98.9	Very high	98.5	Very high	17 Å²	17	47.7 Å²	47.7	9%	0.089	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.8	172.6	-179.2	68.8	0	0	0	111.4	L204 I205 V206 V276 V292 F295	L204-L274 PolarHBondContact O-N 3.18Å; I205-L274 WeakPolarHBondContact CA-O 3.17Å; I205-L274 HydrophobicContact CG1-CB 4.37Å; V206-L274 PolarHBondContact N-O 3.05Å; L274-V276 HydrophobicContact CD2-CG2 3.94Å; L274-V276 HydrophobicContact CG-CG2 4.14Å; L274-V292 HydrophobicContact CD2-CB 4.12Å; L274-V292 HydrophobicContact CD2-CG1 4.39Å; L274-V292 HydrophobicContact CD2-CG2 3.67Å; L274-F295 HydrophobicContact CB-CB 4.43Å; L274-F295 HydrophobicContact CB-CD1 3.6Å; L274-F295 HydrophobicContact CB-CD2 3.81Å; L274-F295 HydrophobicContact CB-CE1 3.64Å; L274-F295 HydrophobicContact CB-CE2 3.84Å; L274-F295 HydrophobicContact CB-CG 3.67Å; L274-F295 HydrophobicContact CB-CZ 3.76Å; L274-F295 HydrophobicContact CD1-CB 4.38Å; L274-F295 HydrophobicContact CD1-CG 4.41Å; L274-F295 HydrophobicContact CD2-CB 3.75Å; L274-F295 HydrophobicContact CD2-CD1 3.81Å; L274-F295 HydrophobicContact CD2-CG 3.83Å; L274-F295 HydrophobicContact CG-CB 4.4Å; L274-F295 HydrophobicContact CG-CD1 4.29Å; L274-F295 HydrophobicContact CG-CG 4.17Å
275	F	98.9	Very high	98.4	Very high	11 Å²	11	48.2 Å²	48.2	5%	0.048	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120	169.2	-56.2	-85	0	0	0	111.1	V206 V208 L261 M270 I273 R291 F360 T364 R366 F368	V206-F275 HydrophobicContact CB-CD1 3.76Å; V206-F275 HydrophobicContact CB-CE1 3.99Å; V206-F275 HydrophobicContact CG1-CD1 4.28Å; V206-F275 HydrophobicContact CG1-CE1 4.43Å; V206-F275 HydrophobicContact CG2-CD1 4.21Å; V206-F275 HydrophobicContact CG2-CE1 3.96Å; V206-F275 CarbonylContact O-C 3.59Å; V206-F275 WeakPolarHBondContact O-CA 3.41Å; V208-F275 HydrophobicContact CG1-CD1 4.34Å; L261-F275 HydrophobicContact CD1-CE1 4.3Å; L261-F275 HydrophobicContact CD1-CZ 3.6Å; L261-F275 HydrophobicContact CD2-CE1 4.3Å; L261-F275 HydrophobicContact CD2-CE2 4.45Å; L261-F275 HydrophobicContact CD2-CZ 3.72Å; L261-F275 HydrophobicContact CG-CZ 4.29Å; M270-F275 HydrophobicContact SD-CE2 3.75Å; M270-F275 HydrophobicContact SD-CZ 4.45Å; I273-F275 HydrophobicContact CB-CE2 4.15Å; I273-F275 HydrophobicContact CB-CZ 4.25Å; I273-F275 HydrophobicContact CG2-CD2 4.48Å; I273-F275 HydrophobicContact CG2-CE1 4.02Å; I273-F275 HydrophobicContact CG2-CE2 3.73Å; I273-F275 HydrophobicContact CG2-CZ 3.47Å; I273-F275 VanDerWaalsContact CG2-CZ 3.47Å; F275-R291 PolarHBondContact O-NH1 3.25Å; F275-F360 AromaticContact CD1-CE2 3.97Å; F275-F360 HydrophobicContact CD1-CE2 3.97Å; F275-F360 AromaticContact CD1-CZ 3.46Å; F275-F360 HydrophobicContact CD1-CZ 3.46Å; F275-F360 VanDerWaalsContact CD1-CZ 3.46Å; F275-F360 AromaticContact CE1-CE2 3.7Å; F275-F360 HydrophobicContact CE1-CE2 3.7Å; F275-F360 AromaticContact CE1-CZ 3.71Å; F275-F360 HydrophobicContact CE1-CZ 3.71Å; F275-F360 HydrophobicContact CG-CZ 4.1Å; F275-F360 HydrophobicContact CZ-CE2 4.33Å; F275-T364 HydrophobicContact CD1-CG2 4.22Å; F275-T364 HydrophobicContact CD2-CG2 3.47Å; F275-T364 VanDerWaalsContact CD2-CG2 3.47Å; F275-T364 HydrophobicContact CE1-CG2 4.16Å; F275-T364 HydrophobicContact CE2-CG2 3.43Å; F275-T364 VanDerWaalsContact CE2-CG2 3.43Å; F275-T364 HydrophobicContact CG-CG2 3.89Å; F275-T364 HydrophobicContact CZ-CG2 3.77Å; F275-R366 PolarHBondContact O-NH1 3.5Å; F275-F368 HydrophobicContact CB-CE1 4.41Å; F275-F368 HydrophobicContact CB-CZ 3.67Å
276	V	98.9	Very high	98.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.6	178.9	178.5	0	0	0	0	108.8	L134 I205 V206 V207 V208 L274 G278 E288 V292	L134-V276 HydrophobicContact CD2-CG2 4.24Å; I205-V276 HydrophobicContact CG2-CG2 3.76Å; V206-V276 PolarHBondContact O-N 3.09Å; V207-V276 WeakPolarHBondContact CA-O 3.24Å; V207-V276 HydrophobicContact CG1-CB 4.39Å; V207-V276 HydrophobicContact CG1-CG1 4.27Å; V207-V276 HydrophobicContact CG2-CB 4.28Å; V208-V276 WeakPolarHBondContact CG2-O 3.32Å; V208-V276 PolarHBondContact N-O 3.32Å; L274-V276 HydrophobicContact CD2-CG2 3.94Å; L274-V276 HydrophobicContact CG-CG2 4.14Å; V276-G278 PolarHBondContact O-N 3.28Å; V276-E288 HydrophobicContact CG1-CB 4.25Å; V276-E288 HydrophobicContact CG1-CG 4.4Å; V276-V292 HydrophobicContact CG2-CG2 3.65Å
277	S	98.8	Very high	98.4	Very high	8 Å²	8	40.9 Å²	40.9	6%	0.056	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	119.4	176.1	167.3	0	0	0	0	109.4	E279 R280 L281 E288	S277-E279 VanDerWaalsContact C-N 3.34Å; S277-E279 PolarHBondContact OG-OE2 3.06Å; S277-R280 PolarHBondContact O-N 2.89Å; S277-R280 WeakPolarHBondContact OG-CB 3.44Å; S277-R280 PolarHBondContact OG-N 2.96Å; S277-L281 VanDerWaalsContact O-CB 3.3Å; S277-L281 WeakPolarHBondContact O-CB 3.46Å; S277-L281 PolarHBondContact O-N 3.5Å; S277-E288 PolarHBondContact N-OE2 3.4Å
278	G	98.4	Very high	98.4	Very high	5 Å²	5	36.1 Å²	36.1	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-66.4	-35.6	175.6	0	0	0	0	0	112.4	V208 V276 L281 I282	V208-G278 VanDerWaalsContact O-CA 3.29Å; V208-G278 WeakPolarHBondContact O-CA 3.5Å; V208-G278 PolarHBondContact O-N 3.36Å; V276-G278 PolarHBondContact O-N 3.28Å; G278-L281 PolarHBondContact O-N 3Å; G278-I282 WeakPolarHBondContact O-CG1 3.47Å; G278-I282 PolarHBondContact O-N 3.01Å
279	E	98.3	Very high	98.4	Very high	58 Å²	58	36 Å²	36	27%	0.271	20%	0.201	S	C	.	.	H	α-helix	trans	-62.2	-49.8	173.7	-65.7	70	-148.9	0	0	110.5	R209 D210 S277 L281 I282 S283 W370	R209-E279 VanDerWaalsContact CA-OE1 3.31Å; R209-E279 WeakPolarHBondContact CA-OE1 3.32Å; R209-E279 WeakPolarHBondContact CG-OE1 3.43Å; D210-E279 PolarHBondContact N-OE1 3Å; S277-E279 VanDerWaalsContact C-N 3.34Å; S277-E279 PolarHBondContact OG-OE2 3.06Å; E279-L281 VanDerWaalsContact C-N 3.32Å; E279-L281 PolarHBondContact O-N 3.26Å; E279-I282 WeakPolarHBondContact O-CB 3.23Å; E279-I282 PolarHBondContact O-N 2.89Å; E279-S283 PolarHBondContact O-N 3.18Å; E279-S283 PolarHBondContact O-OG 3.1Å; E279-W370 PolarHBondContact OE2-NE1 2.86Å; E279-W370 VanDerWaalsContact OE2-NE1 3.17Å
280	R	98.1	Very high	98.4	Very high	89 Å²	89	33.4 Å²	33.4	34%	0.336	19%	0.186	S	C	.	.	H	α-helix	trans	-71.3	-27.9	180	-162.7	174.3	167.2	-143.6	7.4	112.6	S277 I282 S283 D284 E288	S277-R280 PolarHBondContact O-N 2.89Å; S277-R280 WeakPolarHBondContact OG-CB 3.44Å; S277-R280 PolarHBondContact OG-N 2.96Å; R280-I282 PolarHBondContact O-N 2.93Å; R280-S283 WeakPolarHBondContact CA-OG 3.36Å; R280-S283 PolarHBondContact O-N 3.27Å; R280-D284 HydrophobicContact CG-CB 3.96Å; R280-D284 IonicContact CZ-OD2 3.66Å; R280-D284 IonicContact NE-OD2 2.85Å; R280-D284 PolarHBondContact NE-OD2 2.72Å; R280-D284 VanDerWaalsContact NE-OD2 3.14Å; R280-D284 IonicContact NH2-OD2 3.38Å; R280-D284 PolarHBondContact NH2-OD2 3.23Å; R280-D284 CarbonylContact O-C 3.52Å; R280-D284 VanDerWaalsContact O-CA 3.32Å; R280-D284 WeakPolarHBondContact O-CA 3.46Å; R280-D284 PolarHBondContact O-N 3.2Å; R280-E288 HydrophobicContact CB-CG 3.72Å; R280-E288 WeakPolarHBondContact CD-OE1 3.39Å; R280-E288 HydrophobicContact CG-CG 3.83Å; R280-E288 IonicContact CZ-OE1 2.74Å; R280-E288 IonicContact NE-OE1 2.92Å; R280-E288 IonicContact NH1-OE1 3.73Å; R280-E288 PolarHBondContact NH1-OE1 3.37Å
281	L	98.1	Very high	98.4	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-22.3	170.5	-171	65.2	0	0	0	112.4	A133 L134 F137 V207 S277 G278 E279 P285 E288 L289	A133-L281 HydrophobicContact CB-CD2 4.19Å; L134-L281 HydrophobicContact CB-CD2 3.99Å; L134-L281 HydrophobicContact CD1-CD1 4.41Å; F137-L281 HydrophobicContact CD2-CD1 4Å; F137-L281 HydrophobicContact CE2-CD1 4.24Å; F137-L281 HydrophobicContact CE2-CG 4.41Å; V207-L281 HydrophobicContact CG1-CD2 4.2Å; S277-L281 VanDerWaalsContact O-CB 3.3Å; S277-L281 WeakPolarHBondContact O-CB 3.46Å; S277-L281 PolarHBondContact O-N 3.5Å; G278-L281 PolarHBondContact O-N 3Å; E279-L281 VanDerWaalsContact C-N 3.32Å; E279-L281 PolarHBondContact O-N 3.26Å; L281-P285 WeakPolarHBondContact O-CB 3.1Å; L281-E288 HydrophobicContact CD1-CB 4.38Å; L281-L289 HydrophobicContact CD1-CD2 3.54Å
282	I	96.9	Very high	98.4	Very high	63 Å²	63	27.8 Å²	27.8	32%	0.323	15%	0.152	S	C	.	.	H	α-helix	trans	-87.3	-49.2	173.7	-62.3	162	0	0	0	110.5	G278 E279 R280 F315 P316	G278-I282 WeakPolarHBondContact O-CG1 3.47Å; G278-I282 PolarHBondContact O-N 3.01Å; E279-I282 WeakPolarHBondContact O-CB 3.23Å; E279-I282 PolarHBondContact O-N 2.89Å; R280-I282 PolarHBondContact O-N 2.93Å; I282-F315 HydrophobicContact CD1-CD1 4.36Å; I282-F315 HydrophobicContact CD1-CE1 3.87Å; I282-F315 HydrophobicContact CG1-CD1 4.15Å; I282-F315 HydrophobicContact CG1-CE1 4.16Å; I282-F315 HydrophobicContact CG2-CD1 4.11Å; I282-F315 HydrophobicContact CG2-CE1 4.43Å; I282-P316 WeakPolarHBondContact O-CG 3.14Å
283	S	97.5	Very high	98.4	Very high	96 Å²	96	26.2 Å²	26.2	67%	0.671	15%	0.145	S	C	*	.	H	α-helix	trans	-79.8	-33.3	-172.9	66.5	0	0	0	0	114	E279 R280	E279-S283 PolarHBondContact O-N 3.18Å; E279-S283 PolarHBondContact O-OG 3.1Å; R280-S283 WeakPolarHBondContact CA-OG 3.36Å; R280-S283 PolarHBondContact O-N 3.27Å
284	D	98.1	Very high	98.4	Very high	57 Å²	57	29.9 Å²	29.9	31%	0.305	16%	0.164	S	C	.	.			trans	-144.6	70	-177.5	174.9	21.7	0	0	0	110	R280 A286 G287 E288	R280-D284 HydrophobicContact CG-CB 3.96Å; R280-D284 IonicContact CZ-OD2 3.66Å; R280-D284 IonicContact NE-OD2 2.85Å; R280-D284 PolarHBondContact NE-OD2 2.72Å; R280-D284 VanDerWaalsContact NE-OD2 3.14Å; R280-D284 IonicContact NH2-OD2 3.38Å; R280-D284 PolarHBondContact NH2-OD2 3.23Å; R280-D284 CarbonylContact O-C 3.52Å; R280-D284 VanDerWaalsContact O-CA 3.32Å; R280-D284 WeakPolarHBondContact O-CA 3.46Å; R280-D284 PolarHBondContact O-N 3.2Å; D284-A286 VanDerWaalsContact C-N 3.28Å; D284-A286 PolarHBondContact O-N 2.79Å; D284-G287 PolarHBondContact O-N 3.11Å; D284-G287 PolarHBondContact OD1-N 3.19Å; D284-G287 WeakPolarHBondContact OD2-CA 3.48Å; D284-E288 PolarHBondContact O-N 3.25Å
285	P	98.3	Very high	98.4	Very high	13 Å²	13	30.6 Å²	30.6	8%	0.084	17%	0.167	C	C	.	.	H	α-helix	trans	-59.9	-38.5	-178.5	22.5	-33.1	0	0	0	112.1	F137 L281 G287 E288 L289 F307 P316	F137-P285 HydrophobicContact CD2-CB 4.35Å; F137-P285 HydrophobicContact CE2-CB 4.04Å; L281-P285 WeakPolarHBondContact O-CB 3.1Å; P285-G287 PolarHBondContact O-N 2.95Å; P285-E288 PolarHBondContact O-N 3.36Å; P285-L289 WeakPolarHBondContact O-CB 3.26Å; P285-L289 WeakPolarHBondContact O-CD2 3.5Å; P285-L289 PolarHBondContact O-N 3.19Å; P285-F307 HydrophobicContact CB-CD1 4.03Å; P285-F307 HydrophobicContact CB-CD2 4.26Å; P285-F307 HydrophobicContact CB-CE1 3.9Å; P285-F307 HydrophobicContact CB-CE2 4.12Å; P285-F307 HydrophobicContact CB-CG 4.21Å; P285-F307 HydrophobicContact CB-CZ 3.94Å; P285-F307 HydrophobicContact CG-CB 4.2Å; P285-F307 HydrophobicContact CG-CD1 3.94Å; P285-F307 HydrophobicContact CG-CD2 3.97Å; P285-F307 HydrophobicContact CG-CE1 4.31Å; P285-F307 HydrophobicContact CG-CE2 4.34Å; P285-F307 HydrophobicContact CG-CG 3.75Å; P285-P316 HydrophobicContact CG-CB 4.06Å; P285-P316 HydrophobicContact CG-CG 4.31Å
286	A	98.3	Very high	98.4	Very high	20 Å²	20	30.6 Å²	30.6	17%	0.165	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-42.2	179.9	0	0	0	0	0	112.1	D284 L289 G290 D304 F307	D284-A286 VanDerWaalsContact C-N 3.28Å; D284-A286 PolarHBondContact O-N 2.79Å; A286-L289 PolarHBondContact O-N 3.17Å; A286-G290 PolarHBondContact O-N 3.08Å; A286-D304 HydrophobicContact CB-CB 4.22Å; A286-D304 VanDerWaalsContact CB-N 3.28Å; A286-F307 HydrophobicContact CB-CD2 4.28Å; A286-F307 HydrophobicContact CB-CE2 4.21Å
287	G	98.4	Very high	98.4	Very high	21 Å²	21	33.8 Å²	33.8	22%	0.216	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-44.1	176.9	0	0	0	0	0	113.4	D284 P285 G290 R291	D284-G287 PolarHBondContact O-N 3.11Å; D284-G287 PolarHBondContact OD1-N 3.19Å; D284-G287 WeakPolarHBondContact OD2-CA 3.48Å; P285-G287 PolarHBondContact O-N 2.95Å; G287-G290 PolarHBondContact O-N 3.38Å; G287-R291 PolarHBondContact O-N 3.47Å
288	E	98.4	Very high	98.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-39.1	175.1	-75.2	-61.7	109	0	0	111.9	V276 S277 R280 L281 D284 P285 G290 R291 V292 R366	V276-E288 HydrophobicContact CG1-CB 4.25Å; V276-E288 HydrophobicContact CG1-CG 4.4Å; S277-E288 PolarHBondContact N-OE2 3.4Å; R280-E288 HydrophobicContact CB-CG 3.72Å; R280-E288 WeakPolarHBondContact CD-OE1 3.39Å; R280-E288 HydrophobicContact CG-CG 3.83Å; R280-E288 IonicContact CZ-OE1 2.74Å; R280-E288 IonicContact NE-OE1 2.92Å; R280-E288 IonicContact NH1-OE1 3.73Å; R280-E288 PolarHBondContact NH1-OE1 3.37Å; L281-E288 HydrophobicContact CD1-CB 4.38Å; D284-E288 PolarHBondContact O-N 3.25Å; P285-E288 PolarHBondContact O-N 3.36Å; E288-G290 VanDerWaalsContact C-N 3.27Å; E288-G290 PolarHBondContact O-N 3.11Å; E288-R291 WeakPolarHBondContact O-CB 3.39Å; E288-R291 PolarHBondContact O-N 3.31Å; E288-R291 VanDerWaalsContact O-N 3.1Å; E288-R291 IonicContact OE1-NH1 3.95Å; E288-R291 IonicContact OE2-NH1 3.32Å; E288-R291 PolarHBondContact OE2-NH1 2.9Å; E288-V292 WeakPolarHBondContact O-CG2 3.38Å; E288-V292 PolarHBondContact O-N 3.15Å; E288-V292 VanDerWaalsContact O-N 3.11Å; E288-R366 IonicContact OE1-CZ 2.83Å; E288-R366 IonicContact OE1-NH1 3.85Å; E288-R366 IonicContact OE1-NH2 3.86Å; E288-R366 PolarHBondContact OE1-NH2 3.43Å; E288-R366 IonicContact OE2-CZ 3.37Å; E288-R366 IonicContact OE2-NH1 3.81Å; E288-R366 PolarHBondContact OE2-NH1 3.12Å; E288-R366 IonicContact OE2-NH2 3.14Å; E288-R366 PolarHBondContact OE2-NH2 3.31Å
289	L	98.7	Very high	98.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-30.4	176	-90.4	-64.7	0	0	0	112.3	L134 F137 L138 L281 P285 A286 R291 V292 Q293 I302 F307	L134-L289 HydrophobicContact CD1-CD1 4.04Å; L134-L289 HydrophobicContact CD1-CD2 4.07Å; F137-L289 HydrophobicContact CB-CD1 4.24Å; F137-L289 HydrophobicContact CB-CD2 4.07Å; F137-L289 HydrophobicContact CB-CG 4.21Å; F137-L289 HydrophobicContact CD2-CD2 3.98Å; L138-L289 HydrophobicContact CD2-CD1 3.41Å; L138-L289 VanDerWaalsContact CD2-CD1 3.41Å; L138-L289 HydrophobicContact CG-CD1 3.73Å; L281-L289 HydrophobicContact CD1-CD2 3.54Å; P285-L289 WeakPolarHBondContact O-CB 3.26Å; P285-L289 WeakPolarHBondContact O-CD2 3.5Å; P285-L289 PolarHBondContact O-N 3.19Å; A286-L289 PolarHBondContact O-N 3.17Å; L289-R291 VanDerWaalsContact C-N 3.3Å; L289-R291 PolarHBondContact O-N 3.32Å; L289-V292 PolarHBondContact O-N 3.28Å; L289-Q293 WeakPolarHBondContact O-CB 3.14Å; L289-Q293 VanDerWaalsContact O-CG 3.29Å; L289-Q293 WeakPolarHBondContact O-CG 3.26Å; L289-Q293 PolarHBondContact O-N 3.24Å; L289-Q293 PolarHBondContact O-NE2 3.28Å; L289-I302 HydrophobicContact CB-CG2 4.1Å; L289-I302 HydrophobicContact CD1-CD1 4.12Å; L289-I302 HydrophobicContact CG-CG2 4.14Å; L289-F307 HydrophobicContact CG-CZ 4.42Å
290	G	98.7	Very high	98.4	Very high	7 Å²	7	45.5 Å²	45.5	7%	0.072	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-38.2	170.7	0	0	0	0	0	112.8	A286 G287 E288 D294 R300	A286-G290 PolarHBondContact O-N 3.08Å; G287-G290 PolarHBondContact O-N 3.38Å; E288-G290 VanDerWaalsContact C-N 3.27Å; E288-G290 PolarHBondContact O-N 3.11Å; G290-D294 PolarHBondContact O-N 2.92Å; G290-R300 PolarHBondContact O-NE 3.21Å; G290-R300 VanDerWaalsContact O-NE 3.15Å; G290-R300 PolarHBondContact O-NH2 3.28Å
291	R	98.6	Very high	98.4	Very high	71 Å²	71	44 Å²	44	27%	0.268	24%	0.242	S	C	.	.	H	α-helix	trans	-71.3	-38.3	175.9	-63.3	175	64.2	-109.7	-2	111.8	F275 G287 E288 L289 F295	F275-R291 PolarHBondContact O-NH1 3.25Å; G287-R291 PolarHBondContact O-N 3.47Å; E288-R291 WeakPolarHBondContact O-CB 3.39Å; E288-R291 PolarHBondContact O-N 3.31Å; E288-R291 VanDerWaalsContact O-N 3.1Å; E288-R291 IonicContact OE1-NH1 3.95Å; E288-R291 IonicContact OE2-NH1 3.32Å; E288-R291 PolarHBondContact OE2-NH1 2.9Å; L289-R291 VanDerWaalsContact C-N 3.3Å; L289-R291 PolarHBondContact O-N 3.32Å; R291-F295 WeakPolarHBondContact O-CB 3.37Å; R291-F295 PolarHBondContact O-N 2.93Å
292	V	98.9	Very high	98.4	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.8	-41.1	179.7	-178.2	0	0	0	0	111.4	L134 L138 I205 L274 V276 E288 L289 F295 L296	L134-V292 HydrophobicContact CD1-CG2 4.08Å; L138-V292 HydrophobicContact CD1-CG1 3.95Å; L138-V292 HydrophobicContact CD2-CB 4.31Å; L138-V292 HydrophobicContact CD2-CG1 3.63Å; L138-V292 HydrophobicContact CG-CG1 4.34Å; I205-V292 HydrophobicContact CD1-CG1 3.88Å; L274-V292 HydrophobicContact CD2-CB 4.12Å; L274-V292 HydrophobicContact CD2-CG1 4.39Å; L274-V292 HydrophobicContact CD2-CG2 3.67Å; V276-V292 HydrophobicContact CG2-CG2 3.65Å; E288-V292 WeakPolarHBondContact O-CG2 3.38Å; E288-V292 PolarHBondContact O-N 3.15Å; E288-V292 VanDerWaalsContact O-N 3.11Å; L289-V292 PolarHBondContact O-N 3.28Å; V292-F295 PolarHBondContact O-N 3.46Å; V292-L296 HydrophobicContact CG1-CD1 3.96Å; V292-L296 HydrophobicContact CG1-CG 4.37Å; V292-L296 WeakPolarHBondContact O-CB 3.34Å; V292-L296 VanDerWaalsContact O-CG 3.32Å; V292-L296 WeakPolarHBondContact O-CG 3.48Å; V292-L296 PolarHBondContact O-N 3.25Å
293	Q	98.8	Very high	98.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-47.6	176.1	-72.9	167.6	114.1	0	0	111.2	H141 L289 F295 L296 G297 L298 K299 R300 I302	H141-Q293 PolarHBondContact CD2-OE1 3.01Å; L289-Q293 WeakPolarHBondContact O-CB 3.14Å; L289-Q293 VanDerWaalsContact O-CG 3.29Å; L289-Q293 WeakPolarHBondContact O-CG 3.26Å; L289-Q293 PolarHBondContact O-N 3.24Å; L289-Q293 PolarHBondContact O-NE2 3.28Å; Q293-F295 PolarHBondContact O-N 2.58Å; Q293-L296 CarbonylContact O-C 3.02Å; Q293-L296 PolarHBondContact O-N 3.37Å; Q293-G297 PolarHBondContact O-N 2.83Å; Q293-G297 VanDerWaalsContact O-N 3.08Å; Q293-L298 HydrophobicContact CB-CB 4.3Å; Q293-L298 PolarHBondContact O-N 2.61Å; Q293-K299 PolarHBondContact OE1-O 3.33Å; Q293-R300 HydrophobicContact CB-CG 4.3Å; Q293-I302 PolarHBondContact NE2-O 3Å
294	D	98.8	Very high	98.4	Very high	87 Å²	87	44 Å²	44	47%	0.465	24%	0.237	S	C	.	.	H	α-helix	trans	-59.9	-46.8	177	-69.5	7.1	0	0	0	112.1	G290 L296 G297 R300	G290-D294 PolarHBondContact O-N 2.92Å; D294-L296 PolarHBondContact O-N 2.89Å; D294-G297 PolarHBondContact O-N 3.22Å; D294-R300 IonicContact OD1-CZ 3.17Å; D294-R300 IonicContact OD1-NE 3.34Å; D294-R300 PolarHBondContact OD1-NE 3.37Å; D294-R300 IonicContact OD1-NH2 2.56Å; D294-R300 PolarHBondContact OD1-NH2 2.95Å; D294-R300 IonicContact OD2-CZ 3.67Å; D294-R300 IonicContact OD2-NE 3.43Å; D294-R300 PolarHBondContact OD2-NE 3.06Å; D294-R300 IonicContact OD2-NH2 3.41Å; D294-R300 PolarHBondContact OD2-NH2 3.29Å
295	F	98.9	Very high	98.3	Very high	32 Å²	32	48.7 Å²	48.7	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-36.9	178.5	172.7	-105.3	0	0	0	112.1	K203 I205 D271 Q272 L274 R291 V292 Q293 G297	K203-F295 HydrophobicContact CB-CE1 3.76Å; K203-F295 HydrophobicContact CB-CZ 3.83Å; K203-F295 HydrophobicContact CD-CE1 4.13Å; K203-F295 HydrophobicContact CD-CZ 4.17Å; K203-F295 WeakPolarHBondContact CD-O 3.36Å; K203-F295 HydrophobicContact CG-CE1 4.38Å; K203-F295 HydrophobicContact CG-CZ 4.21Å; K203-F295 PolarHBondContact NZ-O 3.48Å; I205-F295 HydrophobicContact CD1-CD1 4.44Å; I205-F295 HydrophobicContact CD1-CE1 4.44Å; I205-F295 HydrophobicContact CG1-CD1 4.17Å; I205-F295 HydrophobicContact CG1-CE1 3.8Å; D271-F295 WeakPolarHBondContact O-CE2 3.18Å; Q272-F295 WeakPolarHBondContact O-CZ 3.18Å; L274-F295 HydrophobicContact CB-CB 4.43Å; L274-F295 HydrophobicContact CB-CD1 3.6Å; L274-F295 HydrophobicContact CB-CD2 3.81Å; L274-F295 HydrophobicContact CB-CE1 3.64Å; L274-F295 HydrophobicContact CB-CE2 3.84Å; L274-F295 HydrophobicContact CB-CG 3.67Å; L274-F295 HydrophobicContact CB-CZ 3.76Å; L274-F295 HydrophobicContact CD1-CB 4.38Å; L274-F295 HydrophobicContact CD1-CG 4.41Å; L274-F295 HydrophobicContact CD2-CB 3.75Å; L274-F295 HydrophobicContact CD2-CD1 3.81Å; L274-F295 HydrophobicContact CD2-CG 3.83Å; L274-F295 HydrophobicContact CG-CB 4.4Å; L274-F295 HydrophobicContact CG-CD1 4.29Å; L274-F295 HydrophobicContact CG-CG 4.17Å; R291-F295 WeakPolarHBondContact O-CB 3.37Å; R291-F295 PolarHBondContact O-N 2.93Å; V292-F295 PolarHBondContact O-N 3.46Å; Q293-F295 PolarHBondContact O-N 2.58Å; F295-G297 VanDerWaalsContact C-N 3.27Å; F295-G297 PolarHBondContact O-N 3.44Å
296	L	98.8	Very high	98.3	Very high	11 Å²	11	50.5 Å²	50.5	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-79.6	-6.1	176	-67.1	177.8	0	0	0	113.4	A121 I144 I177 M179 K203 I205 V292 Q293 D294 L298	A121-L296 HydrophobicContact CB-CD2 3.48Å; A121-L296 VanDerWaalsContact CB-CD2 3.48Å; I144-L296 HydrophobicContact CD1-CD1 4.2Å; I177-L296 HydrophobicContact CD1-CB 4Å; I177-L296 WeakPolarHBondContact CD1-O 3.32Å; M179-L296 HydrophobicContact CE-CD1 4.21Å; M179-L296 HydrophobicContact SD-CD1 4.03Å; K203-L296 HydrophobicContact CD-CD2 4.44Å; I205-L296 HydrophobicContact CD1-CD1 4.46Å; I205-L296 HydrophobicContact CD1-CD2 4.26Å; V292-L296 HydrophobicContact CG1-CD1 3.96Å; V292-L296 HydrophobicContact CG1-CG 4.37Å; V292-L296 WeakPolarHBondContact O-CB 3.34Å; V292-L296 VanDerWaalsContact O-CG 3.32Å; V292-L296 WeakPolarHBondContact O-CG 3.48Å; V292-L296 PolarHBondContact O-N 3.25Å; Q293-L296 CarbonylContact O-C 3.02Å; Q293-L296 PolarHBondContact O-N 3.37Å; D294-L296 PolarHBondContact O-N 2.89Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 HydrophobicContact CB-CD1 3.91Å; L296-L298 HydrophobicContact CB-CG 3.9Å; L296-L298 HydrophobicContact CD1-CD1 4.03Å
297	G	98.5	Very high	98.3	Very high	66 Å²	66	50.3 Å²	50.3	68%	0.68	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	23.7	-174.9	0	0	0	0	0	113.1	Q293 D294 F295	Q293-G297 PolarHBondContact O-N 2.83Å; Q293-G297 VanDerWaalsContact O-N 3.08Å; D294-G297 PolarHBondContact O-N 3.22Å; F295-G297 VanDerWaalsContact C-N 3.27Å; F295-G297 PolarHBondContact O-N 3.44Å
298	L	98.5	Very high	98.1	Very high	19 Å²	19	52.8 Å²	52.8	10%	0.099	26%	0.261	C	S	.	.			trans	-93.7	152.9	-179.8	-65.3	175	0	0	0	111.3	D143 I144 I177 Q293 L296	D143-L298 HydrophobicContact CB-CD2 3.89Å; I144-L298 HydrophobicContact CD1-CD1 3.53Å; I144-L298 HydrophobicContact CG1-CD1 3.6Å; I177-L298 HydrophobicContact CD1-CD1 4.13Å; I177-L298 HydrophobicContact CD1-CD2 3.69Å; I177-L298 HydrophobicContact CD1-CG 3.86Å; I177-L298 HydrophobicContact CG1-CD2 4.24Å; Q293-L298 HydrophobicContact CB-CB 4.3Å; Q293-L298 PolarHBondContact O-N 2.61Å; L296-L298 VanDerWaalsContact C-N 3.29Å; L296-L298 HydrophobicContact CB-CD1 3.91Å; L296-L298 HydrophobicContact CB-CG 3.9Å; L296-L298 HydrophobicContact CD1-CD1 4.03Å
299	K	98.2	Very high	97.9	Very high	160 Å²	160	58.5 Å²	58.5	70%	0.696	29%	0.286	S	S	*	.			trans	-62	140.7	168.4	-174	176.9	-178.9	177.7	0	109.7	H141 Q293 I301	H141-K299 PolarHBondContact NE2-O 3.45Å; Q293-K299 PolarHBondContact OE1-O 3.33Å; K299-I301 HydrophobicContact CB-CD1 4.47Å; K299-I301 HydrophobicContact CB-CG1 4.19Å; K299-I301 HydrophobicContact CD-CD1 4.46Å; K299-I301 HydrophobicContact CD-CG1 4.2Å; K299-I301 HydrophobicContact CG-CG1 4.08Å; K299-I301 PolarHBondContact O-N 2.98Å
300	R	98.3	Very high	97.7	Very high	138 Å²	138	60.4 Å²	60.4	52%	0.521	30%	0.296	S	S	.	.			trans	-72.6	87	172.6	-70.5	-175.3	168.9	-169.2	-8.5	111.3	G290 Q293 D294	G290-R300 PolarHBondContact O-NE 3.21Å; G290-R300 VanDerWaalsContact O-NE 3.15Å; G290-R300 PolarHBondContact O-NH2 3.28Å; Q293-R300 HydrophobicContact CB-CG 4.3Å; D294-R300 IonicContact OD1-CZ 3.17Å; D294-R300 IonicContact OD1-NE 3.34Å; D294-R300 PolarHBondContact OD1-NE 3.37Å; D294-R300 IonicContact OD1-NH2 2.56Å; D294-R300 PolarHBondContact OD1-NH2 2.95Å; D294-R300 IonicContact OD2-CZ 3.67Å; D294-R300 IonicContact OD2-NE 3.43Å; D294-R300 PolarHBondContact OD2-NE 3.06Å; D294-R300 IonicContact OD2-NH2 3.41Å; D294-R300 PolarHBondContact OD2-NH2 3.29Å
301	I	98.3	Very high	97.4	Very high	58 Å²	58	68.4 Å²	68.4	30%	0.297	33%	0.332	S	S	.	.			trans	-98.2	-40.5	176.9	-63.9	179.7	0	0	0	110.8	P142 K299 T303 H306	P142-I301 HydrophobicContact CG-CD1 3.69Å; K299-I301 HydrophobicContact CB-CD1 4.47Å; K299-I301 HydrophobicContact CB-CG1 4.19Å; K299-I301 HydrophobicContact CD-CD1 4.46Å; K299-I301 HydrophobicContact CD-CG1 4.2Å; K299-I301 HydrophobicContact CG-CG1 4.08Å; K299-I301 PolarHBondContact O-N 2.98Å; I301-T303 PolarHBondContact O-N 3.28Å; I301-H306 PolarHBondContact O-CE1 3.16Å
302	I	98.2	Very high	96.9	Very high	4 Å²	4	71.8 Å²	71.8	2%	0.021	36%	0.361	C	S	.	.			trans	-74.3	117.4	179.1	-57.9	164.3	0	0	0	108.6	F137 V140 H141 L289 Q293 F307	F137-I302 VanDerWaalsContact O-CD1 3.26Å; F137-I302 WeakPolarHBondContact O-CD1 3.41Å; V140-I302 HydrophobicContact CB-CD1 4.47Å; V140-I302 HydrophobicContact CB-CG1 4.34Å; V140-I302 HydrophobicContact CG1-CG1 4.49Å; H141-I302 HydrophobicContact CB-CD1 3.9Å; H141-I302 HydrophobicContact CB-CG1 4.34Å; L289-I302 HydrophobicContact CB-CG2 4.1Å; L289-I302 HydrophobicContact CD1-CD1 4.12Å; L289-I302 HydrophobicContact CG-CG2 4.14Å; Q293-I302 PolarHBondContact NE2-O 3Å; I302-F307 HydrophobicContact CG2-CE2 3.74Å; I302-F307 HydrophobicContact CG2-CZ 3.77Å
303	T	98	Very high	96.5	Very high	51 Å²	51	74.3 Å²	74.3	31%	0.313	37%	0.371	S	S	.	.			trans	-130.3	176.5	-178.5	66.8	0	0	0	0	111.8	I301 K305 H306 F307	I301-T303 PolarHBondContact O-N 3.28Å; T303-K305 PolarHBondContact O-N 3.41Å; T303-K305 VanDerWaalsContact O-N 3.12Å; T303-K305 PolarHBondContact OG1-N 2.93Å; T303-H306 PolarHBondContact N-ND1 3.25Å; T303-H306 WeakPolarHBondContact O-CB 3.4Å; T303-H306 PolarHBondContact O-N 2.87Å; T303-H306 PolarHBondContact O-ND1 3.28Å; T303-H306 PolarHBondContact OG1-ND1 3.02Å; T303-F307 WeakPolarHBondContact O-CD2 3.31Å; T303-F307 WeakPolarHBondContact O-CE2 3.29Å
304	D	96.9	Very high	96.1	Very high	108 Å²	108	75.9 Å²	75.9	58%	0.578	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-46.3	-37	172.2	67.1	-43.3	0	0	0	113.5	A286 H306 F307	A286-D304 HydrophobicContact CB-CB 4.22Å; A286-D304 VanDerWaalsContact CB-N 3.28Å; D304-H306 PolarHBondContact O-N 3.31Å; D304-H306 VanDerWaalsContact O-N 3.08Å; D304-F307 PolarHBondContact O-N 3.25Å
305	K	96.6	Very high	95.9	Very high	156 Å²	156	74.8 Å²	74.8	68%	0.678	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-59.1	-24.8	180	-65.3	-177.4	-177.9	177.9	0	113.4	T303 F307 K319	T303-K305 PolarHBondContact O-N 3.41Å; T303-K305 VanDerWaalsContact O-N 3.12Å; T303-K305 PolarHBondContact OG1-N 2.93Å; K305-F307 VanDerWaalsContact C-N 3.3Å; K305-K319 VanDerWaalsContact O-CD 3.3Å; K305-K319 WeakPolarHBondContact O-CD 3.45Å; K305-K319 PolarHBondContact O-NZ 3.38Å
306	H	97.4	Very high	95.7	Very high	52 Å²	52	73.8 Å²	73.8	24%	0.241	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-79.8	-13.6	-179.2	-61	82.1	0	0	0	113.3	I301 T303 D304 L318 K319	I301-H306 PolarHBondContact O-CE1 3.16Å; T303-H306 PolarHBondContact N-ND1 3.25Å; T303-H306 WeakPolarHBondContact O-CB 3.4Å; T303-H306 PolarHBondContact O-N 2.87Å; T303-H306 PolarHBondContact O-ND1 3.28Å; T303-H306 PolarHBondContact OG1-ND1 3.02Å; D304-H306 PolarHBondContact O-N 3.31Å; D304-H306 VanDerWaalsContact O-N 3.08Å; H306-L318 WeakPolarHBondContact O-CA 3.38Å; H306-K319 PolarHBondContact O-N 3.02Å
307	F	97.5	Very high	95.6	Very high	16 Å²	16	73.3 Å²	73.3	7%	0.07	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	151	-174.4	-56.7	-77.3	0	0	0	112	F137 P285 A286 L289 I302 T303 D304 K305 C317 L318 K319	F137-F307 HydrophobicContact CB-CE1 4.13Å; F137-F307 HydrophobicContact CB-CZ 4.24Å; F137-F307 AromaticContact CD1-CE1 3.77Å; F137-F307 HydrophobicContact CD1-CE1 3.77Å; F137-F307 AromaticContact CD2-CE1 3.68Å; F137-F307 HydrophobicContact CD2-CE1 3.68Å; F137-F307 HydrophobicContact CD2-CZ 4.18Å; F137-F307 HydrophobicContact CE1-CD1 4.46Å; F137-F307 HydrophobicContact CE1-CE1 4.02Å; F137-F307 AromaticContact CE2-CE1 3.94Å; F137-F307 HydrophobicContact CE2-CE1 3.94Å; F137-F307 AromaticContact CG-CE1 3.6Å; F137-F307 HydrophobicContact CG-CE1 3.6Å; F137-F307 HydrophobicContact CG-CZ 4.14Å; F137-F307 HydrophobicContact CZ-CD1 4.44Å; F137-F307 HydrophobicContact CZ-CE1 4.1Å; P285-F307 HydrophobicContact CB-CD1 4.03Å; P285-F307 HydrophobicContact CB-CD2 4.26Å; P285-F307 HydrophobicContact CB-CE1 3.9Å; P285-F307 HydrophobicContact CB-CE2 4.12Å; P285-F307 HydrophobicContact CB-CG 4.21Å; P285-F307 HydrophobicContact CB-CZ 3.94Å; P285-F307 HydrophobicContact CG-CB 4.2Å; P285-F307 HydrophobicContact CG-CD1 3.94Å; P285-F307 HydrophobicContact CG-CD2 3.97Å; P285-F307 HydrophobicContact CG-CE1 4.31Å; P285-F307 HydrophobicContact CG-CE2 4.34Å; P285-F307 HydrophobicContact CG-CG 3.75Å; A286-F307 HydrophobicContact CB-CD2 4.28Å; A286-F307 HydrophobicContact CB-CE2 4.21Å; L289-F307 HydrophobicContact CG-CZ 4.42Å; I302-F307 HydrophobicContact CG2-CE2 3.74Å; I302-F307 HydrophobicContact CG2-CZ 3.77Å; T303-F307 WeakPolarHBondContact O-CD2 3.31Å; T303-F307 WeakPolarHBondContact O-CE2 3.29Å; D304-F307 PolarHBondContact O-N 3.25Å; K305-F307 VanDerWaalsContact C-N 3.3Å; F307-C317 WeakPolarHBondContact CA-O 3.33Å; F307-L318 HydrophobicContact CD1-CD2 3.97Å; F307-L318 HydrophobicContact CE1-CD2 3.65Å; F307-L318 HydrophobicContact CZ-CD2 4.43Å; F307-K319 WeakPolarHBondContact O-CE 3.21Å; F307-K319 PolarHBondContact O-NZ 3.45Å
308	Y	95.8	Very high	95.5	Very high	73 Å²	73	70.2 Å²	70.2	29%	0.286	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	149.5	162.8	74.3	-77.5	0	0	0	109	N310 C317 L318 K319 P327 C329	Y308-N310 HydrophobicContact CE2-CB 4.25Å; Y308-C317 HydrophobicContact CD1-CB 3.96Å; Y308-C317 WeakPolarHBondContact CD1-O 3.47Å; Y308-C317 HydrophobicContact CE1-CB 3.35Å; Y308-C317 HydrophobicContact CE2-CB 4.14Å; Y308-C317 VanDerWaalsContact CZ-CB 3.47Å; Y308-C317 PolarHBondContact N-O 3.47Å; Y308-C317 PolarHBondContact O-N 3.34Å; Y308-L318 WeakPolarHBondContact CE1-O 3.24Å; Y308-K319 HydrophobicContact CD1-CB 4.46Å; Y308-K319 HydrophobicContact CD1-CG 3.73Å; Y308-K319 HydrophobicContact CG-CG 4.29Å; Y308-P327 HydrophobicContact CE1-CB 3.77Å; Y308-C329 PolarHBondContact OH-SG 3.38Å; Y308-C329 VanDerWaalsContact OH-SG 3.33Å
309	F	94.4	Very high	95.2	Very high	119 Å²	119	73.8 Å²	73.8	52%	0.522	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.9	177.9	-166.8	-98.3	0	0	0	110.4	Q311 G314	F309-Q311 HydrophobicContact CD1-CG 4.28Å; F309-G314 VanDerWaalsContact CZ-C 3.45Å
310	N	94.4	Very high	94.8	Very high	41 Å²	41	72.8 Å²	72.8	22%	0.219	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	105.5	174.2	-176.5	-42	0	0	0	109.1	Y308 T312 K313 G314 F315 C329	Y308-N310 HydrophobicContact CE2-CB 4.25Å; N310-T312 PolarHBondContact O-N 3.48Å; N310-T312 WeakPolarHBondContact OD1-CB 3.24Å; N310-T312 PolarHBondContact OD1-N 3.44Å; N310-T312 VanDerWaalsContact OD1-N 3.13Å; N310-K313 HydrophobicContact CB-CB 3.97Å; N310-K313 PolarHBondContact O-N 3.02Å; N310-K313 PolarHBondContact OD1-N 2.95Å; N310-G314 PolarHBondContact O-N 3.37Å; N310-F315 PolarHBondContact N-O 2.88Å; N310-F315 VanDerWaalsContact N-O 3.12Å; N310-C329 PolarHBondContact ND2-SG 2.72Å; N310-C329 VanDerWaalsContact ND2-SG 3.45Å
311	Q	91.7	Very high	94.1	Very high	174 Å²	174	67.3 Å²	67.3	81%	0.813	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-41.7	-177.8	-67.3	-179.3	-3	0	0	112.7	F309 K313 G314	F309-Q311 HydrophobicContact CD1-CG 4.28Å; Q311-K313 VanDerWaalsContact C-N 3.3Å; Q311-K313 PolarHBondContact O-N 2.86Å; Q311-G314 PolarHBondContact O-N 3.03Å
312	T	88.1	Confident	93.4	Very high	143 Å²	143	67.5 Å²	67.5	88%	0.877	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-37.6	178.1	-47.7	0	0	0	0	112	N310	N310-T312 PolarHBondContact O-N 3.48Å; N310-T312 WeakPolarHBondContact OD1-CB 3.24Å; N310-T312 PolarHBondContact OD1-N 3.44Å; N310-T312 VanDerWaalsContact OD1-N 3.13Å
313	K	89.7	Confident	92.6	Very high	52 Å²	52	71.7 Å²	71.7	23%	0.226	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-30.6	178.4	-166.8	-180	168.8	68.4	0	112	N310 Q311 F315 C329 L330 G331 K334	N310-K313 HydrophobicContact CB-CB 3.97Å; N310-K313 PolarHBondContact O-N 3.02Å; N310-K313 PolarHBondContact OD1-N 2.95Å; Q311-K313 VanDerWaalsContact C-N 3.3Å; Q311-K313 PolarHBondContact O-N 2.86Å; K313-F315 HydrophobicContact CD-CB 4.41Å; K313-F315 HydrophobicContact CG-CB 4.4Å; K313-F315 HydrophobicContact CG-CD2 4.18Å; K313-F315 VanDerWaalsContact O-CD2 3.23Å; K313-F315 WeakPolarHBondContact O-CD2 3.44Å; K313-C329 HydrophobicContact CD-CB 3.96Å; K313-L330 WeakPolarHBondContact CE-O 3.46Å; K313-L330 PolarHBondContact NZ-O 3.11Å; K313-G331 PolarHBondContact NZ-O 3.43Å; K313-K334 PolarHBondContact NZ-O 3.07Å
314	G	90.9	Very high	92	Very high	33 Å²	33	71.8 Å²	71.8	34%	0.34	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	20.3	-172.5	0	0	0	0	0	114.2	F309 N310 Q311	F309-G314 VanDerWaalsContact CZ-C 3.45Å; N310-G314 PolarHBondContact O-N 3.37Å; Q311-G314 PolarHBondContact O-N 3.03Å
315	F	94.6	Very high	91.4	Very high	64 Å²	64	71.5 Å²	71.5	28%	0.281	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	153.1	-177.3	-71.2	-84.8	0	0	0	111.9	I282 N310 K313	I282-F315 HydrophobicContact CD1-CD1 4.36Å; I282-F315 HydrophobicContact CD1-CE1 3.87Å; I282-F315 HydrophobicContact CG1-CD1 4.15Å; I282-F315 HydrophobicContact CG1-CE1 4.16Å; I282-F315 HydrophobicContact CG2-CD1 4.11Å; I282-F315 HydrophobicContact CG2-CE1 4.43Å; N310-F315 PolarHBondContact N-O 2.88Å; N310-F315 VanDerWaalsContact N-O 3.12Å; K313-F315 HydrophobicContact CD-CB 4.41Å; K313-F315 HydrophobicContact CG-CB 4.4Å; K313-F315 HydrophobicContact CG-CD2 4.18Å; K313-F315 VanDerWaalsContact O-CD2 3.23Å; K313-F315 WeakPolarHBondContact O-CD2 3.44Å
316	P	95	Very high	91	Very high	11 Å²	11	71.2 Å²	71.2	7%	0.071	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	144.2	169.9	29.5	-35.6	0	0	0	111.4	F137 I282 P285	F137-P316 HydrophobicContact CZ-CG 4.43Å; I282-P316 WeakPolarHBondContact O-CG 3.14Å; P285-P316 HydrophobicContact CG-CB 4.06Å; P285-P316 HydrophobicContact CG-CG 4.31Å
317	C	96.3	Very high	90.7	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.007	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.5	177.5	-60.8	0	0	0	0	110.2	F307 Y308 H328 C329	F307-C317 WeakPolarHBondContact CA-O 3.33Å; Y308-C317 HydrophobicContact CD1-CB 3.96Å; Y308-C317 WeakPolarHBondContact CD1-O 3.47Å; Y308-C317 HydrophobicContact CE1-CB 3.35Å; Y308-C317 HydrophobicContact CE2-CB 4.14Å; Y308-C317 VanDerWaalsContact CZ-CB 3.47Å; Y308-C317 PolarHBondContact N-O 3.47Å; Y308-C317 PolarHBondContact O-N 3.34Å; C317-H328 WeakPolarHBondContact CB-O 3.32Å; C317-C329 HydrophobicContact CB-CB 4.01Å; C317-C329 WeakPolarHBondContact CB-SG 3.36Å; C317-C329 WeakPolarHBondContact SG-CA 3.42Å; C317-C329 WeakPolarHBondContact SG-CB 3.39Å; C317-C329 CovalentContact SG-SG 2.03Å; C317-C329 PolarHBondContact SG-SG 2.86Å
318	L	95.8	Very high	90.5	Very high	2 Å²	2	75.3 Å²	75.3	1%	0.01	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	129.7	176.4	-70.9	175.2	0	0	0	110.4	F137 V140 H306 F307 Y308 K320 A321 P327 H328	F137-L318 HydrophobicContact CD1-CD1 4.07Å; F137-L318 HydrophobicContact CD1-CD2 3.69Å; F137-L318 HydrophobicContact CD1-CG 3.75Å; F137-L318 HydrophobicContact CE1-CD2 4.2Å; F137-L318 HydrophobicContact CE1-CG 4.01Å; F137-L318 HydrophobicContact CG-CD2 4.45Å; V140-L318 HydrophobicContact CG2-CD1 3.76Å; V140-L318 HydrophobicContact CG2-CD2 3.83Å; V140-L318 HydrophobicContact CG2-CG 4.42Å; H306-L318 WeakPolarHBondContact O-CA 3.38Å; F307-L318 HydrophobicContact CD1-CD2 3.97Å; F307-L318 HydrophobicContact CE1-CD2 3.65Å; F307-L318 HydrophobicContact CZ-CD2 4.43Å; Y308-L318 WeakPolarHBondContact CE1-O 3.24Å; L318-K320 VanDerWaalsContact C-N 3.27Å; L318-K320 PolarHBondContact O-N 3.48Å; L318-A321 HydrophobicContact CD1-CB 4.49Å; L318-P327 CarbonylContact O-C 3.34Å; L318-P327 VanDerWaalsContact O-CA 3.3Å; L318-P327 WeakPolarHBondContact O-CA 2.98Å; L318-H328 HydrophobicContact CB-CB 4.49Å; L318-H328 PolarHBondContact N-O 3.18Å; L318-H328 PolarHBondContact O-N 2.94Å
319	K	93.2	Very high	90.5	Very high	93 Å²	93	73.4 Å²	73.4	40%	0.404	41%	0.411	S	S	.	.	S	Bend	trans	-65.2	-33.5	172.9	-69.9	-167.3	-171.4	135.6	0	112.2	K305 H306 F307 Y308 P327	K305-K319 VanDerWaalsContact O-CD 3.3Å; K305-K319 WeakPolarHBondContact O-CD 3.45Å; K305-K319 PolarHBondContact O-NZ 3.38Å; H306-K319 PolarHBondContact O-N 3.02Å; F307-K319 WeakPolarHBondContact O-CE 3.21Å; F307-K319 PolarHBondContact O-NZ 3.45Å; Y308-K319 HydrophobicContact CD1-CB 4.46Å; Y308-K319 HydrophobicContact CD1-CG 3.73Å; Y308-K319 HydrophobicContact CG-CG 4.29Å; K319-P327 VanDerWaalsContact O-CA 3.3Å; K319-P327 WeakPolarHBondContact O-CA 3.43Å
320	K	90.8	Very high	90.4	Very high	140 Å²	140	69 Å²	69	61%	0.609	39%	0.393	S	S	*	.	S	Bend	trans	-141.3	125	173.1	-64.7	-176.2	-179.1	179.7	0	108.4	L318	L318-K320 VanDerWaalsContact C-N 3.27Å; L318-K320 PolarHBondContact O-N 3.48Å
321	A	82.9	Confident	90.3	Very high	22 Å²	22	69.2 Å²	69.2	18%	0.182	41%	0.405	C	S	.	.			trans	-86.1	164.2	174.6	0	0	0	0	0	111.2	L318 G323 S324 H328	L318-A321 HydrophobicContact CD1-CB 4.49Å; A321-G323 PolarHBondContact O-N 3.07Å; A321-S324 PolarHBondContact O-N 3.43Å; A321-S324 VanDerWaalsContact O-N 3.08Å; A321-H328 HydrophobicContact CB-CB 3.63Å
322	E	83.5	Confident	90.2	Very high	63 Å²	63	70.7 Å²	70.7	29%	0.294	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	125.5	170.6	-170.2	-172.4	-143.6	0	0	110.4	R139 R145 S324	R139-E322 HydrophobicContact CB-CB 4.15Å; R139-E322 IonicContact CZ-OE2 2.62Å; R139-E322 IonicContact NE-OE2 3.63Å; R139-E322 PolarHBondContact NE-OE2 2.96Å; R139-E322 IonicContact NH2-OE2 3.62Å; R139-E322 PolarHBondContact NH2-OE2 3Å; R139-E322 WeakPolarHBondContact O-CB 3.49Å; R139-E322 WeakPolarHBondContact O-CG 3.46Å; R145-E322 IonicContact CZ-OE1 3.74Å; R145-E322 IonicContact NH1-OE1 3.8Å; R145-E322 PolarHBondContact NH1-OE1 3.37Å; R145-E322 IonicContact NH1-OE2 3.24Å; E322-S324 PolarHBondContact O-N 2.63Å
323	G	81.2	Confident	90.3	Very high	91 Å²	91	67.5 Å²	67.5	94%	0.938	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	10.4	179	0	0	0	0	0	115.6	A321	A321-G323 PolarHBondContact O-N 3.07Å
324	S	85.6	Confident	90.5	Very high	54 Å²	54	68.5 Å²	68.5	38%	0.378	39%	0.393	S	S	.	.			trans	-133.8	136.5	178.5	179.5	0	0	0	0	112.3	A321 E322 K326	A321-S324 PolarHBondContact O-N 3.43Å; A321-S324 VanDerWaalsContact O-N 3.08Å; E322-S324 PolarHBondContact O-N 2.63Å; S324-K326 VanDerWaalsContact C-N 3.27Å; S324-K326 PolarHBondContact OG-N 2.94Å; S324-K326 VanDerWaalsContact OG-N 3.12Å
325	S	84.1	Confident	90.6	Very high	102 Å²	102	69 Å²	69	71%	0.713	40%	0.398	S	S	*	.	S	Bend	trans	-79	-10.1	171.6	57.5	0	0	0	0	113.5
326	K	87.4	Confident	90.6	Very high	149 Å²	149	68.9 Å²	68.9	65%	0.648	40%	0.396	S	S	*	.	S	Bend	trans	-95.2	152.4	-175.4	-63.3	-177.9	-179.2	179.2	0	112.1	S324	S324-K326 VanDerWaalsContact C-N 3.27Å; S324-K326 PolarHBondContact OG-N 2.94Å; S324-K326 VanDerWaalsContact OG-N 3.12Å
327	P	91.1	Very high	90.6	Very high	83 Å²	83	74.8 Å²	74.8	54%	0.539	43%	0.432	S	S	.	.			trans	-58	146.9	169.7	-23	33.5	0	0	0	112.4	Y308 L318 K319	Y308-P327 HydrophobicContact CE1-CB 3.77Å; L318-P327 CarbonylContact O-C 3.34Å; L318-P327 VanDerWaalsContact O-CA 3.3Å; L318-P327 WeakPolarHBondContact O-CA 2.98Å; K319-P327 VanDerWaalsContact O-CA 3.3Å; K319-P327 WeakPolarHBondContact O-CA 3.43Å
328	H	94.2	Very high	90.6	Very high	71 Å²	71	77.7 Å²	77.7	33%	0.329	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-133.2	118.1	178.9	-179.9	76.1	0	0	0	111.3	C317 L318 A321	C317-H328 WeakPolarHBondContact CB-O 3.32Å; L318-H328 HydrophobicContact CB-CB 4.49Å; L318-H328 PolarHBondContact N-O 3.18Å; L318-H328 PolarHBondContact O-N 2.94Å; A321-H328 HydrophobicContact CB-CB 3.63Å
329	C	94.7	Very high	90.7	Very high	33 Å²	33	79.9 Å²	79.9	22%	0.223	46%	0.459	C	S	.	.			trans	-100.8	146.3	164.9	-70.3	0	0	0	0	109.8	Y308 N310 K313 C317	Y308-C329 PolarHBondContact OH-SG 3.38Å; Y308-C329 VanDerWaalsContact OH-SG 3.33Å; N310-C329 PolarHBondContact ND2-SG 2.72Å; N310-C329 VanDerWaalsContact ND2-SG 3.45Å; K313-C329 HydrophobicContact CD-CB 3.96Å; C317-C329 HydrophobicContact CB-CB 4.01Å; C317-C329 WeakPolarHBondContact CB-SG 3.36Å; C317-C329 WeakPolarHBondContact SG-CA 3.42Å; C317-C329 WeakPolarHBondContact SG-CB 3.39Å; C317-C329 CovalentContact SG-SG 2.03Å; C317-C329 PolarHBondContact SG-SG 2.86Å
330	L	93.5	Very high	90.8	Very high	27 Å²	27	83 Å²	83	14%	0.141	48%	0.481	C	S	.	.			trans	-58.3	143.8	171.6	-62.1	177.5	0	0	0	110.9	R132 A133 E136 K313 K334	R132-L330 HydrophobicContact CG-CD2 4.1Å; A133-L330 HydrophobicContact CB-CD1 3.72Å; E136-L330 HydrophobicContact CB-CD2 4.34Å; E136-L330 HydrophobicContact CG-CD2 3.8Å; K313-L330 WeakPolarHBondContact CE-O 3.46Å; K313-L330 PolarHBondContact NZ-O 3.11Å; L330-K334 HydrophobicContact CB-CB 3.72Å; L330-K334 HydrophobicContact CB-CG 3.95Å; L330-K334 HydrophobicContact CD1-CB 4.09Å; L330-K334 HydrophobicContact CD1-CG 4.29Å
331	G	91.4	Very high	91.2	Very high	46 Å²	46	77 Å²	77	47%	0.474	46%	0.455	S	S	.	.			trans	-61.5	174.1	-176.6	0	0	0	0	0	115	K313 T333 K334	K313-G331 PolarHBondContact NZ-O 3.43Å; G331-T333 PolarHBondContact O-N 3.39Å; G331-K334 PolarHBondContact O-N 2.93Å
332	K	90.8	Very high	91.9	Very high	204 Å²	204	78.6 Å²	78.6	89%	0.887	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-25	-176.9	-60.4	-176.7	-179.1	-178.4	0	113.9	K334	K332-K334 PolarHBondContact O-N 3.1Å
333	T	90	Very high	92.5	Very high	77 Å²	77	80.2 Å²	80.2	47%	0.472	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-1.2	177.5	65.2	0	0	0	0	113.9	G331 R336	G331-T333 PolarHBondContact O-N 3.39Å; T333-R336 PolarHBondContact O-NH1 3.22Å
334	K	94.8	Very high	93.3	Very high	72 Å²	72	80.9 Å²	80.9	31%	0.313	46%	0.455	S	S	.	.	S	Bend	trans	-120.3	123.4	178.2	-53	-61.1	173.6	179.8	0	109.1	R132 K313 L330 G331 K332	R132-K334 HydrophobicContact CB-CD 4.49Å; K313-K334 PolarHBondContact NZ-O 3.07Å; L330-K334 HydrophobicContact CB-CB 3.72Å; L330-K334 HydrophobicContact CB-CG 3.95Å; L330-K334 HydrophobicContact CD1-CB 4.09Å; L330-K334 HydrophobicContact CD1-CG 4.29Å; G331-K334 PolarHBondContact O-N 2.93Å; K332-K334 PolarHBondContact O-N 3.1Å
335	G	91.6	Very high	93.8	Very high	43 Å²	43	78.5 Å²	78.5	44%	0.443	44%	0.438	S	S	.	.	S	Bend	trans	80.4	48	-169.8	0	0	0	0	0	113
336	R	94.5	Very high	94.4	Very high	62 Å²	62	75.2 Å²	75.2	23%	0.234	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-69.8	142.9	174.1	-68.3	-174.9	-174.8	68.9	3.4	109.4	T220 S224 T333 H338	T220-R336 HydrophobicContact CG2-CB 3.97Å; S224-R336 PolarHBondContact OG-NE 3.42Å; T333-R336 PolarHBondContact O-NH1 3.22Å; R336-H338 PolarHBondContact O-CD2 3.46Å; R336-H338 VanDerWaalsContact O-CD2 3.25Å; R336-H338 PolarHBondContact O-N 3.08Å
337	T	95.5	Very high	94.9	Very high	136 Å²	136	72.4 Å²	72.4	83%	0.834	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-58.7	130.4	165.9	-48.3	0	0	0	0	109.2	T220	T220-T337 WeakPolarHBondContact CG2-O 3.35Å
338	H	97	Very high	95.1	Very high	62 Å²	62	72.2 Å²	72.2	29%	0.287	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-86.1	147.4	176.6	-66.8	178.5	0	0	0	109.7	I216 S217 R336	I216-H338 HydrophobicContact CG2-CB 3.81Å; S217-H338 WeakPolarHBondContact CB-NE2 3.49Å; S217-H338 PolarHBondContact OG-NE2 3.18Å; R336-H338 PolarHBondContact O-CD2 3.46Å; R336-H338 VanDerWaalsContact O-CD2 3.25Å; R336-H338 PolarHBondContact O-N 3.08Å
339	P	96.3	Very high	95.3	Very high	47 Å²	47	68.8 Å²	68.8	31%	0.305	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-62.3	152.6	168.5	28.9	-33.7	0	0	0	109.9	Y219 T220 I341	Y219-P339 HydrophobicContact CD1-CG 4.16Å; Y219-P339 HydrophobicContact CE1-CG 4.03Å; T220-P339 WeakPolarHBondContact OG1-CD 3.43Å; P339-I341 HydrophobicContact CB-CD1 4.33Å; P339-I341 HydrophobicContact CG-CD1 3.86Å; P339-I341 PolarHBondContact O-N 3.42Å
340	N	97.1	Very high	95.5	Very high	159 Å²	159	70 Å²	70	85%	0.85	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-69.3	127	169.7	-168.7	25.1	0	0	0	108.5
341	I	97.8	Very high	95.7	Very high	14 Å²	14	71.9 Å²	71.9	7%	0.072	39%	0.386	C	S	.	.			trans	-109.1	140.6	-178.8	-55.9	-52.5	0	0	0	108.2	I216 F232 P339 P343 V345 V346	I216-I341 HydrophobicContact CD1-CG1 3.87Å; I216-I341 HydrophobicContact CG1-CG1 4.05Å; I216-I341 HydrophobicContact CG2-CG1 4.18Å; F232-I341 HydrophobicContact CB-CD1 3.6Å; F232-I341 HydrophobicContact CD1-CD1 3.93Å; F232-I341 HydrophobicContact CD1-CG1 4.21Å; F232-I341 HydrophobicContact CD1-CG2 3.69Å; F232-I341 HydrophobicContact CE1-CG2 4.08Å; F232-I341 HydrophobicContact CG-CD1 3.81Å; F232-I341 HydrophobicContact CG-CG1 4.47Å; P339-I341 HydrophobicContact CB-CD1 4.33Å; P339-I341 HydrophobicContact CG-CD1 3.86Å; P339-I341 PolarHBondContact O-N 3.42Å; I341-P343 WeakPolarHBondContact O-CD 3.19Å; I341-V345 HydrophobicContact CG2-CB 4.37Å; I341-V345 HydrophobicContact CG2-CG1 4.41Å; I341-V346 HydrophobicContact CB-CG2 4.01Å; I341-V346 HydrophobicContact CG2-CG2 3.79Å
342	D	97.5	Very high	96	Very high	55 Å²	55	71.7 Å²	71.7	29%	0.294	37%	0.372	S	S	.	.			trans	-49.6	120.6	173.2	-175.4	-22.1	0	0	0	111.2	E233 R240 E344 V345 V346	E233-D342 HydrophobicContact CG-CB 4.02Å; E233-D342 PolarHBondContact OE1-N 3.43Å; R240-D342 IonicContact NH2-OD2 3.16Å; D342-E344 PolarHBondContact O-N 2.69Å; D342-E344 WeakPolarHBondContact OD1-CB 3.11Å; D342-E344 PolarHBondContact OD1-N 3.39Å; D342-V345 HydrophobicContact CB-CB 4.22Å; D342-V345 HydrophobicContact CB-CG2 3.86Å; D342-V345 WeakPolarHBondContact O-CB 3.45Å; D342-V345 PolarHBondContact O-N 3.44Å; D342-V346 PolarHBondContact O-N 3.44Å; D342-V346 VanDerWaalsContact O-N 3.07Å
343	P	97.5	Very high	96.4	Very high	98 Å²	98	62 Å²	62	64%	0.636	33%	0.33	S	S	*	.	H	α-helix	trans	-55.1	-32.4	-179.9	-27.1	35.4	0	0	0	114	I341 V345 V346 Q347	I341-P343 WeakPolarHBondContact O-CD 3.19Å; P343-V345 VanDerWaalsContact C-N 3.34Å; P343-V346 PolarHBondContact O-N 3.04Å; P343-Q347 PolarHBondContact O-N 3.1Å
344	E	96.1	Very high	96.8	Very high	104 Å²	104	62.7 Å²	62.7	49%	0.486	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-39.5	177.3	-168.2	-172	162	0	0	111	D342 Q347 R348	D342-E344 PolarHBondContact O-N 2.69Å; D342-E344 WeakPolarHBondContact OD1-CB 3.11Å; D342-E344 PolarHBondContact OD1-N 3.39Å; E344-Q347 PolarHBondContact O-N 3.19Å; E344-R348 WeakPolarHBondContact O-CG 3.5Å; E344-R348 PolarHBondContact O-N 3.48Å; E344-R348 IonicContact OE1-CZ 2.8Å; E344-R348 VanDerWaalsContact OE1-CZ 3.24Å; E344-R348 IonicContact OE1-NE 3.45Å; E344-R348 PolarHBondContact OE1-NE 2.81Å; E344-R348 VanDerWaalsContact OE1-NE 3.1Å; E344-R348 IonicContact OE1-NH2 3.8Å; E344-R348 PolarHBondContact OE1-NH2 2.91Å
345	V	96.9	Very high	96.9	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.024	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-40.1	177	178.2	0	0	0	0	110.9	F232 E233 T236 F237 I341 D342 P343 R348 L349	F232-V345 HydrophobicContact CD1-CG1 4.44Å; F232-V345 HydrophobicContact CE1-CG1 4.33Å; E233-V345 HydrophobicContact CB-CG2 4.15Å; E233-V345 HydrophobicContact CG-CB 4.28Å; E233-V345 HydrophobicContact CG-CG1 4.36Å; E233-V345 HydrophobicContact CG-CG2 3.77Å; T236-V345 HydrophobicContact CG2-CG1 4Å; F237-V345 HydrophobicContact CE2-CB 4.28Å; F237-V345 HydrophobicContact CE2-CG1 3.79Å; F237-V345 HydrophobicContact CE2-CG2 3.72Å; F237-V345 HydrophobicContact CZ-CB 4.47Å; F237-V345 HydrophobicContact CZ-CG1 4.07Å; F237-V345 HydrophobicContact CZ-CG2 4.17Å; I341-V345 HydrophobicContact CG2-CB 4.37Å; I341-V345 HydrophobicContact CG2-CG1 4.41Å; D342-V345 HydrophobicContact CB-CB 4.22Å; D342-V345 HydrophobicContact CB-CG2 3.86Å; D342-V345 WeakPolarHBondContact O-CB 3.45Å; D342-V345 PolarHBondContact O-N 3.44Å; P343-V345 VanDerWaalsContact C-N 3.34Å; V345-R348 PolarHBondContact O-N 3.3Å; V345-L349 HydrophobicContact CG1-CD1 4.47Å; V345-L349 WeakPolarHBondContact O-CG 3.4Å; V345-L349 PolarHBondContact O-N 3.3Å
346	V	97.6	Very high	97.3	Very high	33 Å²	33	64.4 Å²	64.4	20%	0.2	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-48.4	172.7	173.1	0	0	0	0	110.5	V212 I341 D342 P343 L349 R350	V212-V346 HydrophobicContact CG1-CG1 4.19Å; I341-V346 HydrophobicContact CB-CG2 4.01Å; I341-V346 HydrophobicContact CG2-CG2 3.79Å; D342-V346 PolarHBondContact O-N 3.44Å; D342-V346 VanDerWaalsContact O-N 3.07Å; P343-V346 PolarHBondContact O-N 3.04Å; V346-L349 PolarHBondContact O-N 3.12Å; V346-R350 WeakPolarHBondContact O-CG 3.47Å; V346-R350 PolarHBondContact O-N 2.6Å
347	Q	96.7	Very high	97.5	Very high	90 Å²	90	61.7 Å²	61.7	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-46.6	-179.5	-172.8	57.8	44	0	0	111.8	P343 E344 L349 R350 D351	P343-Q347 PolarHBondContact O-N 3.1Å; E344-Q347 PolarHBondContact O-N 3.19Å; Q347-L349 VanDerWaalsContact C-N 3.28Å; Q347-L349 PolarHBondContact O-N 3.17Å; Q347-R350 WeakPolarHBondContact O-CB 3.31Å; Q347-R350 PolarHBondContact O-N 3.26Å; Q347-R350 VanDerWaalsContact O-N 3.08Å; Q347-D351 PolarHBondContact NE2-OD1 3.27Å; Q347-D351 PolarHBondContact NE2-OD2 3Å; Q347-D351 PolarHBondContact O-N 2.69Å
348	R	96.6	Very high	97.6	Very high	79 Å²	79	59.2 Å²	59.2	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-38.6	176.3	-72	178.4	-177.8	-144.9	1.8	112.3	F237 E344 V345 F352	F237-R348 HydrophobicContact CE1-CB 4.43Å; F237-R348 HydrophobicContact CZ-CB 4.31Å; E344-R348 WeakPolarHBondContact O-CG 3.5Å; E344-R348 PolarHBondContact O-N 3.48Å; E344-R348 IonicContact OE1-CZ 2.8Å; E344-R348 VanDerWaalsContact OE1-CZ 3.24Å; E344-R348 IonicContact OE1-NE 3.45Å; E344-R348 PolarHBondContact OE1-NE 2.81Å; E344-R348 VanDerWaalsContact OE1-NE 3.1Å; E344-R348 IonicContact OE1-NH2 3.8Å; E344-R348 PolarHBondContact OE1-NH2 2.91Å; V345-R348 PolarHBondContact O-N 3.3Å; R348-F352 WeakPolarHBondContact O-CB 3.34Å; R348-F352 PolarHBondContact O-N 3.46Å
349	L	98.1	Very high	97.7	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.3	-39.8	174.4	-78.9	175.6	0	0	0	112.6	V212 F232 T236 I245 I252 V345 V346 Q347 D351 F352 Y353	V212-L349 HydrophobicContact CG1-CB 4.33Å; V212-L349 HydrophobicContact CG1-CD1 4.43Å; V212-L349 HydrophobicContact CG2-CB 3.95Å; F232-L349 HydrophobicContact CE1-CD1 3.53Å; F232-L349 HydrophobicContact CZ-CD1 3.64Å; T236-L349 HydrophobicContact CG2-CD1 4.03Å; T236-L349 HydrophobicContact CG2-CD2 3.8Å; T236-L349 HydrophobicContact CG2-CG 3.92Å; I245-L349 HydrophobicContact CD1-CD2 4.07Å; I245-L349 HydrophobicContact CG1-CD2 4.46Å; I245-L349 HydrophobicContact CG2-CD2 4.37Å; I252-L349 HydrophobicContact CD1-CD1 4.41Å; I252-L349 HydrophobicContact CD1-CD2 3.54Å; V345-L349 HydrophobicContact CG1-CD1 4.47Å; V345-L349 WeakPolarHBondContact O-CG 3.4Å; V345-L349 PolarHBondContact O-N 3.3Å; V346-L349 PolarHBondContact O-N 3.12Å; Q347-L349 VanDerWaalsContact C-N 3.28Å; Q347-L349 PolarHBondContact O-N 3.17Å; L349-D351 VanDerWaalsContact C-N 3.35Å; L349-F352 PolarHBondContact O-N 3.33Å; L349-Y353 HydrophobicContact CD2-CE2 4.25Å; L349-Y353 WeakPolarHBondContact O-CD2 3.48Å; L349-Y353 PolarHBondContact O-N 3.44Å
350	R	98.2	Very high	97.8	Very high	57 Å²	57	58.1 Å²	58.1	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-47.8	173.5	-72.4	-170.4	-179.3	-65.9	-7.9	110.8	D210 V212 V346 Q347 F352 Y353 R354 W370	D210-R350 IonicContact OD1-NH1 3.03Å; D210-R350 IonicContact OD2-CZ 3.17Å; D210-R350 IonicContact OD2-NH1 3.98Å; D210-R350 PolarHBondContact OD2-NH1 3.29Å; D210-R350 IonicContact OD2-NH2 2.76Å; D210-R350 PolarHBondContact OD2-NH2 3.27Å; D210-R350 VanDerWaalsContact OD2-NH2 3.16Å; V212-R350 HydrophobicContact CG2-CG 3.83Å; V346-R350 WeakPolarHBondContact O-CG 3.47Å; V346-R350 PolarHBondContact O-N 2.6Å; Q347-R350 WeakPolarHBondContact O-CB 3.31Å; Q347-R350 PolarHBondContact O-N 3.26Å; Q347-R350 VanDerWaalsContact O-N 3.08Å; R350-F352 VanDerWaalsContact C-N 3.3Å; R350-F352 PolarHBondContact O-N 2.68Å; R350-Y353 PolarHBondContact O-N 3.1Å; R350-R354 WeakPolarHBondContact O-CB 3.45Å; R350-R354 PolarHBondContact O-N 2.83Å; R350-W370 PolarHBondContact NH1-O 2.85Å; R350-W370 VanDerWaalsContact NH1-O 3.09Å
351	D	97.4	Very high	97.9	Very high	67 Å²	67	51.1 Å²	51.1	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-61.9	-39.7	178.7	-64.9	-29.1	0	0	0	111.8	Q347 L349 R354 P355	Q347-D351 PolarHBondContact NE2-OD1 3.27Å; Q347-D351 PolarHBondContact NE2-OD2 3Å; Q347-D351 PolarHBondContact O-N 2.69Å; L349-D351 VanDerWaalsContact C-N 3.35Å; D351-R354 IonicContact OD1-CZ 2.74Å; D351-R354 VanDerWaalsContact OD1-CZ 3.24Å; D351-R354 IonicContact OD1-NH1 3.04Å; D351-R354 PolarHBondContact OD1-NH1 3.41Å; D351-R354 IonicContact OD1-NH2 3.62Å; D351-R354 PolarHBondContact OD1-NH2 3.36Å; D351-P355 WeakPolarHBondContact O-CD 3.44Å
352	F	98	Very high	97.9	Very high	42 Å²	42	57.5 Å²	57.5	18%	0.184	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-44.8	173.7	168.6	-96.8	0	0	0	113.4	I245 T247 I252 I256 R348 L349 R350 P355 F356	I245-F352 HydrophobicContact CB-CD2 4.37Å; I245-F352 HydrophobicContact CD1-CB 3.29Å; I245-F352 HydrophobicContact CD1-CD1 4.29Å; I245-F352 HydrophobicContact CD1-CD2 3.88Å; I245-F352 HydrophobicContact CD1-CG 3.56Å; I245-F352 HydrophobicContact CG2-CD2 4.4Å; I245-F352 HydrophobicContact CG2-CE2 4.4Å; I245-F352 HydrophobicContact CG2-CG 4.46Å; I245-F352 HydrophobicContact CG2-CZ 4.47Å; T247-F352 HydrophobicContact CG2-CE2 3.69Å; T247-F352 HydrophobicContact CG2-CZ 3.57Å; I252-F352 HydrophobicContact CG2-CD1 4.39Å; I252-F352 HydrophobicContact CG2-CE1 3.59Å; I252-F352 HydrophobicContact CG2-CZ 4.02Å; I256-F352 HydrophobicContact CD1-CE1 4.42Å; I256-F352 HydrophobicContact CD1-CZ 4.06Å; I256-F352 HydrophobicContact CG1-CE1 4.42Å; R348-F352 WeakPolarHBondContact O-CB 3.34Å; R348-F352 PolarHBondContact O-N 3.46Å; L349-F352 PolarHBondContact O-N 3.33Å; R350-F352 VanDerWaalsContact C-N 3.3Å; R350-F352 PolarHBondContact O-N 2.68Å; F352-P355 WeakPolarHBondContact O-CD 3.37Å; F352-F356 HydrophobicContact CD2-CE2 4.42Å; F352-F356 HydrophobicContact CE1-CE2 4.27Å; F352-F356 AromaticContact CE2-CE2 3.96Å; F352-F356 HydrophobicContact CE2-CE2 3.96Å; F352-F356 AromaticContact CZ-CE2 3.86Å; F352-F356 HydrophobicContact CZ-CE2 3.86Å; F352-F356 VanDerWaalsContact O-CD2 3.26Å; F352-F356 WeakPolarHBondContact O-CD2 3.38Å; F352-F356 WeakPolarHBondContact O-CE2 3.49Å
353	Y	98.7	Very high	98	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-76.6	-28.7	-178	-76.9	-60.6	0	0	0	113.6	P211 V212 I252 I256 L349 R350 F356 N357	P211-Y353 HydrophobicContact CB-CD1 3.72Å; P211-Y353 HydrophobicContact CB-CD2 3.61Å; P211-Y353 HydrophobicContact CB-CE1 3.8Å; P211-Y353 HydrophobicContact CB-CE2 3.67Å; P211-Y353 HydrophobicContact CB-CG 3.62Å; P211-Y353 HydrophobicContact CG-CD1 4.27Å; P211-Y353 HydrophobicContact CG-CG 4.21Å; V212-Y353 HydrophobicContact CG2-CD2 3.86Å; V212-Y353 HydrophobicContact CG2-CE2 4.32Å; I252-Y353 WeakPolarHBondContact CA-OH 3.44Å; I252-Y353 PolarHBondContact O-OH 3.27Å; I256-Y353 HydrophobicContact CG1-CE1 4.05Å; L349-Y353 HydrophobicContact CD2-CE2 4.25Å; L349-Y353 WeakPolarHBondContact O-CD2 3.48Å; L349-Y353 PolarHBondContact O-N 3.44Å; R350-Y353 PolarHBondContact O-N 3.1Å; Y353-F356 CarbonylContact O-C 3.58Å; Y353-F356 WeakPolarHBondContact O-CA 3.33Å; Y353-F356 WeakPolarHBondContact O-CB 3.12Å; Y353-F356 PolarHBondContact O-N 3.43Å; Y353-N357 PolarHBondContact O-N 2.9Å
354	R	98.6	Very high	98	Very high	92 Å²	92	53.3 Å²	53.3	35%	0.347	25%	0.251	S	S	.	.	H	α-helix	trans	-44.9	-53	-176.2	-170.5	-178.6	-66.4	116.6	3.7	114.5	R350 D351 F356 N357 M358 D371	R350-R354 WeakPolarHBondContact O-CB 3.45Å; R350-R354 PolarHBondContact O-N 2.83Å; D351-R354 IonicContact OD1-CZ 2.74Å; D351-R354 VanDerWaalsContact OD1-CZ 3.24Å; D351-R354 IonicContact OD1-NH1 3.04Å; D351-R354 PolarHBondContact OD1-NH1 3.41Å; D351-R354 IonicContact OD1-NH2 3.62Å; D351-R354 PolarHBondContact OD1-NH2 3.36Å; R354-F356 VanDerWaalsContact C-N 3.29Å; R354-F356 PolarHBondContact O-N 2.85Å; R354-N357 PolarHBondContact O-N 2.74Å; R354-M358 WeakPolarHBondContact O-CG 3.48Å; R354-M358 PolarHBondContact O-N 2.8Å; R354-D371 WeakPolarHBondContact CA-OD1 3.28Å; R354-D371 HydrophobicContact CG-CB 4.37Å
355	P	98.4	Very high	98.1	Very high	81 Å²	81	51.9 Å²	51.9	53%	0.526	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-35.5	178.6	23.9	-34.8	0	0	0	113.1	D351 F352 K359	D351-P355 WeakPolarHBondContact O-CD 3.44Å; F352-P355 WeakPolarHBondContact O-CD 3.37Å; P355-K359 PolarHBondContact O-N 3.07Å; P355-K359 VanDerWaalsContact O-N 3.14Å
356	F	98.6	Very high	98.1	Very high	71 Å²	71	54.1 Å²	54.1	31%	0.311	27%	0.272	S	S	.	.	H	α-helix	trans	-73.8	-36	177.7	-56	-68.2	0	0	0	112.4	I256 F352 Y353 R354 K359 F360	I256-F356 HydrophobicContact CG2-CB 4.2Å; I256-F356 HydrophobicContact CG2-CD1 3.65Å; I256-F356 HydrophobicContact CG2-CD2 4.28Å; I256-F356 HydrophobicContact CG2-CE1 4.05Å; I256-F356 HydrophobicContact CG2-CG 3.79Å; F352-F356 HydrophobicContact CD2-CE2 4.42Å; F352-F356 HydrophobicContact CE1-CE2 4.27Å; F352-F356 AromaticContact CE2-CE2 3.96Å; F352-F356 HydrophobicContact CE2-CE2 3.96Å; F352-F356 AromaticContact CZ-CE2 3.86Å; F352-F356 HydrophobicContact CZ-CE2 3.86Å; F352-F356 VanDerWaalsContact O-CD2 3.26Å; F352-F356 WeakPolarHBondContact O-CD2 3.38Å; F352-F356 WeakPolarHBondContact O-CE2 3.49Å; Y353-F356 CarbonylContact O-C 3.58Å; Y353-F356 WeakPolarHBondContact O-CA 3.33Å; Y353-F356 WeakPolarHBondContact O-CB 3.12Å; Y353-F356 PolarHBondContact O-N 3.43Å; R354-F356 VanDerWaalsContact C-N 3.29Å; R354-F356 PolarHBondContact O-N 2.85Å; F356-K359 PolarHBondContact O-N 2.87Å; F356-F360 WeakPolarHBondContact O-CB 3.2Å; F356-F360 PolarHBondContact O-N 2.79Å
357	N	98.8	Very high	98.1	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-47.5	174.6	-69.2	-13	0	0	0	110.7	P211 Y353 R354 K359 F360 Y361 W370 D371	P211-N357 WeakPolarHBondContact CG-OD1 3.26Å; Y353-N357 PolarHBondContact O-N 2.9Å; R354-N357 PolarHBondContact O-N 2.74Å; N357-K359 VanDerWaalsContact C-N 3.34Å; N357-K359 PolarHBondContact O-N 2.97Å; N357-F360 CarbonylContact O-C 3.37Å; N357-F360 WeakPolarHBondContact O-CA 3.35Å; N357-F360 WeakPolarHBondContact O-CB 3.43Å; N357-F360 PolarHBondContact O-N 3.47Å; N357-Y361 HydrophobicContact CB-CE1 4.43Å; N357-Y361 HydrophobicContact CB-CE2 4.18Å; N357-Y361 WeakPolarHBondContact O-CD1 3.36Å; N357-Y361 WeakPolarHBondContact O-CD2 3.22Å; N357-Y361 PolarHBondContact O-N 3.22Å; N357-W370 HydrophobicContact CB-CE3 4.49Å; N357-D371 WeakPolarHBondContact CB-OD1 3.31Å; N357-D371 WeakPolarHBondContact CB-OD2 3.47Å; N357-D371 PolarHBondContact ND2-OD1 3.31Å
358	M	98.6	Very high	98.2	Very high	85 Å²	85	55 Å²	55	42%	0.419	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-44.6	176.5	-68.4	-53.2	-60	0	0	111.9	R354 F360 Y361 Q362	R354-M358 WeakPolarHBondContact O-CG 3.48Å; R354-M358 PolarHBondContact O-N 2.8Å; M358-F360 VanDerWaalsContact C-N 3.33Å; M358-F360 PolarHBondContact O-N 3.2Å; M358-Y361 PolarHBondContact O-N 3.34Å; M358-Y361 HydrophobicContact SD-CD2 3.88Å; M358-Y361 HydrophobicContact SD-CE2 4.1Å; M358-Q362 WeakPolarHBondContact O-CG 3.25Å; M358-Q362 PolarHBondContact O-N 3.01Å
359	K	98.7	Very high	98.1	Very high	86 Å²	86	52.5 Å²	52.5	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-59.2	-45	172.7	-176.8	179.8	172.3	-169.7	0	111.1	A258 D262 P355 F356 N357 Y361 Q362 M363	A258-K359 HydrophobicContact CB-CB 4.12Å; A258-K359 HydrophobicContact CB-CD 3.9Å; A258-K359 HydrophobicContact CB-CG 3.94Å; D262-K359 IonicContact OD1-NZ 2.98Å; D262-K359 IonicContact OD2-NZ 3.5Å; D262-K359 PolarHBondContact OD2-NZ 3.09Å; P355-K359 PolarHBondContact O-N 3.07Å; P355-K359 VanDerWaalsContact O-N 3.14Å; F356-K359 PolarHBondContact O-N 2.87Å; N357-K359 VanDerWaalsContact C-N 3.34Å; N357-K359 PolarHBondContact O-N 2.97Å; K359-Y361 PolarHBondContact O-N 3.13Å; K359-Q362 PolarHBondContact O-N 3.12Å; K359-M363 HydrophobicContact CD-SD 4.36Å; K359-M363 HydrophobicContact CG-CG 4.33Å; K359-M363 HydrophobicContact CG-SD 3.93Å; K359-M363 WeakPolarHBondContact O-CG 3.39Å; K359-M363 PolarHBondContact O-N 3.12Å
360	F	98.8	Very high	98.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-39.6	179.3	-177.8	-107.3	0	0	0	112.6	V208 Y257 A258 L261 F275 F356 N357 M358 M363 T364 F368 W370	V208-F360 HydrophobicContact CG1-CE1 4.14Å; V208-F360 HydrophobicContact CG1-CZ 3.79Å; V208-F360 HydrophobicContact CG2-CE1 4.36Å; Y257-F360 HydrophobicContact CD2-CD1 4.43Å; Y257-F360 HydrophobicContact CD2-CE1 4.4Å; A258-F360 HydrophobicContact CB-CB 4.15Å; L261-F360 HydrophobicContact CD2-CD2 3.99Å; L261-F360 HydrophobicContact CD2-CE2 3.86Å; F275-F360 AromaticContact CD1-CE2 3.97Å; F275-F360 HydrophobicContact CD1-CE2 3.97Å; F275-F360 AromaticContact CD1-CZ 3.46Å; F275-F360 HydrophobicContact CD1-CZ 3.46Å; F275-F360 VanDerWaalsContact CD1-CZ 3.46Å; F275-F360 AromaticContact CE1-CE2 3.7Å; F275-F360 HydrophobicContact CE1-CE2 3.7Å; F275-F360 AromaticContact CE1-CZ 3.71Å; F275-F360 HydrophobicContact CE1-CZ 3.71Å; F275-F360 HydrophobicContact CG-CZ 4.1Å; F275-F360 HydrophobicContact CZ-CE2 4.33Å; F356-F360 WeakPolarHBondContact O-CB 3.2Å; F356-F360 PolarHBondContact O-N 2.79Å; N357-F360 CarbonylContact O-C 3.37Å; N357-F360 WeakPolarHBondContact O-CA 3.35Å; N357-F360 WeakPolarHBondContact O-CB 3.43Å; N357-F360 PolarHBondContact O-N 3.47Å; M358-F360 VanDerWaalsContact C-N 3.33Å; M358-F360 PolarHBondContact O-N 3.2Å; F360-M363 PolarHBondContact O-N 3.15Å; F360-T364 HydrophobicContact CD1-CG2 4.48Å; F360-T364 HydrophobicContact CD2-CG2 4.05Å; F360-T364 HydrophobicContact CE1-CG2 4.12Å; F360-T364 HydrophobicContact CE2-CG2 3.66Å; F360-T364 HydrophobicContact CG-CG2 4.44Å; F360-T364 HydrophobicContact CZ-CG2 3.7Å; F360-T364 WeakPolarHBondContact O-CB 3.39Å; F360-T364 VanDerWaalsContact O-CG2 3.32Å; F360-T364 WeakPolarHBondContact O-CG2 3.4Å; F360-T364 PolarHBondContact O-N 3.39Å; F360-T364 PolarHBondContact O-OG1 3.5Å; F360-F368 HydrophobicContact CD1-CD2 4.34Å; F360-F368 HydrophobicContact CD1-CE2 4.18Å; F360-F368 HydrophobicContact CE1-CD2 4.03Å; F360-F368 AromaticContact CE1-CE2 3.56Å; F360-F368 HydrophobicContact CE1-CE2 3.56Å; F360-F368 HydrophobicContact CE1-CZ 4.15Å; F360-F368 HydrophobicContact CZ-CE2 4.45Å; F360-W370 HydrophobicContact CD1-CH2 4.24Å; F360-W370 HydrophobicContact CD1-CZ3 4.09Å; F360-W370 HydrophobicContact CE1-CH2 4.03Å; F360-W370 HydrophobicContact CE1-CZ3 4.35Å
361	Y	98.7	Very high	97.5	Very high	12 Å²	12	51.6 Å²	51.6	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-41.6	175.9	-56.7	-23.3	0	0	0	111.9	N357 M358 K359 T364 G365 R366 F367 F368 W370 D371	N357-Y361 HydrophobicContact CB-CE1 4.43Å; N357-Y361 HydrophobicContact CB-CE2 4.18Å; N357-Y361 WeakPolarHBondContact O-CD1 3.36Å; N357-Y361 WeakPolarHBondContact O-CD2 3.22Å; N357-Y361 PolarHBondContact O-N 3.22Å; M358-Y361 PolarHBondContact O-N 3.34Å; M358-Y361 HydrophobicContact SD-CD2 3.88Å; M358-Y361 HydrophobicContact SD-CE2 4.1Å; K359-Y361 PolarHBondContact O-N 3.13Å; Y361-T364 PolarHBondContact O-N 3.34Å; Y361-T364 PolarHBondContact O-OG1 3.49Å; Y361-G365 WeakPolarHBondContact O-CA 3.41Å; Y361-G365 PolarHBondContact O-N 3.27Å; Y361-R366 WeakPolarHBondContact CA-O 3.49Å; Y361-R366 WeakPolarHBondContact CB-O 3.41Å; Y361-R366 WeakPolarHBondContact CD1-O 3.48Å; Y361-R366 PolarHBondContact O-N 3.06Å; Y361-F367 AromaticContact CD2-CD2 3.51Å; Y361-F367 HydrophobicContact CD2-CD2 3.51Å; Y361-F367 AromaticContact CD2-CE2 3.92Å; Y361-F367 HydrophobicContact CD2-CE2 3.92Å; Y361-F367 AromaticContact CE2-CD2 3.57Å; Y361-F367 HydrophobicContact CE2-CD2 3.57Å; Y361-F367 AromaticContact CE2-CE2 3.57Å; Y361-F367 HydrophobicContact CE2-CE2 3.57Å; Y361-F367 HydrophobicContact CG-CD2 4.2Å; Y361-F368 AromaticContact CD1-CD2 3.69Å; Y361-F368 HydrophobicContact CD1-CD2 3.69Å; Y361-F368 HydrophobicContact CD1-CE2 4.49Å; Y361-F368 HydrophobicContact CE1-CB 3.79Å; Y361-F368 AromaticContact CE1-CD2 3.69Å; Y361-F368 HydrophobicContact CE1-CD2 3.69Å; Y361-F368 HydrophobicContact CE1-CG 4.22Å; Y361-W370 HydrophobicContact CE1-CD2 4.42Å; Y361-W370 AromaticContact CE1-CE3 3.76Å; Y361-W370 HydrophobicContact CE1-CE3 3.76Å; Y361-W370 AromaticContact CE1-CZ3 3.81Å; Y361-W370 HydrophobicContact CE1-CZ3 3.81Å; Y361-W370 AromaticContact CZ-CE3 3.93Å; Y361-W370 WeakPolarHBondContact OH-CB 3.4Å; Y361-W370 VanDerWaalsContact OH-CE3 3.25Å; Y361-W370 PolarHBondContact OH-N 3.44Å; Y361-D371 WeakPolarHBondContact CE2-OD2 3.48Å; Y361-D371 PolarHBondContact OH-OD2 3.41Å
362	Q	98.4	Very high	96	Very high	147 Å²	147	57.6 Å²	57.6	69%	0.687	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-48.2	175.2	-71.4	170.9	-6.6	0	0	111.2	M358 K359 T364 G365	M358-Q362 WeakPolarHBondContact O-CG 3.25Å; M358-Q362 PolarHBondContact O-N 3.01Å; K359-Q362 PolarHBondContact O-N 3.12Å; Q362-T364 VanDerWaalsContact C-N 3.33Å; Q362-T364 PolarHBondContact O-N 2.93Å; Q362-G365 PolarHBondContact O-N 3.3Å
363	M	98.6	Very high	95.9	Very high	42 Å²	42	58.4 Å²	58.4	21%	0.207	30%	0.301	C	S	.	.	H	α-helix	trans	-58.7	-45.8	178.6	-69.2	170.7	82	0	0	111.5	A258 L261 D262 L265 M270 K359 F360	A258-M363 HydrophobicContact CB-SD 3.86Å; L261-M363 HydrophobicContact CB-CE 3.93Å; L261-M363 HydrophobicContact CD2-CB 3.98Å; L261-M363 HydrophobicContact CD2-CE 3.74Å; L261-M363 HydrophobicContact CD2-SD 4.22Å; L261-M363 HydrophobicContact CG-CE 3.64Å; D262-M363 WeakPolarHBondContact OD1-CE 3.38Å; L265-M363 HydrophobicContact CD1-CE 3.72Å; M270-M363 WeakPolarHBondContact CE-O 3.36Å; K359-M363 HydrophobicContact CD-SD 4.36Å; K359-M363 HydrophobicContact CG-CG 4.33Å; K359-M363 HydrophobicContact CG-SD 3.93Å; K359-M363 WeakPolarHBondContact O-CG 3.39Å; K359-M363 PolarHBondContact O-N 3.12Å; F360-M363 PolarHBondContact O-N 3.15Å
364	T	98.1	Very high	95.8	Very high	23 Å²	23	61.5 Å²	61.5	14%	0.141	32%	0.317	C	S	.	.	H	α-helix	trans	-85.9	-8.8	-174.3	60.5	0	0	0	0	114.2	L261 F275 F360 Y361 Q362 R366	L261-T364 HydrophobicContact CD2-CG2 3.93Å; F275-T364 HydrophobicContact CD1-CG2 4.22Å; F275-T364 HydrophobicContact CD2-CG2 3.47Å; F275-T364 VanDerWaalsContact CD2-CG2 3.47Å; F275-T364 HydrophobicContact CE1-CG2 4.16Å; F275-T364 HydrophobicContact CE2-CG2 3.43Å; F275-T364 VanDerWaalsContact CE2-CG2 3.43Å; F275-T364 HydrophobicContact CG-CG2 3.89Å; F275-T364 HydrophobicContact CZ-CG2 3.77Å; F360-T364 HydrophobicContact CD1-CG2 4.48Å; F360-T364 HydrophobicContact CD2-CG2 4.05Å; F360-T364 HydrophobicContact CE1-CG2 4.12Å; F360-T364 HydrophobicContact CE2-CG2 3.66Å; F360-T364 HydrophobicContact CG-CG2 4.44Å; F360-T364 HydrophobicContact CZ-CG2 3.7Å; F360-T364 WeakPolarHBondContact O-CB 3.39Å; F360-T364 VanDerWaalsContact O-CG2 3.32Å; F360-T364 WeakPolarHBondContact O-CG2 3.4Å; F360-T364 PolarHBondContact O-N 3.39Å; F360-T364 PolarHBondContact O-OG1 3.5Å; Y361-T364 PolarHBondContact O-N 3.34Å; Y361-T364 PolarHBondContact O-OG1 3.49Å; Q362-T364 VanDerWaalsContact C-N 3.33Å; Q362-T364 PolarHBondContact O-N 2.93Å; T364-R366 PolarHBondContact O-N 3.25Å; T364-R366 PolarHBondContact OG1-N 3.42Å; T364-R366 PolarHBondContact OG1-O 3.2Å
365	G	97.9	Very high	95.6	Very high	75 Å²	75	59.8 Å²	59.8	77%	0.773	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	21.3	-171.1	0	0	0	0	0	113.4	Y361 Q362	Y361-G365 WeakPolarHBondContact O-CA 3.41Å; Y361-G365 PolarHBondContact O-N 3.27Å; Q362-G365 PolarHBondContact O-N 3.3Å
366	R	96.9	Very high	95.5	Very high	51 Å²	51	58.5 Å²	58.5	19%	0.192	30%	0.303	C	S	.	.			trans	-135.3	126.3	-175.2	-175.5	174.3	-176.2	-163.4	10.3	111.4	F275 E288 Y361 T364 F368	F275-R366 PolarHBondContact O-NH1 3.5Å; E288-R366 IonicContact OE1-CZ 2.83Å; E288-R366 IonicContact OE1-NH1 3.85Å; E288-R366 IonicContact OE1-NH2 3.86Å; E288-R366 PolarHBondContact OE1-NH2 3.43Å; E288-R366 IonicContact OE2-CZ 3.37Å; E288-R366 IonicContact OE2-NH1 3.81Å; E288-R366 PolarHBondContact OE2-NH1 3.12Å; E288-R366 IonicContact OE2-NH2 3.14Å; E288-R366 PolarHBondContact OE2-NH2 3.31Å; Y361-R366 WeakPolarHBondContact CA-O 3.49Å; Y361-R366 WeakPolarHBondContact CB-O 3.41Å; Y361-R366 WeakPolarHBondContact CD1-O 3.48Å; Y361-R366 PolarHBondContact O-N 3.06Å; T364-R366 PolarHBondContact O-N 3.25Å; T364-R366 PolarHBondContact OG1-N 3.42Å; T364-R366 PolarHBondContact OG1-O 3.2Å; R366-F368 HydrophobicContact CB-CE2 3.91Å; R366-F368 HydrophobicContact CB-CZ 4.21Å; R366-F368 HydrophobicContact CG-CD2 4.3Å; R366-F368 HydrophobicContact CG-CE1 4.37Å; R366-F368 HydrophobicContact CG-CE2 3.88Å; R366-F368 HydrophobicContact CG-CZ 3.91Å; R366-F368 WeakPolarHBondContact O-CD2 3.46Å; R366-F368 WeakPolarHBondContact O-CE2 3.5Å
367	F	97.6	Very high	95.3	Very high	122 Å²	122	57.8 Å²	57.8	54%	0.535	30%	0.302	S	S	.	.			trans	-84.6	131.4	169.4	-175.2	-108.8	0	0	0	110.6	Y361	Y361-F367 AromaticContact CD2-CD2 3.51Å; Y361-F367 HydrophobicContact CD2-CD2 3.51Å; Y361-F367 AromaticContact CD2-CE2 3.92Å; Y361-F367 HydrophobicContact CD2-CE2 3.92Å; Y361-F367 AromaticContact CE2-CD2 3.57Å; Y361-F367 HydrophobicContact CE2-CD2 3.57Å; Y361-F367 AromaticContact CE2-CE2 3.57Å; Y361-F367 HydrophobicContact CE2-CE2 3.57Å; Y361-F367 HydrophobicContact CG-CD2 4.2Å
368	F	97.4	Very high	95	Very high	19 Å²	19	61.3 Å²	61.3	8%	0.083	32%	0.321	C	S	.	.			trans	-108.9	-6.2	-179.6	-66.4	-95.4	0	0	0	114.5	V208 F275 F360 Y361 R366 W370	V208-F368 HydrophobicContact CG2-CD1 3.71Å; V208-F368 HydrophobicContact CG2-CE1 3.35Å; V208-F368 HydrophobicContact CG2-CE2 4.43Å; V208-F368 HydrophobicContact CG2-CG 4.4Å; V208-F368 HydrophobicContact CG2-CZ 3.76Å; F275-F368 HydrophobicContact CB-CE1 4.41Å; F275-F368 HydrophobicContact CB-CZ 3.67Å; F360-F368 HydrophobicContact CD1-CD2 4.34Å; F360-F368 HydrophobicContact CD1-CE2 4.18Å; F360-F368 HydrophobicContact CE1-CD2 4.03Å; F360-F368 AromaticContact CE1-CE2 3.56Å; F360-F368 HydrophobicContact CE1-CE2 3.56Å; F360-F368 HydrophobicContact CE1-CZ 4.15Å; F360-F368 HydrophobicContact CZ-CE2 4.45Å; Y361-F368 AromaticContact CD1-CD2 3.69Å; Y361-F368 HydrophobicContact CD1-CD2 3.69Å; Y361-F368 HydrophobicContact CD1-CE2 4.49Å; Y361-F368 HydrophobicContact CE1-CB 3.79Å; Y361-F368 AromaticContact CE1-CD2 3.69Å; Y361-F368 HydrophobicContact CE1-CD2 3.69Å; Y361-F368 HydrophobicContact CE1-CG 4.22Å; R366-F368 HydrophobicContact CB-CE2 3.91Å; R366-F368 HydrophobicContact CB-CZ 4.21Å; R366-F368 HydrophobicContact CG-CD2 4.3Å; R366-F368 HydrophobicContact CG-CE1 4.37Å; R366-F368 HydrophobicContact CG-CE2 3.88Å; R366-F368 HydrophobicContact CG-CZ 3.91Å; R366-F368 WeakPolarHBondContact O-CD2 3.46Å; R366-F368 WeakPolarHBondContact O-CE2 3.5Å; F368-W370 HydrophobicContact CB-CD2 3.87Å; F368-W370 HydrophobicContact CB-CE3 4.31Å; F368-W370 HydrophobicContact CB-CG 4.46Å; F368-W370 HydrophobicContact CB-CH2 3.91Å; F368-W370 HydrophobicContact CB-CZ2 3.43Å; F368-W370 VanDerWaalsContact CB-CZ2 3.43Å; F368-W370 HydrophobicContact CB-CZ3 4.33Å; F368-W370 HydrophobicContact CD1-CH2 4.37Å; F368-W370 AromaticContact CD1-CZ2 3.9Å; F368-W370 HydrophobicContact CD1-CZ2 3.9Å; F368-W370 HydrophobicContact CD2-CH2 4.13Å; F368-W370 HydrophobicContact CD2-CZ2 4.36Å; F368-W370 AromaticContact CG-CH2 3.89Å; F368-W370 HydrophobicContact CG-CH2 3.89Å; F368-W370 AromaticContact CG-CZ2 3.66Å; F368-W370 HydrophobicContact CG-CZ2 3.66Å
369	G	96.2	Very high	94.8	Very high	26 Å²	26	59.6 Å²	59.6	27%	0.268	31%	0.314	S	S	.	.			trans	74.4	34.2	171.4	0	0	0	0	0	115.8	H372	G369-H372 PolarHBondContact O-CD2 3.09Å; G369-H372 VanDerWaalsContact O-CD2 3.23Å
370	W	97	Very high	94.5	Very high	8 Å²	8	57.6 Å²	57.6	3%	0.03	31%	0.31	C	S	.	.			trans	-93.2	-12.9	-179.2	-51.9	-37.8	0	0	0	114.6	V208 D210 P211 Y257 E279 R350 N357 F360 Y361 F368	V208-W370 HydrophobicContact CB-CH2 3.77Å; V208-W370 HydrophobicContact CB-CZ2 3.95Å; V208-W370 HydrophobicContact CG2-CH2 3.73Å; V208-W370 HydrophobicContact CG2-CZ2 3.71Å; D210-W370 HydrophobicContact CB-CB 4.22Å; D210-W370 HydrophobicContact CB-CG 3.89Å; P211-W370 HydrophobicContact CG-CE3 4.28Å; P211-W370 HydrophobicContact CG-CZ3 4.48Å; Y257-W370 AromaticContact CD2-CH2 3.85Å; Y257-W370 HydrophobicContact CD2-CH2 3.85Å; Y257-W370 AromaticContact CD2-CZ3 3.78Å; Y257-W370 HydrophobicContact CD2-CZ3 3.78Å; Y257-W370 AromaticContact CE2-CH2 3.64Å; Y257-W370 HydrophobicContact CE2-CH2 3.64Å; Y257-W370 HydrophobicContact CE2-CZ2 4.45Å; Y257-W370 AromaticContact CE2-CZ3 3.77Å; Y257-W370 HydrophobicContact CE2-CZ3 3.77Å; E279-W370 PolarHBondContact OE2-NE1 2.86Å; E279-W370 VanDerWaalsContact OE2-NE1 3.17Å; R350-W370 PolarHBondContact NH1-O 2.85Å; R350-W370 VanDerWaalsContact NH1-O 3.09Å; N357-W370 HydrophobicContact CB-CE3 4.49Å; F360-W370 HydrophobicContact CD1-CH2 4.24Å; F360-W370 HydrophobicContact CD1-CZ3 4.09Å; F360-W370 HydrophobicContact CE1-CH2 4.03Å; F360-W370 HydrophobicContact CE1-CZ3 4.35Å; Y361-W370 HydrophobicContact CE1-CD2 4.42Å; Y361-W370 AromaticContact CE1-CE3 3.76Å; Y361-W370 HydrophobicContact CE1-CE3 3.76Å; Y361-W370 AromaticContact CE1-CZ3 3.81Å; Y361-W370 HydrophobicContact CE1-CZ3 3.81Å; Y361-W370 AromaticContact CZ-CE3 3.93Å; Y361-W370 WeakPolarHBondContact OH-CB 3.4Å; Y361-W370 VanDerWaalsContact OH-CE3 3.25Å; Y361-W370 PolarHBondContact OH-N 3.44Å; F368-W370 HydrophobicContact CB-CD2 3.87Å; F368-W370 HydrophobicContact CB-CE3 4.31Å; F368-W370 HydrophobicContact CB-CG 4.46Å; F368-W370 HydrophobicContact CB-CH2 3.91Å; F368-W370 HydrophobicContact CB-CZ2 3.43Å; F368-W370 VanDerWaalsContact CB-CZ2 3.43Å; F368-W370 HydrophobicContact CB-CZ3 4.33Å; F368-W370 HydrophobicContact CD1-CH2 4.37Å; F368-W370 AromaticContact CD1-CZ2 3.9Å; F368-W370 HydrophobicContact CD1-CZ2 3.9Å; F368-W370 HydrophobicContact CD2-CH2 4.13Å; F368-W370 HydrophobicContact CD2-CZ2 4.36Å; F368-W370 AromaticContact CG-CH2 3.89Å; F368-W370 HydrophobicContact CG-CH2 3.89Å; F368-W370 AromaticContact CG-CZ2 3.66Å; F368-W370 HydrophobicContact CG-CZ2 3.66Å
371	D	85.5	Confident	94.1	Very high	31 Å²	31	62.4 Å²	62.4	17%	0.166	34%	0.335	C	S	.	.			trans	-102.9	29.9	-166.3	-54.9	-78.4	0	0	0	113.8	R354 N357 Y361	R354-D371 WeakPolarHBondContact CA-OD1 3.28Å; R354-D371 HydrophobicContact CG-CB 4.37Å; N357-D371 WeakPolarHBondContact CB-OD1 3.31Å; N357-D371 WeakPolarHBondContact CB-OD2 3.47Å; N357-D371 PolarHBondContact ND2-OD1 3.31Å; Y361-D371 WeakPolarHBondContact CE2-OD2 3.48Å; Y361-D371 PolarHBondContact OH-OD2 3.41Å
372	H	66.8	Low	93.7	Very high	193 Å²	193	67 Å²	67	89%	0.894	36%	0.362	S	S	*	.			trans	-84.5	0	176.3	-61.8	-61.1	0	0	0	113.3	G369	G369-H372 PolarHBondContact O-CD2 3.09Å; G369-H372 VanDerWaalsContact O-CD2 3.23Å

Retrieved 372 of 372 residues in 404.6 ms (Link to these results)

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