A0A096MXZ7_PAPAN Loading...

Uracil-DNA glycosylase

Excises uracil residues from the DNA which can arise as a result of misincorporation of dUMP residues by DNA polymerase or due to deamination of cytosine.

AlphaFold DB (F7DWJ9), UniProt , Accession A0A096MXZ7, Species PAPAN (Papio anubis, Olive baboon), Gene UNG, Length 313 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.2	Very low	42.8	Very low	238 Å²	238	164.9 Å²	164.9	100%	1.172	83%	0.833	S	S	*	*				0	149.7	0	-88.7	-172.2	-128.5	0	0	108.7
2	I	34.1	Very low	42.6	Very low	183 Å²	183	160.1 Å²	160.1	94%	0.938	83%	0.826	S	S	*	*			trans	80.4	113.1	-176.5	-45.9	161.4	0	0	0	112.3
3	G	37	Very low	42.3	Very low	67 Å²	67	157.9 Å²	157.9	69%	0.691	83%	0.828	S	S	*	*			cis	-171.4	135.3	-1.3	0	0	0	0	0	108.7
4	Q	41.9	Very low	42.2	Very low	194 Å²	194	155.1 Å²	155.1	91%	0.907	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-65.3	128.6	177.8	-74.4	169.4	-40.2	0	0	110.6
5	K	45.7	Very low	41.9	Very low	208 Å²	208	153 Å²	153	90%	0.904	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-89.4	117.7	161.9	-73.7	-176.9	177.9	179.5	0	108.1
6	T	52.4	Low	41.5	Very low	109 Å²	109	150 Å²	150	67%	0.669	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-77.1	145.9	179.9	41.8	0	0	0	0	111.6	Y8	T6-Y8 PolarHBondContact O-N 2.74Å
7	L	42.6	Very low	41	Very low	164 Å²	164	156.1 Å²	156.1	86%	0.859	84%	0.837	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	4.7	-172.6	-135	101.2	0	0	0	115.7
8	Y	40.6	Very low	40.7	Very low	201 Å²	201	158.9 Å²	158.9	79%	0.788	84%	0.84	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	0.6	-172.5	-91.2	-85.5	0	0	0	114.7	T6 F10	T6-Y8 PolarHBondContact O-N 2.74Å; Y8-F10 VanDerWaalsContact C-N 3.31Å; Y8-F10 PolarHBondContact O-N 2.79Å
9	S	43.3	Very low	40.2	Very low	99 Å²	99	163.9 Å²	163.9	69%	0.692	85%	0.846	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	1.2	179.4	67.6	0	0	0	0	115
10	F	43.5	Very low	39.7	Very low	173 Å²	173	168.4 Å²	168.4	76%	0.759	85%	0.852	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-4.3	-177	-83	-81.1	0	0	0	115	Y8	Y8-F10 VanDerWaalsContact C-N 3.31Å; Y8-F10 PolarHBondContact O-N 2.79Å
11	F	46.8	Very low	39.6	Very low	178 Å²	178	164.6 Å²	164.6	78%	0.781	85%	0.846	S	S	*	*			trans	-132.6	93.5	178.6	-66.6	-79.4	0	0	0	110.4
12	S	40.7	Very low	39.2	Very low	107 Å²	107	159.5 Å²	159.5	75%	0.748	83%	0.831	S	S	*	*			trans	-143.3	131.6	161.1	-73.8	0	0	0	0	109.3
13	P	38.7	Very low	39.2	Very low	132 Å²	132	156 Å²	156	86%	0.857	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-77.3	131.6	-176.9	29.9	-31.8	0	0	0	110.9
14	S	40	Very low	39.5	Very low	118 Å²	118	158.9 Å²	158.9	83%	0.825	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-74.3	145.2	172.4	-68	0	0	0	0	112.1
15	P	38.1	Very low	39	Very low	124 Å²	124	158 Å²	158	81%	0.805	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.8	151.8	-171.7	32.8	-34.8	0	0	0	114
16	A	34.8	Very low	38.8	Very low	105 Å²	105	154 Å²	154	87%	0.868	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.6	143.8	178.3	0	0	0	0	0	113.8
17	R	34.4	Very low	37.8	Very low	254 Å²	254	152.8 Å²	152.8	96%	0.958	82%	0.821	S	S	*	*			trans	-106.9	128.1	172.3	-145.8	173.8	-177.9	-175.2	-0.2	110.9
18	K	34.4	Very low	37.2	Very low	207 Å²	207	151.9 Å²	151.9	90%	0.9	82%	0.822	S	S	*	*			trans	-72.9	147.5	-171.9	-73.5	173.8	174.1	175.9	0	114.1
19	R	32.2	Very low	36.6	Very low	253 Å²	253	150.4 Å²	150.4	96%	0.955	83%	0.827	S	S	*	*			trans	-72.2	159.6	167.3	-76.4	175.6	164.1	178.8	-5.9	112.8
20	R	30	Very low	35.8	Very low	254 Å²	254	149 Å²	149	96%	0.958	83%	0.828	S	S	*	*			trans	-131.7	136.1	156	-113.6	-178.3	177	-173.4	-1.7	109.7
21	A	37.4	Very low	35	Very low	88 Å²	88	147.8 Å²	147.8	73%	0.727	84%	0.835	S	S	*	*			trans	-97.1	174.9	174.1	0	0	0	0	0	110.5
22	P	34.8	Very low	34	Very low	131 Å²	131	142.4 Å²	142.4	85%	0.851	83%	0.829	S	S	*	*				-147.6	161	83	35	-14.9	0	0	0	117
23	S	33.3	Very low	33.3	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	84%	0.837	S	S	*	*			trans	-86.7	-178.6	171.3	-31	0	0	0	0	111.6
24	P	43	Very low	32.7	Very low	129 Å²	129	142.3 Å²	142.3	84%	0.838	83%	0.83	S	S	*	*			cis	-143	171.2	47.5	33.6	-8.9	0	0	0	118.7
25	E	33	Very low	32.2	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	83%	0.833	S	S	*	*			trans	-65	-178	177.6	-104.2	-176.6	-170.2	0	0	116
26	P	41.6	Very low	31.7	Very low	122 Å²	122	141.9 Å²	141.9	79%	0.792	83%	0.832	S	S	*	*			cis	-141.5	177.2	29.1	34.5	-9.8	0	0	0	119.1
27	A	29.7	Very low	32.2	Very low	85 Å²	85	142.1 Å²	142.1	70%	0.702	82%	0.824	S	S	*	*			trans	-70.6	162.9	-176.3	0	0	0	0	0	116.7
28	V	30.2	Very low	31.9	Very low	144 Å²	144	137.8 Å²	137.8	87%	0.873	82%	0.815	S	S	*	*				-162	144.7	125	177.8	0	0	0	0	110.2
29	L	27.8	Very low	31.7	Very low	171 Å²	171	133.8 Å²	133.8	90%	0.895	80%	0.799	S	S	*	*			trans	-61.5	158.6	176.2	-73.4	93.6	0	0	0	115.9
30	G	27.4	Very low	31.6	Very low	69 Å²	69	127 Å²	127	71%	0.711	78%	0.782	S	S	*	*			trans	-177.1	112.3	158.3	0	0	0	0	0	114.6
31	T	26.5	Very low	31.5	Very low	148 Å²	148	124.1 Å²	124.1	91%	0.908	77%	0.771	S	S	*	*			trans	-21.3	137.8	152.2	49.4	0	0	0	0	114.7
32	G	25	Very low	31.2	Very low	64 Å²	64	127.8 Å²	127.8	66%	0.66	78%	0.778	S	S	*	*				105.7	122.8	67.2	0	0	0	0	0	110.6
33	V	26.7	Very low	31	Very low	150 Å²	150	125.8 Å²	125.8	91%	0.909	77%	0.773	S	S	*	*			trans	70.7	141.4	149.9	-157.9	0	0	0	0	119.4
34	A	26.5	Very low	30.9	Very low	87 Å²	87	125.3 Å²	125.3	72%	0.719	78%	0.776	S	S	*	*			trans	83.9	112.5	156.3	0	0	0	0	0	118.5
35	A	28.9	Very low	30.5	Very low	107 Å²	107	123.6 Å²	123.6	88%	0.884	77%	0.773	S	S	*	*			trans	-125.2	122.3	142.3	0	0	0	0	0	107.7
36	V	27.5	Very low	30.3	Very low	127 Å²	127	122.9 Å²	122.9	77%	0.77	77%	0.774	S	S	*	*			trans	-118.1	173.7	169.7	-135.6	0	0	0	0	106.5
37	P	45.2	Very low	30.2	Very low	110 Å²	110	122.5 Å²	122.5	71%	0.714	77%	0.772	S	S	*	*				-128.3	-150.5	-111.1	43.6	-23.5	0	0	0	112.9
38	E	29.7	Very low	30.6	Very low	162 Å²	162	124.3 Å²	124.3	76%	0.757	78%	0.777	S	S	*	*			trans	100.2	142.9	166.6	-61.8	-151	159.5	0	0	116.4
39	E	29.8	Very low	30.7	Very low	123 Å²	123	127.5 Å²	127.5	58%	0.575	78%	0.779	S	S	*	*			cis	-164.6	154.9	-0.8	-116.4	-170.6	154.6	0	0	103.8	R41	E39-R41 IonicContact OE1-NH2 3.09Å
40	N	29.4	Very low	31.1	Very low	110 Å²	110	129.2 Å²	129.2	59%	0.588	78%	0.779	S	S	*	*				175.4	129.6	67.2	-120.1	-18.3	0	0	0	107.8
41	R	28.7	Very low	31.5	Very low	195 Å²	195	130.3 Å²	130.3	74%	0.736	78%	0.781	S	S	*	*				81.1	118.5	100	-80.9	-178.1	-154.3	-162.8	4.7	117.6	E39	E39-R41 IonicContact OE1-NH2 3.09Å
42	D	30.4	Very low	32	Very low	164 Å²	164	129.5 Å²	129.5	88%	0.877	78%	0.778	S	S	*	*			trans	158.9	141.7	134.3	-82.1	-18	0	0	0	107.6
43	A	30.1	Very low	32.5	Very low	90 Å²	90	131.1 Å²	131.1	74%	0.744	79%	0.785	S	S	*	*			cis	-167.3	163.3	-15.3	0	0	0	0	0	106.5
44	A	32.9	Very low	33	Very low	99 Å²	99	128.1 Å²	128.1	82%	0.818	78%	0.777	S	S	*	*			trans	85.1	96.3	153.5	0	0	0	0	0	122.6
45	A	32.7	Very low	33.8	Very low	93 Å²	93	133 Å²	133	77%	0.769	79%	0.785	S	S	*	*				69.2	103.3	114.2	0	0	0	0	0	124.8
46	N	30.2	Very low	34.1	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	79%	0.788	S	S	*	*			trans	60.7	153.6	131.9	-77	-10.6	0	0	0	123.3
47	P	38.4	Very low	35	Very low	114 Å²	114	140 Å²	140	74%	0.74	79%	0.791	S	S	*	*			cis	-134.9	-173.7	22.7	44.4	-24.4	0	0	0	115.2
48	P	39.3	Very low	35	Very low	124 Å²	124	139.9 Å²	139.9	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.2	147.4	-151.1	34.8	-34	0	0	0	115.7
49	K	31	Very low	35.4	Very low	211 Å²	211	135.7 Å²	135.7	92%	0.917	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.5	124.7	167.2	-77.2	178.1	176	176.1	0	110.6
50	K	36.4	Very low	36.7	Very low	206 Å²	206	135.9 Å²	135.9	90%	0.896	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65.1	127.9	162.7	-140	175.1	-175.1	-179.7	0	108.3
51	A	36.6	Very low	38.1	Very low	92 Å²	92	135.9 Å²	135.9	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-66.7	141.9	172.8	0	0	0	0	0	110.7
52	P	36.8	Very low	39.1	Very low	131 Å²	131	132 Å²	132	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-87.9	134.4	172.8	33	-28	0	0	0	110.5
53	A	35.4	Very low	40.4	Very low	98 Å²	98	129.8 Å²	129.8	81%	0.81	80%	0.803	S	S	*	*			trans	-104.4	128	165.1	0	0	0	0	0	109.4
54	A	37.9	Very low	42.2	Very low	88 Å²	88	130.3 Å²	130.3	73%	0.727	80%	0.802	S	S	*	*			trans	68.5	108.8	153.4	0	0	0	0	0	120.8
55	Q	43	Very low	44.4	Very low	190 Å²	190	131.5 Å²	131.5	89%	0.888	80%	0.801	S	S	*	*				61.3	110.6	128.5	-64.4	177.5	-10.8	0	0	120.1
56	E	35.4	Very low	46.8	Very low	202 Å²	202	131.4 Å²	131.4	94%	0.944	79%	0.787	S	S	*	*			trans	-151.8	139.1	139.5	-109.7	173.3	-165.2	0	0	110.1
57	E	44.8	Very low	49.6	Very low	178 Å²	178	126.4 Å²	126.4	83%	0.832	77%	0.765	S	S	*	*			trans	-58.2	165.7	-177.6	-84.9	-93.1	146.3	0	0	114.8	G59	E57-G59 PolarHBondContact O-N 3.21Å
58	P	46.4	Very low	51.9	Low	107 Å²	107	125 Å²	125	70%	0.695	76%	0.762	S	S	*	*			trans	-75.4	96.7	-168	30.8	-30	0	0	0	111.9	T60	P58-T60 PolarHBondContact O-N 3.49Å
59	G	38.6	Very low	54.2	Low	75 Å²	75	126.5 Å²	126.5	77%	0.773	76%	0.759	S	S	*	*			trans	-70.6	87.5	170.5	0	0	0	0	0	112.2	E57	E57-G59 PolarHBondContact O-N 3.21Å
60	T	57.4	Low	56.9	Low	127 Å²	127	120.3 Å²	120.3	78%	0.779	73%	0.733	S	S	*	*			trans	-67.6	122.2	153.6	-17.1	0	0	0	0	107.1	P58	P58-T60 PolarHBondContact O-N 3.49Å
61	P	57.4	Low	59.4	Low	110 Å²	110	114.3 Å²	114.3	71%	0.714	71%	0.71	S	S	*	*			trans	-66.4	133.4	174.5	25.1	-30.5	0	0	0	109	S63	P61-S63 PolarHBondContact O-N 2.87Å; P61-S63 VanDerWaalsContact O-N 3.12Å
62	P	49.8	Very low	62	Low	114 Å²	114	113.1 Å²	113.1	74%	0.74	69%	0.691	S	S	*	*			trans	-68.9	113.5	170.5	28	-29.3	0	0	0	106.9	S64	P62-S64 VanDerWaalsContact C-N 3.27Å; P62-S64 PolarHBondContact O-N 3.28Å
63	S	58.5	Low	64.5	Low	116 Å²	116	113.9 Å²	113.9	81%	0.811	68%	0.677	S	S	*	*			trans	-63.6	96.9	164.2	59.3	0	0	0	0	106.9	P61	P61-S63 PolarHBondContact O-N 2.87Å; P61-S63 VanDerWaalsContact O-N 3.12Å
64	S	67.9	Low	67	Low	101 Å²	101	113.2 Å²	113.2	71%	0.706	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.7	128.2	175.1	-51.1	0	0	0	0	108.2	P62 L66	P62-S64 VanDerWaalsContact C-N 3.27Å; P62-S64 PolarHBondContact O-N 3.28Å; S64-L66 PolarHBondContact O-N 3.47Å
65	P	78.6	Confident	69.4	Low	124 Å²	124	115 Å²	115	81%	0.805	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60	138.4	178.6	22.7	-30.4	0	0	0	109.3	S67	P65-S67 PolarHBondContact O-N 2.87Å
66	L	83.6	Confident	71.6	Confident	91 Å²	91	112.9 Å²	112.9	48%	0.476	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-53.6	137	179.9	-67.7	165.6	0	0	0	110.5	S64 Q70 L71 I74	S64-L66 PolarHBondContact O-N 3.47Å; L66-Q70 HydrophobicContact CB-CB 4.38Å; L66-Q70 HydrophobicContact CD2-CB 4.31Å; L66-L71 HydrophobicContact CB-CD1 4.5Å; L66-L71 HydrophobicContact CB-CD2 3.98Å; L66-L71 HydrophobicContact CB-CG 3.86Å; L66-L71 HydrophobicContact CD1-CD2 3.75Å; L66-L71 HydrophobicContact CD1-CG 4.5Å; L66-I74 HydrophobicContact CD1-CD1 3.87Å; L66-I74 HydrophobicContact CD2-CD1 4.37Å
67	S	88.9	Confident	74.1	Confident	55 Å²	55	108.1 Å²	108.1	39%	0.385	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-64.7	155.6	173.9	81.1	0	0	0	0	110.9	P65 E69 Q70 L71	P65-S67 PolarHBondContact O-N 2.87Å; S67-E69 PolarHBondContact O-N 2.97Å; S67-Q70 WeakPolarHBondContact O-CB 3.47Å; S67-Q70 PolarHBondContact O-N 3.5Å; S67-Q70 WeakPolarHBondContact OG-CG 3.47Å; S67-Q70 PolarHBondContact OG-N 3.43Å; S67-Q70 VanDerWaalsContact OG-N 3.17Å; S67-Q70 PolarHBondContact OG-OE1 3.25Å; S67-L71 PolarHBondContact O-N 3.44Å
68	A	86.8	Confident	76.1	Confident	84 Å²	84	106.5 Å²	106.5	69%	0.694	61%	0.608	S	S	*	*	H	α-helix	trans	-55.2	-37.6	177.3	0	0	0	0	0	112.2	L71 D72	A68-L71 PolarHBondContact O-N 3.49Å; A68-D72 WeakPolarHBondContact O-CB 3.37Å; A68-D72 PolarHBondContact O-N 3.43Å
69	E	87.6	Confident	77.7	Confident	156 Å²	156	103.8 Å²	103.8	73%	0.729	59%	0.594	S	S	*	*	H	α-helix	trans	-69.5	-37.6	176.9	-167.7	177.5	-175.9	0	0	112.5	S67 D72 R73	S67-E69 PolarHBondContact O-N 2.97Å; E69-D72 PolarHBondContact O-N 3.42Å; E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 PolarHBondContact O-N 3.17Å
70	Q	87.8	Confident	79.8	Confident	81 Å²	81	101.7 Å²	101.7	38%	0.379	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-42.4	173.6	-73.3	171.7	-38.9	0	0	111.4	L66 S67 R73 I74	L66-Q70 HydrophobicContact CB-CB 4.38Å; L66-Q70 HydrophobicContact CD2-CB 4.31Å; S67-Q70 WeakPolarHBondContact O-CB 3.47Å; S67-Q70 PolarHBondContact O-N 3.5Å; S67-Q70 WeakPolarHBondContact OG-CG 3.47Å; S67-Q70 PolarHBondContact OG-N 3.43Å; S67-Q70 VanDerWaalsContact OG-N 3.17Å; S67-Q70 PolarHBondContact OG-OE1 3.25Å; Q70-R73 PolarHBondContact O-N 3.03Å; Q70-I74 WeakPolarHBondContact O-CB 3.45Å; Q70-I74 WeakPolarHBondContact O-CD1 3.48Å; Q70-I74 WeakPolarHBondContact O-CG1 3.33Å; Q70-I74 PolarHBondContact O-N 3.46Å
71	L	88.4	Confident	81	Confident	80 Å²	80	98.2 Å²	98.2	42%	0.419	55%	0.554	S	S	.	*	H	α-helix	trans	-62.5	-45.6	176	-73.2	169.6	0	0	0	111.6	L66 S67 A68 R73 I74 Q75	L66-L71 HydrophobicContact CB-CD1 4.5Å; L66-L71 HydrophobicContact CB-CD2 3.98Å; L66-L71 HydrophobicContact CB-CG 3.86Å; L66-L71 HydrophobicContact CD1-CD2 3.75Å; L66-L71 HydrophobicContact CD1-CG 4.5Å; S67-L71 PolarHBondContact O-N 3.44Å; A68-L71 PolarHBondContact O-N 3.49Å; L71-R73 PolarHBondContact O-N 2.92Å; L71-I74 PolarHBondContact O-N 3.47Å; L71-Q75 WeakPolarHBondContact O-CB 3.41Å; L71-Q75 WeakPolarHBondContact O-CG 3.31Å; L71-Q75 PolarHBondContact O-N 2.92Å
72	D	90.1	Very high	82	Confident	67 Å²	67	97.3 Å²	97.3	36%	0.358	54%	0.542	S	S	.	.	H	α-helix	trans	-62.7	-42.3	177.4	-178.2	63.4	0	0	0	111.7	A68 E69 I74 Q75 R76	A68-D72 WeakPolarHBondContact O-CB 3.37Å; A68-D72 PolarHBondContact O-N 3.43Å; E69-D72 PolarHBondContact O-N 3.42Å; D72-I74 PolarHBondContact O-N 2.95Å; D72-Q75 PolarHBondContact O-N 2.93Å; D72-R76 WeakPolarHBondContact O-CB 3.19Å; D72-R76 WeakPolarHBondContact O-CG 3.46Å; D72-R76 PolarHBondContact O-N 3.17Å; D72-R76 IonicContact OD2-CZ 3.15Å; D72-R76 IonicContact OD2-NE 2.79Å; D72-R76 PolarHBondContact OD2-NE 2.93Å; D72-R76 IonicContact OD2-NH2 2.74Å; D72-R76 PolarHBondContact OD2-NH2 3.41Å
73	R	90	Very high	83.3	Confident	148 Å²	148	97.5 Å²	97.5	56%	0.558	54%	0.537	S	S	*	.	H	α-helix	trans	-62.7	-42.2	174.4	-169.1	174.7	73.1	-172.3	4.1	112.2	E69 Q70 L71 R76 N77	E69-R73 WeakPolarHBondContact O-CB 3.44Å; E69-R73 PolarHBondContact O-N 3.17Å; Q70-R73 PolarHBondContact O-N 3.03Å; L71-R73 PolarHBondContact O-N 2.92Å; R73-R76 PolarHBondContact O-N 3.46Å; R73-N77 VanDerWaalsContact O-CB 3.31Å; R73-N77 WeakPolarHBondContact O-CB 3.45Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.46Å
74	I	88.2	Confident	84.4	Confident	83 Å²	83	100 Å²	100	43%	0.426	53%	0.528	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175.9	-71.2	164.7	0	0	0	110.3	L66 Q70 L71 D72 N77 K78	L66-I74 HydrophobicContact CD1-CD1 3.87Å; L66-I74 HydrophobicContact CD2-CD1 4.37Å; Q70-I74 WeakPolarHBondContact O-CB 3.45Å; Q70-I74 WeakPolarHBondContact O-CD1 3.48Å; Q70-I74 WeakPolarHBondContact O-CG1 3.33Å; Q70-I74 PolarHBondContact O-N 3.46Å; L71-I74 PolarHBondContact O-N 3.47Å; D72-I74 PolarHBondContact O-N 2.95Å; I74-N77 PolarHBondContact O-N 3.27Å; I74-K78 VanDerWaalsContact O-CB 3.25Å; I74-K78 WeakPolarHBondContact O-CB 3.32Å; I74-K78 PolarHBondContact O-N 2.84Å
75	Q	88.6	Confident	84.8	Confident	127 Å²	127	98.4 Å²	98.4	59%	0.593	51%	0.511	S	S	*	.	H	α-helix	trans	-62.4	-47.5	177.5	-75	178.6	-2.1	0	0	111.7	L71 D72 N77 K78 A79	L71-Q75 WeakPolarHBondContact O-CB 3.41Å; L71-Q75 WeakPolarHBondContact O-CG 3.31Å; L71-Q75 PolarHBondContact O-N 2.92Å; D72-Q75 PolarHBondContact O-N 2.93Å; Q75-N77 PolarHBondContact O-N 2.76Å; Q75-K78 PolarHBondContact O-N 3.37Å; Q75-A79 WeakPolarHBondContact O-CB 3.34Å; Q75-A79 PolarHBondContact O-N 2.93Å
76	R	87.9	Confident	84.7	Confident	145 Å²	145	92.8 Å²	92.8	55%	0.547	48%	0.475	S	S	.	.	H	α-helix	trans	-59.9	-46.1	175.8	-77.4	-172.1	-82	151.7	-6.9	112.2	D72 R73 K78 A79 A80	D72-R76 WeakPolarHBondContact O-CB 3.19Å; D72-R76 WeakPolarHBondContact O-CG 3.46Å; D72-R76 PolarHBondContact O-N 3.17Å; D72-R76 IonicContact OD2-CZ 3.15Å; D72-R76 IonicContact OD2-NE 2.79Å; D72-R76 PolarHBondContact OD2-NE 2.93Å; D72-R76 IonicContact OD2-NH2 2.74Å; D72-R76 PolarHBondContact OD2-NH2 3.41Å; R73-R76 PolarHBondContact O-N 3.46Å; R76-K78 VanDerWaalsContact C-N 3.35Å; R76-K78 PolarHBondContact O-N 3.34Å; R76-A79 PolarHBondContact O-N 2.98Å; R76-A80 WeakPolarHBondContact O-CB 3.42Å; R76-A80 PolarHBondContact O-N 2.9Å
77	N	88.7	Confident	84.5	Confident	102 Å²	102	91.7 Å²	91.7	55%	0.545	48%	0.48	S	S	.	.	H	α-helix	trans	-63.6	-41.1	177.8	-74.1	-14.3	0	0	0	111.9	R73 I74 Q75 A80 A81	R73-N77 VanDerWaalsContact O-CB 3.31Å; R73-N77 WeakPolarHBondContact O-CB 3.45Å; R73-N77 PolarHBondContact O-N 3.46Å; R73-N77 PolarHBondContact O-ND2 3.46Å; I74-N77 PolarHBondContact O-N 3.27Å; Q75-N77 PolarHBondContact O-N 2.76Å; N77-A80 PolarHBondContact O-N 3.29Å; N77-A81 WeakPolarHBondContact O-CB 2.92Å; N77-A81 PolarHBondContact O-N 3.45Å
78	K	85.8	Confident	84.1	Confident	144 Å²	144	99.3 Å²	99.3	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-45.2	175.3	-174.5	177.3	-179.5	179.2	0	111.4	I74 Q75 R76 A81 L82	I74-K78 VanDerWaalsContact O-CB 3.25Å; I74-K78 WeakPolarHBondContact O-CB 3.32Å; I74-K78 PolarHBondContact O-N 2.84Å; Q75-K78 PolarHBondContact O-N 3.37Å; R76-K78 VanDerWaalsContact C-N 3.35Å; R76-K78 PolarHBondContact O-N 3.34Å; K78-A81 PolarHBondContact O-N 2.86Å; K78-L82 HydrophobicContact CG-CD1 4.42Å; K78-L82 WeakPolarHBondContact O-CG 3.46Å; K78-L82 PolarHBondContact O-N 3.39Å
79	A	81.1	Confident	83.8	Confident	49 Å²	49	97.8 Å²	97.8	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-45.4	176.6	0	0	0	0	0	111.7	Q75 R76 A81 L82 L83	Q75-A79 WeakPolarHBondContact O-CB 3.34Å; Q75-A79 PolarHBondContact O-N 2.93Å; R76-A79 PolarHBondContact O-N 2.98Å; A79-A81 PolarHBondContact O-N 3.44Å; A79-L82 PolarHBondContact O-N 3.44Å; A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.49Å
80	A	83.1	Confident	83.7	Confident	32 Å²	32	92.2 Å²	92.2	26%	0.264	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-39.6	176.3	0	0	0	0	0	112.5	R76 N77 L83 R84	R76-A80 WeakPolarHBondContact O-CB 3.42Å; R76-A80 PolarHBondContact O-N 2.9Å; N77-A80 PolarHBondContact O-N 3.29Å; A80-L83 PolarHBondContact O-N 3.33Å; A80-R84 WeakPolarHBondContact O-CG 3.41Å; A80-R84 PolarHBondContact O-N 2.91Å; A80-R84 VanDerWaalsContact O-N 3.07Å
81	A	81.8	Confident	83.5	Confident	54 Å²	54	89.2 Å²	89.2	45%	0.446	44%	0.444	S	S	.	.	H	α-helix	trans	-64.1	-42.6	175.4	0	0	0	0	0	112	N77 K78 A79 R84 L85	N77-A81 WeakPolarHBondContact O-CB 2.92Å; N77-A81 PolarHBondContact O-N 3.45Å; K78-A81 PolarHBondContact O-N 2.86Å; A79-A81 PolarHBondContact O-N 3.44Å; A81-R84 PolarHBondContact O-N 2.98Å; A81-L85 PolarHBondContact O-N 2.87Å
82	L	78.1	Confident	83.3	Confident	91 Å²	91	91.2 Å²	91.2	48%	0.476	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-40.6	176	-72.8	172.1	0	0	0	112.2	K78 A79 L85 A86	K78-L82 HydrophobicContact CG-CD1 4.42Å; K78-L82 WeakPolarHBondContact O-CG 3.46Å; K78-L82 PolarHBondContact O-N 3.39Å; A79-L82 PolarHBondContact O-N 3.44Å; L82-L85 PolarHBondContact O-N 3.32Å; L82-A86 WeakPolarHBondContact O-CB 3.39Å; L82-A86 PolarHBondContact O-N 3.3Å
83	L	78.1	Confident	83	Confident	118 Å²	118	89.8 Å²	89.8	62%	0.618	46%	0.46	S	S	*	.	H	α-helix	trans	-61.9	-43.1	175	-75.3	171.2	0	0	0	112.1	A79 A80 A86 A87	A79-L83 WeakPolarHBondContact O-CG 3.45Å; A79-L83 PolarHBondContact O-N 3.49Å; A80-L83 PolarHBondContact O-N 3.33Å; L83-A86 PolarHBondContact O-N 3.07Å; L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.32Å
84	R	80.6	Confident	83.3	Confident	169 Å²	169	83.3 Å²	83.3	64%	0.638	44%	0.436	S	S	*	.	H	α-helix	trans	-63.5	-40.8	175.8	-71.5	177	-174.9	125.4	-1.7	112	A80 A81 A87 R88	A80-R84 WeakPolarHBondContact O-CG 3.41Å; A80-R84 PolarHBondContact O-N 2.91Å; A80-R84 VanDerWaalsContact O-N 3.07Å; A81-R84 PolarHBondContact O-N 2.98Å; R84-A87 PolarHBondContact O-N 2.92Å; R84-R88 WeakPolarHBondContact O-CG 3.36Å; R84-R88 PolarHBondContact O-N 2.89Å
85	L	78.1	Confident	83.6	Confident	66 Å²	66	80 Å²	80	35%	0.346	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-45.7	176.6	-176.1	64.8	0	0	0	111.2	A81 L82 A87 R88 N89 I112	A81-L85 PolarHBondContact O-N 2.87Å; L82-L85 PolarHBondContact O-N 3.32Å; L85-A87 VanDerWaalsContact C-N 3.34Å; L85-A87 PolarHBondContact O-N 3.19Å; L85-R88 PolarHBondContact O-N 3.21Å; L85-N89 PolarHBondContact O-N 3.03Å; L85-N89 PolarHBondContact O-ND2 3.42Å; L85-I112 HydrophobicContact CD2-CD1 4.16Å
86	A	75.9	Confident	84	Confident	6 Å²	6	80 Å²	80	5%	0.05	42%	0.423	C	S	.	.	H	α-helix	trans	-59.7	-43.7	176.4	0	0	0	0	0	111.9	L82 L83 R88 N89 V90 S103 F106	L82-A86 WeakPolarHBondContact O-CB 3.39Å; L82-A86 PolarHBondContact O-N 3.3Å; L83-A86 PolarHBondContact O-N 3.07Å; A86-R88 VanDerWaalsContact C-N 3.29Å; A86-R88 PolarHBondContact O-N 2.85Å; A86-N89 PolarHBondContact O-N 3.12Å; A86-N89 VanDerWaalsContact O-N 3.13Å; A86-V90 WeakPolarHBondContact O-CG2 3.29Å; A86-V90 PolarHBondContact O-N 3.47Å; A86-S103 VanDerWaalsContact CB-O 3.27Å; A86-S103 WeakPolarHBondContact CB-O 3.49Å; A86-F106 HydrophobicContact CB-CB 4.29Å
87	A	78.4	Confident	84.4	Confident	69 Å²	69	74.4 Å²	74.4	57%	0.57	41%	0.406	S	S	*	.	H	α-helix	trans	-61.6	-35	178.5	0	0	0	0	0	113.1	L83 R84 L85 N89 V90	L83-A87 WeakPolarHBondContact O-CB 3.39Å; L83-A87 PolarHBondContact O-N 3.32Å; R84-A87 PolarHBondContact O-N 2.92Å; L85-A87 VanDerWaalsContact C-N 3.34Å; L85-A87 PolarHBondContact O-N 3.19Å; A87-N89 VanDerWaalsContact C-N 3.32Å; A87-V90 WeakPolarHBondContact O-CG2 3.48Å
88	R	80.3	Confident	84.9	Confident	214 Å²	214	69.5 Å²	69.5	81%	0.808	38%	0.38	S	S	*	.	H	α-helix	trans	-71	-27.2	176.2	-72.7	176	177.3	-170.3	-1.6	113.4	R84 L85 A86	R84-R88 WeakPolarHBondContact O-CG 3.36Å; R84-R88 PolarHBondContact O-N 2.89Å; L85-R88 PolarHBondContact O-N 3.21Å; A86-R88 VanDerWaalsContact C-N 3.29Å; A86-R88 PolarHBondContact O-N 2.85Å
89	N	82.4	Confident	85.3	Confident	52 Å²	52	65.4 Å²	65.4	28%	0.278	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	11.7	-174.2	-64.7	-21.2	0	0	0	113.1	L85 A86 A87 P91 F106 I112	L85-N89 PolarHBondContact O-N 3.03Å; L85-N89 PolarHBondContact O-ND2 3.42Å; A86-N89 PolarHBondContact O-N 3.12Å; A86-N89 VanDerWaalsContact O-N 3.13Å; A87-N89 VanDerWaalsContact C-N 3.32Å; N89-P91 WeakPolarHBondContact O-CD 3.43Å; N89-F106 HydrophobicContact CB-CB 4.14Å; N89-F106 WeakPolarHBondContact CB-O 3.4Å; N89-F106 PolarHBondContact ND2-O 2.89Å; N89-F106 VanDerWaalsContact ND2-O 3.08Å; N89-I112 WeakPolarHBondContact ND2-CG1 3.25Å
90	V	84.6	Confident	86	Confident	40 Å²	40	70.4 Å²	70.4	24%	0.242	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-63.9	123.7	177.6	179.5	0	0	0	0	108.8	A86 A87 F94 K99 F106	A86-V90 WeakPolarHBondContact O-CG2 3.29Å; A86-V90 PolarHBondContact O-N 3.47Å; A87-V90 WeakPolarHBondContact O-CG2 3.48Å; V90-F94 HydrophobicContact CG1-CB 4.42Å; V90-K99 HydrophobicContact CG1-CD 3.79Å; V90-K99 HydrophobicContact CG1-CG 4.26Å; V90-F106 HydrophobicContact CB-CD2 4.38Å; V90-F106 HydrophobicContact CB-CE2 4.43Å; V90-F106 HydrophobicContact CG1-CE2 4.23Å; V90-F106 HydrophobicContact CG2-CD2 3.87Å; V90-F106 HydrophobicContact CG2-CE2 4.11Å
91	P	84.6	Confident	86.7	Confident	18 Å²	18	71.4 Å²	71.4	12%	0.117	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-64.4	145.5	175.8	-19.5	31.8	0	0	0	112.1	N89 F94 F106 F111 F135	N89-P91 WeakPolarHBondContact O-CD 3.43Å; P91-F94 HydrophobicContact CB-CD2 4.3Å; P91-F94 HydrophobicContact CG-CD2 4.09Å; P91-F94 WeakPolarHBondContact O-CB 3.47Å; P91-F94 PolarHBondContact O-N 3.11Å; P91-F106 HydrophobicContact CG-CE1 4.36Å; P91-F111 HydrophobicContact CG-CE1 4.18Å; P91-F111 HydrophobicContact CG-CZ 3.86Å; P91-F135 HydrophobicContact CB-CD2 3.7Å; P91-F135 HydrophobicContact CB-CE2 3.17Å; P91-F135 HydrophobicContact CB-CZ 3.78Å; P91-F135 HydrophobicContact CG-CD2 4.4Å; P91-F135 HydrophobicContact CG-CE1 4.5Å; P91-F135 HydrophobicContact CG-CE2 3.63Å; P91-F135 HydrophobicContact CG-CZ 3.66Å
92	V	83.3	Confident	87.4	Confident	122 Å²	122	69.1 Å²	69.1	74%	0.739	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	138.1	175.5	-178.7	0	0	0	0	109.9
93	G	84.6	Confident	88.1	Confident	36 Å²	36	66.3 Å²	66.3	37%	0.371	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	17.9	177.9	0	0	0	0	0	114.7	Q139	G93-Q139 WeakPolarHBondContact O-CG 3.44Å; G93-Q139 PolarHBondContact O-NE2 3.15Å
94	F	94.8	Very high	88.7	Confident	13 Å²	13	63.1 Å²	63.1	6%	0.057	34%	0.337	C	S	.	.			trans	-80.8	126.2	176.2	-150.1	-76.8	0	0	0	111	V90 P91 W98 K99 L102 F106 F135 W137 T138 F234	V90-F94 HydrophobicContact CG1-CB 4.42Å; P91-F94 HydrophobicContact CB-CD2 4.3Å; P91-F94 HydrophobicContact CG-CD2 4.09Å; P91-F94 WeakPolarHBondContact O-CB 3.47Å; P91-F94 PolarHBondContact O-N 3.11Å; F94-W98 HydrophobicContact CD1-CB 4.11Å; F94-W98 HydrophobicContact CE1-CB 3.52Å; F94-W98 HydrophobicContact CZ-CB 4.44Å; F94-K99 HydrophobicContact CD1-CB 3.75Å; F94-K99 HydrophobicContact CE1-CB 4.28Å; F94-L102 HydrophobicContact CE1-CD1 4.18Å; F94-L102 HydrophobicContact CZ-CB 4.42Å; F94-L102 HydrophobicContact CZ-CD1 3.85Å; F94-F106 HydrophobicContact CD1-CZ 4.36Å; F94-F106 HydrophobicContact CD2-CZ 4.06Å; F94-F106 HydrophobicContact CE1-CZ 4.11Å; F94-F106 HydrophobicContact CE2-CE1 4.12Å; F94-F106 AromaticContact CE2-CZ 3.83Å; F94-F106 HydrophobicContact CE2-CZ 3.83Å; F94-F106 HydrophobicContact CG-CZ 4.32Å; F94-F106 HydrophobicContact CZ-CE1 4.33Å; F94-F106 AromaticContact CZ-CZ 3.86Å; F94-F106 HydrophobicContact CZ-CZ 3.86Å; F94-F135 HydrophobicContact CD2-CB 4.02Å; F94-F135 AromaticContact CD2-CD1 3.49Å; F94-F135 HydrophobicContact CD2-CD1 3.49Å; F94-F135 VanDerWaalsContact CD2-CD1 3.49Å; F94-F135 HydrophobicContact CD2-CD2 4.05Å; F94-F135 AromaticContact CD2-CE1 3.89Å; F94-F135 HydrophobicContact CD2-CE1 3.89Å; F94-F135 HydrophobicContact CD2-CE2 4.42Å; F94-F135 AromaticContact CD2-CG 3.56Å; F94-F135 HydrophobicContact CD2-CG 3.56Å; F94-F135 HydrophobicContact CD2-CZ 4.32Å; F94-F135 HydrophobicContact CE2-CB 4.49Å; F94-F135 AromaticContact CE2-CD1 3.3Å; F94-F135 HydrophobicContact CE2-CD1 3.3Å; F94-F135 AromaticContact CE2-CE1 3.54Å; F94-F135 HydrophobicContact CE2-CE1 3.54Å; F94-F135 AromaticContact CE2-CG 3.9Å; F94-F135 HydrophobicContact CE2-CG 3.9Å; F94-F135 HydrophobicContact CE2-CZ 4.31Å; F94-F135 HydrophobicContact CZ-CD1 4.41Å; F94-W137 HydrophobicContact CZ-CH2 4.2Å; F94-T138 HydrophobicContact CD1-CG2 4.14Å; F94-T138 HydrophobicContact CE1-CG2 3.81Å; F94-T138 HydrophobicContact CE2-CG2 4.18Å; F94-T138 HydrophobicContact CG-CG2 4.49Å; F94-T138 HydrophobicContact CZ-CG2 3.82Å; F94-F234 HydrophobicContact CE2-CE1 4.45Å; F94-F234 AromaticContact CE2-CZ 3.83Å; F94-F234 HydrophobicContact CE2-CZ 3.83Å; F94-F234 AromaticContact CZ-CZ 3.89Å; F94-F234 HydrophobicContact CZ-CZ 3.89Å
95	G	96.1	Very high	89.5	Confident	14 Å²	14	56.2 Å²	56.2	14%	0.144	31%	0.312	C	S	.	.			trans	-61.9	141.5	-179.6	0	0	0	0	0	113.2	S97 W98 K99 T138	G95-S97 PolarHBondContact O-N 3.02Å; G95-W98 PolarHBondContact O-N 2.7Å; G95-K99 VanDerWaalsContact O-CB 3.27Å; G95-K99 WeakPolarHBondContact O-CB 3.33Å; G95-K99 PolarHBondContact O-N 2.99Å; G95-T138 PolarHBondContact N-OG1 3.39Å
96	E	95.6	Very high	90.2	Very high	127 Å²	127	53.1 Å²	53.1	59%	0.593	30%	0.296	S	S	*	.	H	α-helix	trans	-66.3	-40.6	-167.3	-74.7	-60.8	138.3	0	0	114.3	K99 K100	E96-K99 PolarHBondContact O-N 3.22Å; E96-K99 IonicContact OE1-NZ 3.12Å; E96-K99 PolarHBondContact OE1-NZ 3.15Å; E96-K99 IonicContact OE2-NZ 2.9Å; E96-K99 PolarHBondContact OE2-NZ 2.9Å; E96-K100 WeakPolarHBondContact O-CB 3.28Å; E96-K100 PolarHBondContact O-N 3.41Å
97	S	97.6	Very high	90.9	Very high	26 Å²	26	53.3 Å²	53.3	18%	0.182	30%	0.299	C	S	.	.	H	α-helix	trans	-68.7	-38.3	178.2	56.5	0	0	0	0	112.4	G95 H101 D142 I143	G95-S97 PolarHBondContact O-N 3.02Å; S97-H101 PolarHBondContact O-CD2 2.79Å; S97-H101 PolarHBondContact O-N 3.43Å; S97-D142 WeakPolarHBondContact CB-OD2 3.5Å; S97-D142 VanDerWaalsContact OG-CG 3.27Å; S97-D142 PolarHBondContact OG-OD2 3.27Å; S97-I143 PolarHBondContact OG-N 3.16Å
98	W	98.1	Very high	91.7	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-46.5	171.5	-62.8	85.7	0	0	0	111.5	F94 G95 K100 H101 L102 W137 T138 C141 I143 V146 L210 V238	F94-W98 HydrophobicContact CD1-CB 4.11Å; F94-W98 HydrophobicContact CE1-CB 3.52Å; F94-W98 HydrophobicContact CZ-CB 4.44Å; G95-W98 PolarHBondContact O-N 2.7Å; W98-K100 VanDerWaalsContact C-N 3.34Å; W98-K100 PolarHBondContact O-N 2.74Å; W98-H101 PolarHBondContact O-N 2.8Å; W98-H101 VanDerWaalsContact O-N 3.12Å; W98-L102 HydrophobicContact CB-CD1 4.4Å; W98-L102 HydrophobicContact CE3-CD1 4.11Å; W98-L102 WeakPolarHBondContact O-CB 2.79Å; W98-L102 WeakPolarHBondContact O-CG 3Å; W98-L102 PolarHBondContact O-N 3.3Å; W98-W137 HydrophobicContact CD2-CE3 4.46Å; W98-W137 HydrophobicContact CD2-CZ3 4.08Å; W98-W137 HydrophobicContact CE3-CE3 4.12Å; W98-W137 HydrophobicContact CE3-CH2 4.4Å; W98-W137 AromaticContact CE3-CZ3 3.44Å; W98-W137 HydrophobicContact CE3-CZ3 3.44Å; W98-W137 VanDerWaalsContact CE3-CZ3 3.44Å; W98-W137 HydrophobicContact CH2-CE3 4.28Å; W98-W137 HydrophobicContact CH2-CZ3 4.26Å; W98-W137 HydrophobicContact CZ3-CE3 4.02Å; W98-W137 AromaticContact CZ3-CZ3 3.55Å; W98-W137 HydrophobicContact CZ3-CZ3 3.55Å; W98-T138 HydrophobicContact CB-CG2 3.9Å; W98-T138 HydrophobicContact CD2-CG2 4.16Å; W98-T138 HydrophobicContact CG-CG2 3.88Å; W98-T138 PolarHBondContact NE1-O 3.24Å; W98-C141 PolarHBondContact NE1-O 3.1Å; W98-I143 HydrophobicContact CD2-CB 3.67Å; W98-I143 HydrophobicContact CD2-CD1 3.92Å; W98-I143 HydrophobicContact CD2-CG1 3.74Å; W98-I143 HydrophobicContact CE3-CB 3.99Å; W98-I143 HydrophobicContact CE3-CD1 3.39Å; W98-I143 HydrophobicContact CE3-CG1 3.49Å; W98-I143 VanDerWaalsContact CE3-CG1 3.49Å; W98-I143 HydrophobicContact CG-CB 4.05Å; W98-I143 HydrophobicContact CH2-CB 4.37Å; W98-I143 HydrophobicContact CH2-CG1 3.84Å; W98-I143 HydrophobicContact CZ2-CB 4.06Å; W98-I143 HydrophobicContact CZ2-CG1 4.05Å; W98-I143 HydrophobicContact CZ3-CB 4.33Å; W98-I143 HydrophobicContact CZ3-CD1 3.76Å; W98-I143 HydrophobicContact CZ3-CG1 3.55Å; W98-V146 HydrophobicContact CH2-CG2 3.75Å; W98-V146 HydrophobicContact CZ2-CG2 3.73Å; W98-L210 HydrophobicContact CH2-CD1 3.75Å; W98-L210 HydrophobicContact CH2-CD2 3.91Å; W98-L210 HydrophobicContact CH2-CG 4.35Å; W98-L210 HydrophobicContact CZ2-CD1 4.29Å; W98-L210 HydrophobicContact CZ3-CD1 4.47Å; W98-L210 HydrophobicContact CZ3-CD2 4.35Å; W98-V238 HydrophobicContact CZ3-CG1 3.89Å
99	K	95.6	Very high	92.4	Very high	57 Å²	57	49 Å²	49	25%	0.248	28%	0.284	C	S	.	.	H	α-helix	trans	-58.2	-45.5	179	175.2	179	162.2	-161.9	0	111.3	V90 F94 G95 E96 H101 L102 S103 F106	V90-K99 HydrophobicContact CG1-CD 3.79Å; V90-K99 HydrophobicContact CG1-CG 4.26Å; F94-K99 HydrophobicContact CD1-CB 3.75Å; F94-K99 HydrophobicContact CE1-CB 4.28Å; G95-K99 VanDerWaalsContact O-CB 3.27Å; G95-K99 WeakPolarHBondContact O-CB 3.33Å; G95-K99 PolarHBondContact O-N 2.99Å; E96-K99 PolarHBondContact O-N 3.22Å; E96-K99 IonicContact OE1-NZ 3.12Å; E96-K99 PolarHBondContact OE1-NZ 3.15Å; E96-K99 IonicContact OE2-NZ 2.9Å; E96-K99 PolarHBondContact OE2-NZ 2.9Å; K99-H101 PolarHBondContact O-N 3.28Å; K99-L102 PolarHBondContact O-N 3.38Å; K99-S103 WeakPolarHBondContact O-CA 3.34Å; K99-S103 WeakPolarHBondContact O-CB 3.44Å; K99-S103 PolarHBondContact O-N 2.84Å; K99-F106 HydrophobicContact CG-CE2 4.36Å
100	K	94.9	Very high	93.1	Very high	155 Å²	155	48 Å²	48	67%	0.674	28%	0.277	S	S	*	.	H	α-helix	trans	-54.4	-35.9	177.3	179.7	179	179.7	177.1	0	112.7	E96 W98	E96-K100 WeakPolarHBondContact O-CB 3.28Å; E96-K100 PolarHBondContact O-N 3.41Å; W98-K100 VanDerWaalsContact C-N 3.34Å; W98-K100 PolarHBondContact O-N 2.74Å
101	H	96.6	Very high	93.7	Very high	53 Å²	53	46.1 Å²	46.1	25%	0.245	27%	0.265	C	S	.	.	H	α-helix	trans	-97.1	-20.5	-174.2	-72	-54.5	0	0	0	113.9	S97 W98 K99 I143 W241	S97-H101 PolarHBondContact O-CD2 2.79Å; S97-H101 PolarHBondContact O-N 3.43Å; W98-H101 PolarHBondContact O-N 2.8Å; W98-H101 VanDerWaalsContact O-N 3.12Å; K99-H101 PolarHBondContact O-N 3.28Å; H101-I143 HydrophobicContact CB-CD1 4.22Å; H101-W241 HydrophobicContact CB-CD2 4.32Å; H101-W241 HydrophobicContact CB-CZ2 3.85Å; H101-W241 AromaticContact CD2-CZ2 3.54Å; H101-W241 AromaticContact CE1-CZ2 3.85Å; H101-W241 AromaticContact CG-CE2 3.63Å; H101-W241 AromaticContact CG-CZ2 3.35Å; H101-W241 AromaticContact CG-NE1 3.73Å; H101-W241 AromaticContact ND1-CE2 3.87Å; H101-W241 AromaticContact ND1-CZ2 3.57Å; H101-W241 AromaticContact ND1-NE1 3.71Å; H101-W241 AromaticContact NE2-CZ2 3.86Å
102	L	96.5	Very high	94.2	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-110.5	-3.4	-177.4	-60.8	172.5	0	0	0	113.8	F94 W98 K99 G104 E105 W137 F234 V238	F94-L102 HydrophobicContact CE1-CD1 4.18Å; F94-L102 HydrophobicContact CZ-CB 4.42Å; F94-L102 HydrophobicContact CZ-CD1 3.85Å; W98-L102 HydrophobicContact CB-CD1 4.4Å; W98-L102 HydrophobicContact CE3-CD1 4.11Å; W98-L102 WeakPolarHBondContact O-CB 2.79Å; W98-L102 WeakPolarHBondContact O-CG 3Å; W98-L102 PolarHBondContact O-N 3.3Å; K99-L102 PolarHBondContact O-N 3.38Å; L102-G104 PolarHBondContact O-N 3.06Å; L102-E105 WeakPolarHBondContact O-CB 3.49Å; L102-E105 PolarHBondContact O-N 3.41Å; L102-W137 HydrophobicContact CD1-CH2 4.18Å; L102-F234 HydrophobicContact CD1-CZ 4.46Å; L102-V238 HydrophobicContact CD1-CG2 3.83Å; L102-V238 HydrophobicContact CD2-CG2 4.19Å
103	S	93	Very high	94.9	Very high	33 Å²	33	50.6 Å²	50.6	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-58.1	-25.5	-177.8	59.9	0	0	0	0	113.8	A86 K99 E105 F106	A86-S103 VanDerWaalsContact CB-O 3.27Å; A86-S103 WeakPolarHBondContact CB-O 3.49Å; K99-S103 WeakPolarHBondContact O-CA 3.34Å; K99-S103 WeakPolarHBondContact O-CB 3.44Å; K99-S103 PolarHBondContact O-N 2.84Å; S103-E105 PolarHBondContact O-N 3.21Å; S103-F106 PolarHBondContact O-N 3.4Å; S103-F106 VanDerWaalsContact O-N 3.14Å
104	G	92.4	Very high	95.5	Very high	50 Å²	50	48.9 Å²	48.9	52%	0.515	26%	0.258	S	S	.	.	H	α-helix	trans	-59.3	-21.6	173.7	0	0	0	0	0	113.8	L102 K108	L102-G104 PolarHBondContact O-N 3.06Å; G104-K108 WeakPolarHBondContact O-CE 3.37Å
105	E	96.3	Very high	95.6	Very high	25 Å²	25	50.7 Å²	50.7	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-78.4	-32.3	176.2	-59.9	-50.1	118.4	0	0	112.8	L102 S103 G107 K108 Y110 F111 F234 A237	L102-E105 WeakPolarHBondContact O-CB 3.49Å; L102-E105 PolarHBondContact O-N 3.41Å; S103-E105 PolarHBondContact O-N 3.21Å; E105-G107 VanDerWaalsContact C-N 3.28Å; E105-G107 PolarHBondContact O-N 2.98Å; E105-K108 WeakPolarHBondContact O-CB 3.41Å; E105-K108 PolarHBondContact O-N 3.3Å; E105-K108 WeakPolarHBondContact OE1-CE 3.32Å; E105-K108 IonicContact OE1-NZ 2.84Å; E105-K108 PolarHBondContact OE1-NZ 3.47Å; E105-K108 WeakPolarHBondContact OE2-CD 3.28Å; E105-K108 IonicContact OE2-NZ 3.7Å; E105-K108 PolarHBondContact OE2-NZ 2.91Å; E105-Y110 WeakPolarHBondContact OE2-CE1 3.44Å; E105-Y110 PolarHBondContact OE2-OH 3.09Å; E105-F111 WeakPolarHBondContact O-CB 3.25Å; E105-F234 HydrophobicContact CB-CD2 3.86Å; E105-F234 HydrophobicContact CB-CE2 3.98Å; E105-F234 HydrophobicContact CG-CD2 4.07Å; E105-F234 HydrophobicContact CG-CE2 4.24Å; E105-A237 HydrophobicContact CG-CB 3.84Å
106	F	93.5	Very high	95.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.5	-23.4	-168.9	-54.2	-27.1	0	0	0	114.3	A86 N89 V90 P91 F94 K99 S103 F111 F234	A86-F106 HydrophobicContact CB-CB 4.29Å; N89-F106 HydrophobicContact CB-CB 4.14Å; N89-F106 WeakPolarHBondContact CB-O 3.4Å; N89-F106 PolarHBondContact ND2-O 2.89Å; N89-F106 VanDerWaalsContact ND2-O 3.08Å; V90-F106 HydrophobicContact CB-CD2 4.38Å; V90-F106 HydrophobicContact CB-CE2 4.43Å; V90-F106 HydrophobicContact CG1-CE2 4.23Å; V90-F106 HydrophobicContact CG2-CD2 3.87Å; V90-F106 HydrophobicContact CG2-CE2 4.11Å; P91-F106 HydrophobicContact CG-CE1 4.36Å; F94-F106 HydrophobicContact CD1-CZ 4.36Å; F94-F106 HydrophobicContact CD2-CZ 4.06Å; F94-F106 HydrophobicContact CE1-CZ 4.11Å; F94-F106 HydrophobicContact CE2-CE1 4.12Å; F94-F106 AromaticContact CE2-CZ 3.83Å; F94-F106 HydrophobicContact CE2-CZ 3.83Å; F94-F106 HydrophobicContact CG-CZ 4.32Å; F94-F106 HydrophobicContact CZ-CE1 4.33Å; F94-F106 AromaticContact CZ-CZ 3.86Å; F94-F106 HydrophobicContact CZ-CZ 3.86Å; K99-F106 HydrophobicContact CG-CE2 4.36Å; S103-F106 PolarHBondContact O-N 3.4Å; S103-F106 VanDerWaalsContact O-N 3.14Å; F106-F111 HydrophobicContact CB-CD1 4.31Å; F106-F111 HydrophobicContact CB-CE1 4.34Å; F106-F111 HydrophobicContact CD1-CD1 4.01Å; F106-F111 AromaticContact CD1-CE1 3.51Å; F106-F111 HydrophobicContact CD1-CE1 3.51Å; F106-F111 HydrophobicContact CD1-CE2 4.11Å; F106-F111 HydrophobicContact CD1-CG 4.49Å; F106-F111 AromaticContact CD1-CZ 3.57Å; F106-F111 HydrophobicContact CD1-CZ 3.57Å; F106-F111 HydrophobicContact CE1-CE1 4.23Å; F106-F111 HydrophobicContact CE1-CE2 4.32Å; F106-F111 AromaticContact CE1-CZ 3.85Å; F106-F111 HydrophobicContact CE1-CZ 3.85Å; F106-F111 HydrophobicContact CG-CE1 4.24Å; F106-F234 HydrophobicContact CD1-CE2 4.46Å; F106-F234 AromaticContact CE1-CE2 3.85Å; F106-F234 HydrophobicContact CE1-CE2 3.85Å; F106-F234 HydrophobicContact CE1-CZ 4.16Å
107	G	90.5	Very high	95.7	Very high	11 Å²	11	48 Å²	48	11%	0.113	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-7.1	174.5	0	0	0	0	0	114.2	E105	E105-G107 VanDerWaalsContact C-N 3.28Å; E105-G107 PolarHBondContact O-N 2.98Å
108	K	93.9	Very high	95.7	Very high	82 Å²	82	47.3 Å²	47.3	36%	0.357	26%	0.256	S	S	.	.	S	Bend	trans	-77.5	145.3	-175.4	-68.4	177.1	-178.8	175.9	0	111.1	G104 E105 Y110 F111 I112	G104-K108 WeakPolarHBondContact O-CE 3.37Å; E105-K108 WeakPolarHBondContact O-CB 3.41Å; E105-K108 PolarHBondContact O-N 3.3Å; E105-K108 WeakPolarHBondContact OE1-CE 3.32Å; E105-K108 IonicContact OE1-NZ 2.84Å; E105-K108 PolarHBondContact OE1-NZ 3.47Å; E105-K108 WeakPolarHBondContact OE2-CD 3.28Å; E105-K108 IonicContact OE2-NZ 3.7Å; E105-K108 PolarHBondContact OE2-NZ 2.91Å; K108-Y110 VanDerWaalsContact C-N 3.26Å; K108-Y110 HydrophobicContact CB-CD1 3.67Å; K108-Y110 HydrophobicContact CB-CE1 3.73Å; K108-Y110 HydrophobicContact CD-CD1 4.22Å; K108-Y110 HydrophobicContact CD-CE1 3.66Å; K108-Y110 HydrophobicContact CG-CE1 4.35Å; K108-Y110 PolarHBondContact O-N 2.9Å; K108-Y110 VanDerWaalsContact O-N 3.16Å; K108-F111 PolarHBondContact O-N 2.84Å; K108-F111 VanDerWaalsContact O-N 3.09Å; K108-I112 WeakPolarHBondContact O-CG1 3.27Å; K108-I112 PolarHBondContact O-N 3.25Å; K108-I112 VanDerWaalsContact O-N 3.17Å
109	P	95.8	Very high	95.7	Very high	110 Å²	110	49.8 Å²	49.8	71%	0.714	28%	0.277	S	S	*	.	H	α-helix	trans	-54.7	-38	-177.9	-28.3	35.1	0	0	0	114.4	F111 K113	P109-F111 PolarHBondContact O-N 3.23Å; P109-K113 WeakPolarHBondContact O-CB 3.47Å; P109-K113 PolarHBondContact O-N 2.84Å
110	Y	97.6	Very high	95.8	Very high	31 Å²	31	51 Å²	51	12%	0.122	28%	0.284	C	S	.	.	H	α-helix	trans	-64.7	-40.6	-179.7	86.6	-91.6	0	0	0	111.9	E105 K108 K113 L114 G230 Q233 F234	E105-Y110 WeakPolarHBondContact OE2-CE1 3.44Å; E105-Y110 PolarHBondContact OE2-OH 3.09Å; K108-Y110 VanDerWaalsContact C-N 3.26Å; K108-Y110 HydrophobicContact CB-CD1 3.67Å; K108-Y110 HydrophobicContact CB-CE1 3.73Å; K108-Y110 HydrophobicContact CD-CD1 4.22Å; K108-Y110 HydrophobicContact CD-CE1 3.66Å; K108-Y110 HydrophobicContact CG-CE1 4.35Å; K108-Y110 PolarHBondContact O-N 2.9Å; K108-Y110 VanDerWaalsContact O-N 3.16Å; Y110-K113 PolarHBondContact O-N 3.47Å; Y110-L114 VanDerWaalsContact O-CB 3.25Å; Y110-L114 WeakPolarHBondContact O-CB 3.27Å; Y110-L114 PolarHBondContact O-N 2.92Å; Y110-G230 WeakPolarHBondContact CE2-O 3.2Å; Y110-Q233 VanDerWaalsContact CD1-CD 3.44Å; Y110-Q233 HydrophobicContact CD1-CG 4.25Å; Y110-Q233 HydrophobicContact CD2-CB 4.05Å; Y110-Q233 HydrophobicContact CD2-CG 4.11Å; Y110-Q233 HydrophobicContact CE1-CG 3.94Å; Y110-Q233 HydrophobicContact CE2-CB 3.83Å; Y110-Q233 HydrophobicContact CE2-CG 3.84Å; Y110-Q233 HydrophobicContact CG-CG 4.32Å; Y110-F234 HydrophobicContact CE2-CB 4.06Å; Y110-F234 WeakPolarHBondContact OH-CA 3.26Å
111	F	96.7	Very high	96	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-72.5	-38.8	-177.9	-167.2	-90.9	0	0	0	111	P91 E105 F106 K108 P109 L114 M115 F234	P91-F111 HydrophobicContact CG-CE1 4.18Å; P91-F111 HydrophobicContact CG-CZ 3.86Å; E105-F111 WeakPolarHBondContact O-CB 3.25Å; F106-F111 HydrophobicContact CB-CD1 4.31Å; F106-F111 HydrophobicContact CB-CE1 4.34Å; F106-F111 HydrophobicContact CD1-CD1 4.01Å; F106-F111 AromaticContact CD1-CE1 3.51Å; F106-F111 HydrophobicContact CD1-CE1 3.51Å; F106-F111 HydrophobicContact CD1-CE2 4.11Å; F106-F111 HydrophobicContact CD1-CG 4.49Å; F106-F111 AromaticContact CD1-CZ 3.57Å; F106-F111 HydrophobicContact CD1-CZ 3.57Å; F106-F111 HydrophobicContact CE1-CE1 4.23Å; F106-F111 HydrophobicContact CE1-CE2 4.32Å; F106-F111 AromaticContact CE1-CZ 3.85Å; F106-F111 HydrophobicContact CE1-CZ 3.85Å; F106-F111 HydrophobicContact CG-CE1 4.24Å; K108-F111 PolarHBondContact O-N 2.84Å; K108-F111 VanDerWaalsContact O-N 3.09Å; P109-F111 PolarHBondContact O-N 3.23Å; F111-L114 HydrophobicContact CD2-CD2 4.23Å; F111-L114 HydrophobicContact CE2-CD2 4.44Å; F111-L114 WeakPolarHBondContact O-CB 3.49Å; F111-L114 PolarHBondContact O-N 2.93Å; F111-M115 HydrophobicContact CD1-CG 3.88Å; F111-M115 HydrophobicContact CE1-CE 4.1Å; F111-M115 HydrophobicContact CE1-CG 3.56Å; F111-M115 HydrophobicContact CE1-SD 3.91Å; F111-M115 HydrophobicContact CE2-CE 4.01Å; F111-M115 HydrophobicContact CZ-CE 3.75Å; F111-M115 HydrophobicContact CZ-CG 4.17Å; F111-M115 HydrophobicContact CZ-SD 3.94Å; F111-M115 WeakPolarHBondContact O-CG 3.37Å; F111-M115 PolarHBondContact O-N 3.47Å; F111-F234 HydrophobicContact CD2-CB 4.34Å; F111-F234 AromaticContact CD2-CD2 3.72Å; F111-F234 HydrophobicContact CD2-CD2 3.72Å; F111-F234 HydrophobicContact CD2-CE2 4.31Å; F111-F234 HydrophobicContact CD2-CG 4.12Å; F111-F234 HydrophobicContact CE2-CB 4.45Å; F111-F234 HydrophobicContact CE2-CD1 4.34Å; F111-F234 AromaticContact CE2-CD2 3.52Å; F111-F234 HydrophobicContact CE2-CD2 3.52Å; F111-F234 AromaticContact CE2-CE2 3.77Å; F111-F234 HydrophobicContact CE2-CE2 3.77Å; F111-F234 AromaticContact CE2-CG 3.84Å; F111-F234 HydrophobicContact CE2-CG 3.84Å; F111-F234 HydrophobicContact CE2-CZ 4.26Å
112	I	95	Very high	96.1	Very high	70 Å²	70	45.3 Å²	45.3	36%	0.359	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-48.2	173.9	-62.9	170.6	0	0	0	110.3	L85 N89 K108 L114 M115 G116	L85-I112 HydrophobicContact CD2-CD1 4.16Å; N89-I112 WeakPolarHBondContact ND2-CG1 3.25Å; K108-I112 WeakPolarHBondContact O-CG1 3.27Å; K108-I112 PolarHBondContact O-N 3.25Å; K108-I112 VanDerWaalsContact O-N 3.17Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.12Å; I112-M115 PolarHBondContact O-N 2.88Å; I112-G116 PolarHBondContact O-N 3.36Å
113	K	97	Very high	96.2	Very high	165 Å²	165	52 Å²	52	72%	0.717	29%	0.285	S	S	*	.	H	α-helix	trans	-60.5	-41.6	176.1	-175.9	179.2	179.3	-179.3	0	111.7	P109 Y110 G116 F117	P109-K113 WeakPolarHBondContact O-CB 3.47Å; P109-K113 PolarHBondContact O-N 2.84Å; Y110-K113 PolarHBondContact O-N 3.47Å; K113-G116 PolarHBondContact O-N 3.05Å; K113-F117 WeakPolarHBondContact O-CB 3.42Å; K113-F117 PolarHBondContact O-N 3.17Å
114	L	97.8	Very high	96.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-49	177.4	171.6	67.7	0	0	0	111.9	Y110 F111 I112 G116 F117 V118 R229 W231	Y110-L114 VanDerWaalsContact O-CB 3.25Å; Y110-L114 WeakPolarHBondContact O-CB 3.27Å; Y110-L114 PolarHBondContact O-N 2.92Å; F111-L114 HydrophobicContact CD2-CD2 4.23Å; F111-L114 HydrophobicContact CE2-CD2 4.44Å; F111-L114 WeakPolarHBondContact O-CB 3.49Å; F111-L114 PolarHBondContact O-N 2.93Å; I112-L114 VanDerWaalsContact C-N 3.31Å; I112-L114 PolarHBondContact O-N 3.12Å; L114-G116 VanDerWaalsContact C-N 3.33Å; L114-G116 PolarHBondContact O-N 3.19Å; L114-F117 WeakPolarHBondContact O-CB 3.36Å; L114-F117 PolarHBondContact O-N 2.88Å; L114-V118 HydrophobicContact CD1-CG2 4.31Å; L114-V118 WeakPolarHBondContact O-CG2 3.36Å; L114-V118 PolarHBondContact O-N 3.34Å; L114-R229 HydrophobicContact CD1-CB 4.18Å; L114-R229 WeakPolarHBondContact CD1-O 3.48Å; L114-W231 HydrophobicContact CD1-CD2 4.05Å; L114-W231 HydrophobicContact CD1-CG 3.97Å; L114-W231 HydrophobicContact CD2-CD2 3.68Å; L114-W231 HydrophobicContact CD2-CE3 3.66Å; L114-W231 HydrophobicContact CD2-CG 4.16Å; L114-W231 HydrophobicContact CD2-CH2 4.36Å; L114-W231 HydrophobicContact CD2-CZ2 4.38Å; L114-W231 HydrophobicContact CD2-CZ3 3.98Å; L114-W231 HydrophobicContact CG-CD2 4.31Å
115	M	96.3	Very high	96.7	Very high	51 Å²	51	59.2 Å²	59.2	25%	0.251	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-40.6	178	-67.1	-56.7	98.7	0	0	111.5	F111 I112 V118 A119 W231	F111-M115 HydrophobicContact CD1-CG 3.88Å; F111-M115 HydrophobicContact CE1-CE 4.1Å; F111-M115 HydrophobicContact CE1-CG 3.56Å; F111-M115 HydrophobicContact CE1-SD 3.91Å; F111-M115 HydrophobicContact CE2-CE 4.01Å; F111-M115 HydrophobicContact CZ-CE 3.75Å; F111-M115 HydrophobicContact CZ-CG 4.17Å; F111-M115 HydrophobicContact CZ-SD 3.94Å; F111-M115 WeakPolarHBondContact O-CG 3.37Å; F111-M115 PolarHBondContact O-N 3.47Å; I112-M115 PolarHBondContact O-N 2.88Å; M115-V118 PolarHBondContact O-N 3.14Å; M115-A119 VanDerWaalsContact O-CB 3.32Å; M115-A119 WeakPolarHBondContact O-CB 3.42Å; M115-A119 PolarHBondContact O-N 3.47Å; M115-W231 HydrophobicContact CE-CH2 3.44Å; M115-W231 VanDerWaalsContact CE-CH2 3.44Å; M115-W231 HydrophobicContact CE-CZ2 3.82Å; M115-W231 HydrophobicContact CE-CZ3 4.01Å
116	G	96.6	Very high	96.8	Very high	43 Å²	43	62 Å²	62	44%	0.443	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-44.8	173.4	0	0	0	0	0	112.6	I112 K113 L114 A119 E120	I112-G116 PolarHBondContact O-N 3.36Å; K113-G116 PolarHBondContact O-N 3.05Å; L114-G116 VanDerWaalsContact C-N 3.33Å; L114-G116 PolarHBondContact O-N 3.19Å; G116-A119 PolarHBondContact O-N 3.13Å; G116-E120 WeakPolarHBondContact O-CB 3.38Å; G116-E120 PolarHBondContact O-N 3.28Å
117	F	98.5	Very high	97.1	Very high	41 Å²	41	62.3 Å²	62.3	18%	0.18	32%	0.318	C	S	.	.	H	α-helix	trans	-59.1	-49	174.6	164	-98.9	0	0	0	112.1	K113 L114 A119 E120 E121 H226 R229	K113-F117 WeakPolarHBondContact O-CB 3.42Å; K113-F117 PolarHBondContact O-N 3.17Å; L114-F117 WeakPolarHBondContact O-CB 3.36Å; L114-F117 PolarHBondContact O-N 2.88Å; F117-A119 VanDerWaalsContact C-N 3.33Å; F117-A119 PolarHBondContact O-N 3.37Å; F117-E120 PolarHBondContact O-N 3.26Å; F117-E121 HydrophobicContact CD2-CG 4.19Å; F117-E121 HydrophobicContact CE1-CG 3.98Å; F117-E121 HydrophobicContact CE2-CG 3.61Å; F117-E121 HydrophobicContact CZ-CG 3.49Å; F117-E121 VanDerWaalsContact CZ-CG 3.49Å; F117-E121 WeakPolarHBondContact O-CG 3.33Å; F117-E121 PolarHBondContact O-N 2.98Å; F117-H226 HydrophobicContact CE1-CB 4.1Å; F117-H226 AromaticContact CE1-CD2 3.9Å; F117-H226 AromaticContact CE1-CG 3.7Å; F117-H226 AromaticContact CE1-ND1 3.82Å; F117-H226 AromaticContact CZ-CD2 3.75Å; F117-R229 HydrophobicContact CD1-CB 3.84Å; F117-R229 HydrophobicContact CD1-CG 3.98Å; F117-R229 HydrophobicContact CE1-CB 3.83Å; F117-R229 HydrophobicContact CE1-CG 3.54Å; F117-R229 HydrophobicContact CE2-CG 4.23Å; F117-R229 HydrophobicContact CZ-CB 4.45Å; F117-R229 HydrophobicContact CZ-CG 3.68Å
118	V	97.9	Very high	97.4	Very high	11 Å²	11	63.2 Å²	63.2	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-38.2	179.7	173.3	0	0	0	0	111.4	L114 M115 E121 R122 T217 W231	L114-V118 HydrophobicContact CD1-CG2 4.31Å; L114-V118 WeakPolarHBondContact O-CG2 3.36Å; L114-V118 PolarHBondContact O-N 3.34Å; M115-V118 PolarHBondContact O-N 3.14Å; V118-E121 PolarHBondContact O-N 3.27Å; V118-R122 VanDerWaalsContact O-CG 3.3Å; V118-R122 WeakPolarHBondContact O-CG 3.31Å; V118-R122 PolarHBondContact O-N 3.45Å; V118-T217 HydrophobicContact CG1-CG2 4.2Å; V118-T217 HydrophobicContact CG2-CG2 4.49Å; V118-W231 HydrophobicContact CG2-CZ2 4.15Å
119	A	97.3	Very high	97.6	Very high	52 Å²	52	59.3 Å²	59.3	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-63.5	-42.3	175.9	0	0	0	0	0	111.5	M115 G116 F117 R122 K123	M115-A119 VanDerWaalsContact O-CB 3.32Å; M115-A119 WeakPolarHBondContact O-CB 3.42Å; M115-A119 PolarHBondContact O-N 3.47Å; G116-A119 PolarHBondContact O-N 3.13Å; F117-A119 VanDerWaalsContact C-N 3.33Å; F117-A119 PolarHBondContact O-N 3.37Å; A119-R122 PolarHBondContact O-N 2.87Å; A119-K123 PolarHBondContact O-N 3.31Å
120	E	98.3	Very high	97.7	Very high	84 Å²	84	56.2 Å²	56.2	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-66.6	-43.5	176.4	-165.2	62.4	-164.4	0	0	112.2	G116 F117 R122 K123 H124	G116-E120 WeakPolarHBondContact O-CB 3.38Å; G116-E120 PolarHBondContact O-N 3.28Å; F117-E120 PolarHBondContact O-N 3.26Å; E120-R122 PolarHBondContact O-N 3Å; E120-K123 WeakPolarHBondContact O-CB 3.46Å; E120-K123 PolarHBondContact O-N 3.32Å; E120-K123 WeakPolarHBondContact OE2-CD 3.47Å; E120-K123 WeakPolarHBondContact OE2-CE 3.37Å; E120-K123 IonicContact OE2-NZ 3.56Å; E120-K123 PolarHBondContact OE2-NZ 3.34Å; E120-H124 PolarHBondContact O-CD2 3.41Å; E120-H124 PolarHBondContact O-N 3.21Å; E120-H124 IonicContact OE1-CD2 3.77Å; E120-H124 IonicContact OE1-NE2 3.65Å; E120-H124 PolarHBondContact OE1-NE2 3.08Å; E120-H124 VanDerWaalsContact OE1-NE2 3.12Å
121	E	98.6	Very high	97.7	Very high	19 Å²	19	58.5 Å²	58.5	9%	0.089	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-40.4	174.2	-79.4	-72.5	113.9	0	0	111.8	F117 V118 K123 H124 Y125 V127 R219 H226	F117-E121 HydrophobicContact CD2-CG 4.19Å; F117-E121 HydrophobicContact CE1-CG 3.98Å; F117-E121 HydrophobicContact CE2-CG 3.61Å; F117-E121 HydrophobicContact CZ-CG 3.49Å; F117-E121 VanDerWaalsContact CZ-CG 3.49Å; F117-E121 WeakPolarHBondContact O-CG 3.33Å; F117-E121 PolarHBondContact O-N 2.98Å; V118-E121 PolarHBondContact O-N 3.27Å; E121-K123 VanDerWaalsContact C-N 3.28Å; E121-K123 PolarHBondContact O-N 2.85Å; E121-H124 PolarHBondContact O-N 2.98Å; E121-Y125 WeakPolarHBondContact O-CA 3.31Å; E121-Y125 WeakPolarHBondContact O-CB 3.46Å; E121-Y125 PolarHBondContact O-N 2.88Å; E121-V127 HydrophobicContact CB-CG2 3.72Å; E121-R219 IonicContact OE1-CZ 3.93Å; E121-R219 IonicContact OE1-NE 3.21Å; E121-R219 IonicContact OE1-NH2 2.73Å; E121-R219 PolarHBondContact OE1-NH2 2.95Å; E121-R219 IonicContact OE2-CZ 3.73Å; E121-R219 IonicContact OE2-NE 3.95Å; E121-R219 PolarHBondContact OE2-NE 2.98Å; E121-R219 IonicContact OE2-NH2 2.7Å; E121-R219 PolarHBondContact OE2-NH2 2.95Å; E121-H226 IonicContact OE2-CD2 3.53Å; E121-H226 IonicContact OE2-NE2 2.73Å; E121-H226 PolarHBondContact OE2-NE2 3.42Å; E121-H226 VanDerWaalsContact OE2-NE2 3.09Å
122	R	98.1	Very high	97.6	Very high	69 Å²	69	64 Å²	64	26%	0.26	33%	0.326	S	S	.	.	H	α-helix	trans	-69.8	-20	178.8	-74	177.7	-171.1	-71	1.2	114.1	V118 A119 E120 V127 P129	V118-R122 VanDerWaalsContact O-CG 3.3Å; V118-R122 WeakPolarHBondContact O-CG 3.31Å; V118-R122 PolarHBondContact O-N 3.45Å; A119-R122 PolarHBondContact O-N 2.87Å; E120-R122 PolarHBondContact O-N 3Å; R122-V127 HydrophobicContact CG-CB 3.79Å; R122-V127 HydrophobicContact CG-CG1 4.45Å; R122-V127 HydrophobicContact CG-CG2 3.86Å; R122-V127 PolarHBondContact NH1-O 3.35Å; R122-P129 PolarHBondContact NH1-O 3.42Å; R122-P129 PolarHBondContact NH2-O 3.32Å
123	K	98.3	Very high	97.8	Very high	146 Å²	146	62 Å²	62	64%	0.635	32%	0.315	S	S	*	.	H	α-helix	trans	-74.9	-30.9	173.5	-66	176.7	-168.3	163.2	0	112.1	A119 E120 E121	A119-K123 PolarHBondContact O-N 3.31Å; E120-K123 WeakPolarHBondContact O-CB 3.46Å; E120-K123 PolarHBondContact O-N 3.32Å; E120-K123 WeakPolarHBondContact OE2-CD 3.47Å; E120-K123 WeakPolarHBondContact OE2-CE 3.37Å; E120-K123 IonicContact OE2-NZ 3.56Å; E120-K123 PolarHBondContact OE2-NZ 3.34Å; E121-K123 VanDerWaalsContact C-N 3.28Å; E121-K123 PolarHBondContact O-N 2.85Å
124	H	98.3	Very high	97.8	Very high	122 Å²	122	54.5 Å²	54.5	57%	0.565	28%	0.283	S	S	*	.	H	α-helix	trans	-108	-22.8	-172.3	-64.1	-57.4	0	0	0	113.9	E120 E121	E120-H124 PolarHBondContact O-CD2 3.41Å; E120-H124 PolarHBondContact O-N 3.21Å; E120-H124 IonicContact OE1-CD2 3.77Å; E120-H124 IonicContact OE1-NE2 3.65Å; E120-H124 PolarHBondContact OE1-NE2 3.08Å; E120-H124 VanDerWaalsContact OE1-NE2 3.12Å; E121-H124 PolarHBondContact O-N 2.98Å
125	Y	98.5	Very high	97.8	Very high	112 Å²	112	54.9 Å²	54.9	44%	0.439	28%	0.284	S	S	.	.	S	Bend	trans	-140.5	158.6	-172.9	-51.9	-73.7	0	0	0	111.7	E121 V127 R219	E121-Y125 WeakPolarHBondContact O-CA 3.31Å; E121-Y125 WeakPolarHBondContact O-CB 3.46Å; E121-Y125 PolarHBondContact O-N 2.88Å; Y125-V127 PolarHBondContact O-N 3.24Å; Y125-R219 HydrophobicContact CG-CG 4.06Å
126	T	98.5	Very high	98	Very high	82 Å²	82	52.8 Å²	52.8	50%	0.503	28%	0.275	S	S	.	.			trans	-73.7	124.3	163.7	-61.2	0	0	0	0	109.2	Y128 A220	T126-Y128 HydrophobicContact CG2-CD1 4.29Å; T126-Y128 HydrophobicContact CG2-CE1 3.58Å; T126-Y128 HydrophobicContact CG2-CE2 4.31Å; T126-A220 HydrophobicContact CG2-CB 4.14Å; T126-A220 WeakPolarHBondContact O-CB 3.42Å; T126-A220 PolarHBondContact O-N 2.96Å
127	V	98.7	Very high	98.1	Very high	7 Å²	7	51 Å²	51	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.7	178	176.4	0	0	0	0	109.4	E121 R122 Y125 T217 V218	E121-V127 HydrophobicContact CB-CG2 3.72Å; R122-V127 HydrophobicContact CG-CB 3.79Å; R122-V127 HydrophobicContact CG-CG1 4.45Å; R122-V127 HydrophobicContact CG-CG2 3.86Å; R122-V127 PolarHBondContact NH1-O 3.35Å; Y125-V127 PolarHBondContact O-N 3.24Å; V127-T217 HydrophobicContact CG1-CG2 4.28Å; V127-V218 CarbonylContact C-O 3.59Å; V127-V218 WeakPolarHBondContact CA-O 3.38Å
128	Y	98.6	Very high	98.1	Very high	30 Å²	30	49.2 Å²	49.2	12%	0.118	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	150.9	175.3	-57.6	-55.3	0	0	0	111.6	T126 H157 P159 T217 V218 A220	T126-Y128 HydrophobicContact CG2-CD1 4.29Å; T126-Y128 HydrophobicContact CG2-CE1 3.58Å; T126-Y128 HydrophobicContact CG2-CE2 4.31Å; Y128-H157 WeakPolarHBondContact CE2-O 3.29Å; Y128-P159 WeakPolarHBondContact OH-CA 3.38Å; Y128-T217 CarbonylContact O-C 3.44Å; Y128-T217 WeakPolarHBondContact O-CA 3.4Å; Y128-V218 PolarHBondContact N-O 3.02Å; Y128-V218 PolarHBondContact O-N 3Å; Y128-A220 HydrophobicContact CD2-CB 4.21Å; Y128-A220 HydrophobicContact CE2-CB 3.48Å; Y128-A220 VanDerWaalsContact CE2-CB 3.48Å
129	P	98.1	Very high	98.1	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	27%	0.265	C	S	.	.	S	Bend	cis	-69.4	171.8	-14	34.3	-36.9	0	0	0	111.2	R122 Q133 V134 A162 L216	R122-P129 PolarHBondContact NH1-O 3.42Å; R122-P129 PolarHBondContact NH2-O 3.32Å; P129-Q133 HydrophobicContact CB-CB 3.98Å; P129-Q133 HydrophobicContact CG-CB 4.48Å; P129-V134 HydrophobicContact CG-CB 4.39Å; P129-V134 HydrophobicContact CG-CG2 3.96Å; P129-A162 HydrophobicContact CB-CB 4.23Å; P129-A162 VanDerWaalsContact CB-O 3.28Å; P129-A162 WeakPolarHBondContact CB-O 3.43Å; P129-L216 WeakPolarHBondContact CD-O 3.47Å
130	P	97.2	Very high	98.1	Very high	45 Å²	45	52.8 Å²	52.8	29%	0.292	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-51.2	152.4	167	-26.5	34.8	0	0	0	112.5	H132 Q133 V134	P130-H132 VanDerWaalsContact C-N 3.31Å; P130-H132 PolarHBondContact O-N 2.97Å; P130-H132 VanDerWaalsContact O-N 3.17Å; P130-Q133 PolarHBondContact O-N 3.19Å; P130-V134 PolarHBondContact O-N 3.26Å
131	P	96.6	Very high	98.1	Very high	79 Å²	79	49.6 Å²	49.6	51%	0.513	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-52.7	-43	-172.7	-28.6	35.1	0	0	0	114.9	Q133 V134	P131-Q133 PolarHBondContact O-N 2.91Å; P131-V134 PolarHBondContact O-N 3.39Å
132	H	96.3	Very high	98.1	Very high	116 Å²	116	51.6 Å²	51.6	54%	0.537	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-70.4	-12.5	-178.7	64.5	-84.2	0	0	0	113.9	P130	P130-H132 VanDerWaalsContact C-N 3.31Å; P130-H132 PolarHBondContact O-N 2.97Å; P130-H132 VanDerWaalsContact O-N 3.17Å
133	Q	97.8	Very high	98.1	Very high	27 Å²	27	48.3 Å²	48.3	13%	0.126	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-107.4	-2.9	-179.5	-75.7	-178.1	-26.1	0	0	113.4	P129 P130 P131 F135 T136 G164	P129-Q133 HydrophobicContact CB-CB 3.98Å; P129-Q133 HydrophobicContact CG-CB 4.48Å; P130-Q133 PolarHBondContact O-N 3.19Å; P131-Q133 PolarHBondContact O-N 2.91Å; Q133-F135 PolarHBondContact O-N 2.83Å; Q133-T136 VanDerWaalsContact CA-OG1 3.29Å; Q133-T136 WeakPolarHBondContact CA-OG1 3.46Å; Q133-T136 PolarHBondContact O-N 2.8Å; Q133-T136 PolarHBondContact O-OG1 2.86Å; Q133-G164 WeakPolarHBondContact O-CA 3.36Å
134	V	98.2	Very high	98.1	Very high	8 Å²	8	49.7 Å²	49.7	5%	0.048	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-32.7	178.8	177.6	0	0	0	0	111.7	P129 P130 P131 W137 L216 T217 W231	P129-V134 HydrophobicContact CG-CB 4.39Å; P129-V134 HydrophobicContact CG-CG2 3.96Å; P130-V134 PolarHBondContact O-N 3.26Å; P131-V134 PolarHBondContact O-N 3.39Å; V134-W137 PolarHBondContact O-NE1 3.31Å; V134-L216 HydrophobicContact CG1-CB 4.05Å; V134-T217 HydrophobicContact CG1-CG2 4.23Å; V134-T217 HydrophobicContact CG2-CG2 4.05Å; V134-W231 HydrophobicContact CG1-CH2 3.82Å; V134-W231 HydrophobicContact CG1-CZ2 4.14Å
135	F	98.3	Very high	98.1	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.035	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	22.3	-175.2	-57.7	-76.2	0	0	0	113.7	P91 F94 Q133 W137 T138 L216 W231 F234	P91-F135 HydrophobicContact CB-CD2 3.7Å; P91-F135 HydrophobicContact CB-CE2 3.17Å; P91-F135 HydrophobicContact CB-CZ 3.78Å; P91-F135 HydrophobicContact CG-CD2 4.4Å; P91-F135 HydrophobicContact CG-CE1 4.5Å; P91-F135 HydrophobicContact CG-CE2 3.63Å; P91-F135 HydrophobicContact CG-CZ 3.66Å; F94-F135 HydrophobicContact CD2-CB 4.02Å; F94-F135 AromaticContact CD2-CD1 3.49Å; F94-F135 HydrophobicContact CD2-CD1 3.49Å; F94-F135 VanDerWaalsContact CD2-CD1 3.49Å; F94-F135 HydrophobicContact CD2-CD2 4.05Å; F94-F135 AromaticContact CD2-CE1 3.89Å; F94-F135 HydrophobicContact CD2-CE1 3.89Å; F94-F135 HydrophobicContact CD2-CE2 4.42Å; F94-F135 AromaticContact CD2-CG 3.56Å; F94-F135 HydrophobicContact CD2-CG 3.56Å; F94-F135 HydrophobicContact CD2-CZ 4.32Å; F94-F135 HydrophobicContact CE2-CB 4.49Å; F94-F135 AromaticContact CE2-CD1 3.3Å; F94-F135 HydrophobicContact CE2-CD1 3.3Å; F94-F135 AromaticContact CE2-CE1 3.54Å; F94-F135 HydrophobicContact CE2-CE1 3.54Å; F94-F135 AromaticContact CE2-CG 3.9Å; F94-F135 HydrophobicContact CE2-CG 3.9Å; F94-F135 HydrophobicContact CE2-CZ 4.31Å; F94-F135 HydrophobicContact CZ-CD1 4.41Å; Q133-F135 PolarHBondContact O-N 2.83Å; F135-W137 AromaticContact CD1-CZ2 3.75Å; F135-W137 HydrophobicContact CD1-CZ2 3.75Å; F135-W137 AromaticContact CD1-NE1 3.97Å; F135-W137 HydrophobicContact CE1-CZ2 4.33Å; F135-W137 PolarHBondContact O-N 3.12Å; F135-W137 VanDerWaalsContact O-N 3.1Å; F135-T138 HydrophobicContact CB-CG2 4.26Å; F135-T138 WeakPolarHBondContact O-CB 3.29Å; F135-T138 PolarHBondContact O-N 3.41Å; F135-T138 PolarHBondContact O-OG1 2.83Å; F135-L216 HydrophobicContact CD1-CD1 4.4Å; F135-L216 HydrophobicContact CE1-CD1 4.06Å; F135-W231 HydrophobicContact CE1-CH2 4.22Å; F135-W231 HydrophobicContact CE1-CZ3 4.03Å; F135-W231 AromaticContact CZ-CH2 3.71Å; F135-W231 HydrophobicContact CZ-CH2 3.71Å; F135-W231 AromaticContact CZ-CZ3 3.94Å; F135-W231 HydrophobicContact CZ-CZ3 3.94Å; F135-F234 AromaticContact CE1-CE1 3.89Å; F135-F234 HydrophobicContact CE1-CE1 3.89Å; F135-F234 HydrophobicContact CE1-CZ 4.32Å
136	T	98.7	Very high	98.2	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.043	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-49.8	-37.7	176.8	-54.6	0	0	0	0	112.6	Q133 T138 Q139 M140 H163 L165	Q133-T136 VanDerWaalsContact CA-OG1 3.29Å; Q133-T136 WeakPolarHBondContact CA-OG1 3.46Å; Q133-T136 PolarHBondContact O-N 2.8Å; Q133-T136 PolarHBondContact O-OG1 2.86Å; T136-T138 PolarHBondContact O-N 3.04Å; T136-T138 VanDerWaalsContact O-N 3.1Å; T136-Q139 WeakPolarHBondContact O-CB 3.37Å; T136-Q139 PolarHBondContact O-N 3.37Å; T136-M140 HydrophobicContact CG2-CE 3.29Å; T136-M140 WeakPolarHBondContact O-CG 3.36Å; T136-H163 WeakPolarHBondContact CB-O 3.45Å; T136-H163 PolarHBondContact OG1-O 3.36Å; T136-L165 HydrophobicContact CG2-CD1 4.43Å; T136-L165 HydrophobicContact CG2-CD2 4.11Å; T136-L165 HydrophobicContact CG2-CG 4.03Å
137	W	98.7	Very high	98.2	Very high	5 Å²	5	41.5 Å²	41.5	2%	0.019	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-57.9	-23	176	58.5	-91.2	0	0	0	114.4	F94 W98 L102 V134 F135 L165 L210 L212 L216 F234 V238	F94-W137 HydrophobicContact CZ-CH2 4.2Å; W98-W137 HydrophobicContact CD2-CE3 4.46Å; W98-W137 HydrophobicContact CD2-CZ3 4.08Å; W98-W137 HydrophobicContact CE3-CE3 4.12Å; W98-W137 HydrophobicContact CE3-CH2 4.4Å; W98-W137 AromaticContact CE3-CZ3 3.44Å; W98-W137 HydrophobicContact CE3-CZ3 3.44Å; W98-W137 VanDerWaalsContact CE3-CZ3 3.44Å; W98-W137 HydrophobicContact CH2-CE3 4.28Å; W98-W137 HydrophobicContact CH2-CZ3 4.26Å; W98-W137 HydrophobicContact CZ3-CE3 4.02Å; W98-W137 AromaticContact CZ3-CZ3 3.55Å; W98-W137 HydrophobicContact CZ3-CZ3 3.55Å; L102-W137 HydrophobicContact CD1-CH2 4.18Å; V134-W137 PolarHBondContact O-NE1 3.31Å; F135-W137 AromaticContact CD1-CZ2 3.75Å; F135-W137 HydrophobicContact CD1-CZ2 3.75Å; F135-W137 AromaticContact CD1-NE1 3.97Å; F135-W137 HydrophobicContact CE1-CZ2 4.33Å; F135-W137 PolarHBondContact O-N 3.12Å; F135-W137 VanDerWaalsContact O-N 3.1Å; W137-L165 HydrophobicContact CB-CD2 3.92Å; W137-L210 HydrophobicContact CB-CD1 4.07Å; W137-L210 HydrophobicContact CD2-CD1 4.43Å; W137-L210 HydrophobicContact CE3-CD1 3.78Å; W137-L212 HydrophobicContact CD2-CD1 3.87Å; W137-L212 HydrophobicContact CE3-CD1 4.21Å; W137-L212 HydrophobicContact CG-CD1 4.22Å; W137-L212 HydrophobicContact CZ2-CD1 4.23Å; W137-L212 HydrophobicContact CZ3-CD1 4.5Å; W137-L216 HydrophobicContact CZ2-CD1 4.05Å; W137-F234 HydrophobicContact CH2-CE1 4.19Å; W137-F234 HydrophobicContact CH2-CZ 4.49Å; W137-F234 AromaticContact CZ2-CE1 3.93Å; W137-F234 HydrophobicContact CZ2-CE1 3.93Å; W137-V238 HydrophobicContact CH2-CG1 4.47Å; W137-V238 HydrophobicContact CH2-CG2 3.75Å; W137-V238 HydrophobicContact CZ3-CG1 4.1Å; W137-V238 HydrophobicContact CZ3-CG2 4.2Å
138	T	98.6	Very high	98.2	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.025	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-83.7	-14.2	174.6	67.7	0	0	0	0	113.7	F94 G95 W98 F135 T136	F94-T138 HydrophobicContact CD1-CG2 4.14Å; F94-T138 HydrophobicContact CE1-CG2 3.81Å; F94-T138 HydrophobicContact CE2-CG2 4.18Å; F94-T138 HydrophobicContact CG-CG2 4.49Å; F94-T138 HydrophobicContact CZ-CG2 3.82Å; G95-T138 PolarHBondContact N-OG1 3.39Å; W98-T138 HydrophobicContact CB-CG2 3.9Å; W98-T138 HydrophobicContact CD2-CG2 4.16Å; W98-T138 HydrophobicContact CG-CG2 3.88Å; W98-T138 PolarHBondContact NE1-O 3.24Å; F135-T138 HydrophobicContact CB-CG2 4.26Å; F135-T138 WeakPolarHBondContact O-CB 3.29Å; F135-T138 PolarHBondContact O-N 3.41Å; F135-T138 PolarHBondContact O-OG1 2.83Å; T136-T138 PolarHBondContact O-N 3.04Å; T136-T138 VanDerWaalsContact O-N 3.1Å
139	Q	98.2	Very high	98.2	Very high	96 Å²	96	39.7 Å²	39.7	45%	0.449	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-14.6	-171.6	-59	171.8	-1.3	0	0	112.4	G93 T136	G93-Q139 WeakPolarHBondContact O-CG 3.44Å; G93-Q139 PolarHBondContact O-NE2 3.15Å; T136-Q139 WeakPolarHBondContact O-CB 3.37Å; T136-Q139 PolarHBondContact O-N 3.37Å
140	M	98.4	Very high	98.2	Very high	41 Å²	41	39.7 Å²	39.7	20%	0.202	20%	0.197	C	C	.	.	S	Bend	trans	-85.3	-32.9	-168.1	-66.5	-66.8	164	0	0	113.8	T136 L165 A205 K206	T136-M140 HydrophobicContact CG2-CE 3.29Å; T136-M140 WeakPolarHBondContact O-CG 3.36Å; M140-L165 HydrophobicContact CE-CD1 4.37Å; M140-L165 HydrophobicContact CG-CD2 4.3Å; M140-A205 HydrophobicContact CB-CB 3.51Å; M140-A205 HydrophobicContact CG-CB 3.58Å; M140-A205 HydrophobicContact SD-CB 4.36Å; M140-K206 WeakPolarHBondContact O-CA 3.19Å; M140-K206 HydrophobicContact SD-CG 4.43Å
141	C	97.9	Very high	98.1	Very high	18 Å²	18	37.6 Å²	37.6	12%	0.122	18%	0.183	C	C	.	.	S	Bend	trans	-152.6	163.5	176.1	56.5	0	0	0	0	110.8	W98 A205	W98-C141 PolarHBondContact NE1-O 3.1Å; C141-A205 PolarHBondContact SG-O 2.82Å
142	D	98.5	Very high	97.9	Very high	60 Å²	60	34 Å²	34	32%	0.321	16%	0.16	S	C	.	.			trans	-63.8	142.9	171	-164.9	-82.7	0	0	0	110.2	S97 R144 D145	S97-D142 WeakPolarHBondContact CB-OD2 3.5Å; S97-D142 VanDerWaalsContact OG-CG 3.27Å; S97-D142 PolarHBondContact OG-OD2 3.27Å; D142-R144 PolarHBondContact O-N 3.29Å; D142-R144 VanDerWaalsContact O-N 3.09Å; D142-R144 WeakPolarHBondContact OD1-CB 3.5Å; D142-R144 PolarHBondContact OD1-N 3.03Å; D142-D145 HydrophobicContact CB-CB 4.28Å; D142-D145 WeakPolarHBondContact CB-OD2 3.49Å; D142-D145 WeakPolarHBondContact O-CB 3.33Å; D142-D145 PolarHBondContact O-N 3.18Å
143	I	98.6	Very high	97.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-56.7	-27.9	178.1	-166.5	174.2	0	0	0	113	S97 W98 H101 V146 W241 L242	S97-I143 PolarHBondContact OG-N 3.16Å; W98-I143 HydrophobicContact CD2-CB 3.67Å; W98-I143 HydrophobicContact CD2-CD1 3.92Å; W98-I143 HydrophobicContact CD2-CG1 3.74Å; W98-I143 HydrophobicContact CE3-CB 3.99Å; W98-I143 HydrophobicContact CE3-CD1 3.39Å; W98-I143 HydrophobicContact CE3-CG1 3.49Å; W98-I143 VanDerWaalsContact CE3-CG1 3.49Å; W98-I143 HydrophobicContact CG-CB 4.05Å; W98-I143 HydrophobicContact CH2-CB 4.37Å; W98-I143 HydrophobicContact CH2-CG1 3.84Å; W98-I143 HydrophobicContact CZ2-CB 4.06Å; W98-I143 HydrophobicContact CZ2-CG1 4.05Å; W98-I143 HydrophobicContact CZ3-CB 4.33Å; W98-I143 HydrophobicContact CZ3-CD1 3.76Å; W98-I143 HydrophobicContact CZ3-CG1 3.55Å; H101-I143 HydrophobicContact CB-CD1 4.22Å; I143-V146 WeakPolarHBondContact O-CG2 3.3Å; I143-W241 HydrophobicContact CB-CZ3 4.43Å; I143-W241 HydrophobicContact CD1-CD2 3.91Å; I143-W241 HydrophobicContact CD1-CE3 3.4Å; I143-W241 VanDerWaalsContact CD1-CE3 3.4Å; I143-W241 HydrophobicContact CD1-CH2 3.91Å; I143-W241 HydrophobicContact CD1-CZ2 4.35Å; I143-W241 HydrophobicContact CD1-CZ3 3.44Å; I143-W241 VanDerWaalsContact CD1-CZ3 3.44Å; I143-W241 HydrophobicContact CG1-CE3 3.86Å; I143-W241 HydrophobicContact CG1-CH2 4.03Å; I143-W241 HydrophobicContact CG1-CZ3 3.45Å; I143-W241 VanDerWaalsContact CG1-CZ3 3.45Å; I143-W241 HydrophobicContact CG2-CH2 3.95Å; I143-W241 HydrophobicContact CG2-CZ3 4.25Å; I143-L242 HydrophobicContact CG1-CD2 4.25Å
144	R	98.1	Very high	97.1	Very high	175 Å²	175	31.9 Å²	31.9	66%	0.66	15%	0.151	S	C	*	.	G	3₁₀ helix	trans	-81.2	-16.4	176.8	-64.7	-174.3	173.5	-156.2	-5	113.8	D142 V146	D142-R144 PolarHBondContact O-N 3.29Å; D142-R144 VanDerWaalsContact O-N 3.09Å; D142-R144 WeakPolarHBondContact OD1-CB 3.5Å; D142-R144 PolarHBondContact OD1-N 3.03Å; R144-V146 VanDerWaalsContact C-N 3.3Å
145	D	98.4	Very high	97	Very high	101 Å²	101	31.8 Å²	31.8	54%	0.54	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-88	-2.4	177.9	-64.7	-25.9	0	0	0	112.4	D142 K147 G208	D142-D145 HydrophobicContact CB-CB 4.28Å; D142-D145 WeakPolarHBondContact CB-OD2 3.49Å; D142-D145 WeakPolarHBondContact O-CB 3.33Å; D142-D145 PolarHBondContact O-N 3.18Å; D145-K147 PolarHBondContact O-N 2.88Å; D145-G208 WeakPolarHBondContact O-CA 3.22Å
146	V	98.8	Very high	96.9	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.024	16%	0.158	C	C	.	.			trans	-61.1	126.8	175.1	178.5	0	0	0	0	109.8	W98 I143 R144 V149 L210 L242 L249	W98-V146 HydrophobicContact CH2-CG2 3.75Å; W98-V146 HydrophobicContact CZ2-CG2 3.73Å; I143-V146 WeakPolarHBondContact O-CG2 3.3Å; R144-V146 VanDerWaalsContact C-N 3.3Å; V146-V149 HydrophobicContact CG1-CG2 3.95Å; V146-L210 HydrophobicContact CG1-CB 3.98Å; V146-L210 HydrophobicContact CG2-CB 4.49Å; V146-L242 HydrophobicContact CB-CD2 4.17Å; V146-L242 HydrophobicContact CG1-CD2 4.26Å; V146-L242 HydrophobicContact CG2-CD2 4.37Å; V146-L249 HydrophobicContact CG1-CD2 4.45Å; V146-L249 WeakPolarHBondContact O-CD2 3.48Å
147	K	98.8	Very high	96.8	Very high	38 Å²	38	36.6 Å²	36.6	17%	0.165	17%	0.172	C	C	.	.			trans	-114.1	-38.8	177.7	-69.8	-177.2	-71.4	176.4	0	111.8	D145 Q207 G208 L249 V250 L300 K305 K306 I308	D145-K147 PolarHBondContact O-N 2.88Å; K147-Q207 WeakPolarHBondContact CE-O 3.35Å; K147-Q207 PolarHBondContact NZ-O 3.28Å; K147-Q207 VanDerWaalsContact NZ-O 3.16Å; K147-G208 PolarHBondContact N-O 3.49Å; K147-L249 WeakPolarHBondContact O-CA 3.34Å; K147-V250 PolarHBondContact O-N 2.99Å; K147-V250 VanDerWaalsContact O-N 3.1Å; K147-L300 HydrophobicContact CB-CD1 4.44Å; K147-L300 HydrophobicContact CB-CD2 3.93Å; K147-K305 HydrophobicContact CD-CB 4.46Å; K147-K305 HydrophobicContact CG-CD 4.33Å; K147-K306 PolarHBondContact NZ-O 3.17Å; K147-I308 HydrophobicContact CB-CD1 4.44Å; K147-I308 HydrophobicContact CD-CD1 4.46Å
148	V	98.9	Very high	96.7	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	143.3	-174.8	-173.8	0	0	0	0	108.9	I150 G208 V209 L210 V250 L252 T296 L300 I308 W310	V148-I150 HydrophobicContact CG1-CG1 4.36Å; V148-G208 PolarHBondContact N-O 3.38Å; V148-G208 VanDerWaalsContact N-O 3.15Å; V148-V209 HydrophobicContact CB-CB 4.49Å; V148-V209 HydrophobicContact CB-CG1 4.26Å; V148-V209 HydrophobicContact CB-CG2 4.19Å; V148-V209 HydrophobicContact CG1-CG1 4.33Å; V148-V209 HydrophobicContact CG2-CG2 4.48Å; V148-V209 CarbonylContact O-C 3.42Å; V148-V209 WeakPolarHBondContact O-CA 3.43Å; V148-L210 PolarHBondContact O-N 3.38Å; V148-V250 CarbonylContact C-O 3.58Å; V148-V250 VanDerWaalsContact CA-O 3.29Å; V148-V250 WeakPolarHBondContact CA-O 3.17Å; V148-V250 WeakPolarHBondContact CG1-O 3.5Å; V148-L252 HydrophobicContact CG1-CD1 4.22Å; V148-L252 HydrophobicContact CG1-CG 4.15Å; V148-T296 HydrophobicContact CB-CG2 4.47Å; V148-T296 HydrophobicContact CG1-CG2 4.11Å; V148-T296 HydrophobicContact CG2-CG2 3.48Å; V148-T296 VanDerWaalsContact CG2-CG2 3.48Å; V148-L300 HydrophobicContact CG2-CD1 3.91Å; V148-I308 HydrophobicContact CG2-CD1 4.2Å; V148-I308 HydrophobicContact CG2-CG1 3.82Å; V148-W310 HydrophobicContact CG1-CH2 4.38Å
149	V	98.8	Very high	96.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.6	174.7	-178.3	0	0	0	0	109	V146 L151 L210 L242 V250 F251 L252	V146-V149 HydrophobicContact CG1-CG2 3.95Å; V149-L151 HydrophobicContact CG1-CD2 3.8Å; V149-L151 HydrophobicContact CG1-CG 4.08Å; V149-L210 HydrophobicContact CG1-CD2 4.06Å; V149-L210 HydrophobicContact CG1-CG 4.42Å; V149-L210 HydrophobicContact CG2-CB 4.25Å; V149-L210 HydrophobicContact CG2-CD2 4.19Å; V149-L242 HydrophobicContact CG2-CD1 4.05Å; V149-V250 PolarHBondContact N-O 3.5Å; V149-F251 HydrophobicContact CB-CD1 3.55Å; V149-F251 HydrophobicContact CB-CE1 3.79Å; V149-F251 HydrophobicContact CB-CG 4.29Å; V149-F251 HydrophobicContact CG1-CD1 3.88Å; V149-F251 HydrophobicContact CG1-CE1 4.01Å; V149-F251 HydrophobicContact CG2-CD1 3.98Å; V149-F251 HydrophobicContact CG2-CE1 3.71Å; V149-F251 HydrophobicContact CG2-CZ 4.24Å; V149-F251 CarbonylContact O-C 3.59Å; V149-F251 WeakPolarHBondContact O-CA 3.41Å; V149-L252 PolarHBondContact O-N 3.22Å
150	I	98.8	Very high	96.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119	172.9	-51.8	-171.8	0	0	0	107.8	V148 C166 F167 V209 L210 L211 L212 L252 W254	V148-I150 HydrophobicContact CG1-CG1 4.36Å; I150-C166 PolarHBondContact O-SG 2.96Å; I150-F167 HydrophobicContact CG2-CD2 4.25Å; I150-F167 HydrophobicContact CG2-CE2 3.92Å; I150-V209 HydrophobicContact CD1-CG1 3.81Å; I150-V209 HydrophobicContact CG1-CG1 3.92Å; I150-L210 PolarHBondContact N-O 3.17Å; I150-L211 HydrophobicContact CB-CD2 4.11Å; I150-L211 HydrophobicContact CD1-CD2 3.92Å; I150-L211 HydrophobicContact CG1-CD2 4.28Å; I150-L212 PolarHBondContact O-N 3.22Å; I150-L212 VanDerWaalsContact O-N 3.08Å; I150-L252 HydrophobicContact CD1-CD1 4.05Å; I150-L252 HydrophobicContact CG1-CB 4.21Å; I150-L252 HydrophobicContact CG1-CD1 4.01Å; I150-L252 HydrophobicContact CG1-CG 4.33Å; I150-W254 HydrophobicContact CD1-CH2 3.97Å; I150-W254 HydrophobicContact CD1-CZ3 4.45Å; I150-W254 HydrophobicContact CG2-CD2 4.4Å; I150-W254 HydrophobicContact CG2-CE3 3.8Å; I150-W254 HydrophobicContact CG2-CH2 4Å; I150-W254 HydrophobicContact CG2-CZ3 3.57Å
151	L	95.1	Very high	96.4	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.9	-179.2	-66	-176.8	0	0	0	111.3	V149 L212 V239 L252 L253 A258 K261	V149-L151 HydrophobicContact CG1-CD2 3.8Å; V149-L151 HydrophobicContact CG1-CG 4.08Å; L151-L212 CarbonylContact C-O 3.53Å; L151-L212 WeakPolarHBondContact CA-O 3.32Å; L151-L212 HydrophobicContact CD2-CB 4.08Å; L151-L212 HydrophobicContact CD2-CD2 4.09Å; L151-L212 HydrophobicContact CD2-CG 4.32Å; L151-V239 HydrophobicContact CD1-CG2 4.23Å; L151-V239 HydrophobicContact CD2-CG2 4.13Å; L151-L252 PolarHBondContact N-O 2.83Å; L151-L253 HydrophobicContact CB-CD2 4.4Å; L151-L253 HydrophobicContact CD1-CD2 3.73Å; L151-L253 HydrophobicContact CG-CD2 4.21Å; L151-A258 HydrophobicContact CB-CB 3.97Å; L151-A258 WeakPolarHBondContact O-CB 3.34Å; L151-K261 HydrophobicContact CD1-CB 4.37Å; L151-K261 HydrophobicContact CD1-CD 3.91Å; L151-K261 HydrophobicContact CD1-CG 4Å
152	G	91	Very high	96.4	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	175.2	167.6	0	0	0	0	0	112.6	L212 N213 A214	G152-L212 PolarHBondContact N-O 3.27Å; G152-N213 VanDerWaalsContact CA-OD1 3.26Å; G152-N213 WeakPolarHBondContact CA-OD1 3.48Å; G152-A214 PolarHBondContact O-N 3.09Å
153	Q	88.5	Confident	96.4	Very high	65 Å²	65	38.4 Å²	38.4	30%	0.304	19%	0.189	S	C	.	.	S	Bend	trans	-90.1	-75	-178.8	-179.7	173.6	-30.3	0	0	111.2	N213 A214 V215 N224 Y257	Q153-N213 PolarHBondContact N-OD1 3.17Å; Q153-A214 PolarHBondContact O-N 3.49Å; Q153-A214 VanDerWaalsContact O-N 3.16Å; Q153-V215 PolarHBondContact O-N 3.16Å; Q153-N224 PolarHBondContact NE2-ND2 3.15Å; Q153-N224 PolarHBondContact NE2-OD1 3.21Å; Q153-Y257 HydrophobicContact CG-CD1 4.47Å; Q153-Y257 HydrophobicContact CG-CD2 4.15Å; Q153-Y257 HydrophobicContact CG-CG 4.11Å
154	D	89.3	Confident	96.4	Very high	33 Å²	33	39 Å²	39	18%	0.176	20%	0.195	C	C	.	.	S	Bend	trans	-132.6	162	178.9	65.8	-42.4	0	0	0	111.2	V215 N224	D154-V215 HydrophobicContact CB-CB 4.21Å; D154-N224 PolarHBondContact OD2-N 3.3Å
155	P	96.6	Very high	96.4	Very high	7 Å²	7	30.9 Å²	30.9	5%	0.045	17%	0.165	C	C	.	.			trans	-67.4	158	177.8	-13.5	30.4	0	0	0	110.9	H157 A162 V215 V218	P155-H157 PolarHBondContact O-N 3.18Å; P155-A162 HydrophobicContact CB-CB 3.64Å; P155-V215 VanDerWaalsContact CD-O 3.24Å; P155-V215 WeakPolarHBondContact CD-O 3.44Å; P155-V218 HydrophobicContact CB-CG1 4.08Å; P155-V218 HydrophobicContact CG-CG1 4.39Å
156	Y	96.9	Very high	96.4	Very high	43 Å²	43	26 Å²	26	17%	0.169	14%	0.139	C	C	.	.			trans	-57.3	136.6	167.7	-68.7	-58.4	0	0	0	111.4	Q161 A162 F167 V169 P176	Y156-Q161 VanDerWaalsContact CB-CB 3.4Å; Y156-Q161 HydrophobicContact CD2-CB 4.15Å; Y156-Q161 HydrophobicContact CG-CB 4.02Å; Y156-A162 WeakPolarHBondContact O-CB 3.4Å; Y156-F167 WeakPolarHBondContact CE2-O 3.39Å; Y156-F167 PolarHBondContact OH-O 3.22Å; Y156-V169 HydrophobicContact CD2-CG1 3.87Å; Y156-V169 HydrophobicContact CE2-CG1 3.94Å; Y156-P176 HydrophobicContact CD1-CB 4.39Å; Y156-P176 HydrophobicContact CD1-CG 4.34Å; Y156-P176 HydrophobicContact CD2-CG 4.14Å; Y156-P176 HydrophobicContact CE1-CB 3.66Å; Y156-P176 HydrophobicContact CE1-CG 3.88Å; Y156-P176 HydrophobicContact CE2-CB 4.27Å; Y156-P176 HydrophobicContact CE2-CG 3.65Å; Y156-P176 HydrophobicContact CG-CG 4.47Å
157	H	96.4	Very high	96.4	Very high	73 Å²	73	26.6 Å²	26.6	34%	0.338	14%	0.141	S	C	.	.			trans	-100.5	4.3	-175	61.4	70.8	0	0	0	113.5	Y128 P155 V218 H221	Y128-H157 WeakPolarHBondContact CE2-O 3.29Å; P155-H157 PolarHBondContact O-N 3.18Å; H157-V218 HydrophobicContact CB-CG1 4Å; H157-V218 HydrophobicContact CB-CG2 3.97Å; H157-H221 PolarHBondContact O-N 2.84Å
158	G	95.6	Very high	96.4	Very high	8 Å²	8	24.8 Å²	24.8	8%	0.082	13%	0.133	C	C	.	.	S	Bend	trans	-90.4	158.5	174.1	0	0	0	0	0	112.7	N160 Q161	G158-N160 PolarHBondContact O-N 3.09Å; G158-Q161 PolarHBondContact O-N 2.79Å
159	P	96.4	Very high	96.3	Very high	69 Å²	69	24.8 Å²	24.8	45%	0.448	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	136	178.5	-23.2	33.2	0	0	0	112.8	Y128 Q161	Y128-P159 WeakPolarHBondContact OH-CA 3.38Å; P159-Q161 PolarHBondContact O-N 2.93Å
160	N	95.9	Very high	96.3	Very high	128 Å²	128	28.4 Å²	28.4	68%	0.684	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	6.5	175.4	-50.6	-45	0	0	0	116	G158 V173	G158-N160 PolarHBondContact O-N 3.09Å; N160-V173 HydrophobicContact CB-CG2 3.99Å
161	Q	97.4	Very high	96.3	Very high	47 Å²	47	34.7 Å²	34.7	22%	0.22	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-59.8	-177.2	-63.7	-174.3	-55.8	0	0	111.9	Y156 G158 P159 H163 V169 V173	Y156-Q161 VanDerWaalsContact CB-CB 3.4Å; Y156-Q161 HydrophobicContact CD2-CB 4.15Å; Y156-Q161 HydrophobicContact CG-CB 4.02Å; G158-Q161 PolarHBondContact O-N 2.79Å; P159-Q161 PolarHBondContact O-N 2.93Å; Q161-H163 PolarHBondContact O-N 3.29Å; Q161-V169 HydrophobicContact CB-CG1 4Å; Q161-V169 HydrophobicContact CG-CG1 4.49Å; Q161-V169 WeakPolarHBondContact O-CG1 3.49Å; Q161-V173 HydrophobicContact CG-CG1 4.18Å
162	A	98.1	Very high	96.4	Very high	7 Å²	7	40.9 Å²	40.9	6%	0.058	21%	0.214	C	C	.	.			trans	-75.9	129.4	-175.4	0	0	0	0	0	111.6	P129 P155 Y156	P129-A162 HydrophobicContact CB-CB 4.23Å; P129-A162 VanDerWaalsContact CB-O 3.28Å; P129-A162 WeakPolarHBondContact CB-O 3.43Å; P155-A162 HydrophobicContact CB-CB 3.64Å; Y156-A162 WeakPolarHBondContact O-CB 3.4Å
163	H	98.5	Very high	96.8	Very high	2 Å²	2	42 Å²	42	1%	0.009	22%	0.22	C	C	.	.	S	Bend	trans	-132.7	18.9	176.4	76.7	113.4	0	0	0	113.4	T136 Q161 S168 Q170 D200	T136-H163 WeakPolarHBondContact CB-O 3.45Å; T136-H163 PolarHBondContact OG1-O 3.36Å; Q161-H163 PolarHBondContact O-N 3.29Å; H163-S168 PolarHBondContact CD2-O 3.33Å; H163-S168 WeakPolarHBondContact NE2-CB 3.32Å; H163-S168 PolarHBondContact NE2-OG 3.34Å; H163-Q170 HydrophobicContact CB-CG 3.81Å; H163-D200 IonicContact CE1-OD1 3.62Å
164	G	98.1	Very high	97.2	Very high	13 Å²	13	43.5 Å²	43.5	13%	0.134	24%	0.236	C	C	.	.	S	Bend	trans	95.9	-0.3	174.1	0	0	0	0	0	116.4	Q133	Q133-G164 WeakPolarHBondContact O-CA 3.36Å
165	L	98.8	Very high	97.6	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	23%	0.233	C	C	.	.	S	Bend	trans	-113	130.7	171.7	-57.3	-178.5	0	0	0	109	T136 W137 M140 S168 A205 L211	T136-L165 HydrophobicContact CG2-CD1 4.43Å; T136-L165 HydrophobicContact CG2-CD2 4.11Å; T136-L165 HydrophobicContact CG2-CG 4.03Å; W137-L165 HydrophobicContact CB-CD2 3.92Å; M140-L165 HydrophobicContact CE-CD1 4.37Å; M140-L165 HydrophobicContact CG-CD2 4.3Å; L165-S168 PolarHBondContact O-N 3.11Å; L165-A205 HydrophobicContact CD1-CB 4.14Å; L165-A205 HydrophobicContact CD2-CB 4.41Å; L165-L211 HydrophobicContact CB-CB 4Å; L165-L211 HydrophobicContact CB-CD1 4Å; L165-L211 HydrophobicContact CD1-CD1 4.23Å; L165-L211 HydrophobicContact CD2-CB 4.28Å
166	C	97.9	Very high	97.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	143.8	178.7	72.9	0	0	0	0	111.3	I150 S168 L211 N213	I150-C166 PolarHBondContact O-SG 2.96Å; C166-S168 PolarHBondContact O-N 3.44Å; C166-L211 PolarHBondContact N-O 3.38Å; C166-L211 VanDerWaalsContact N-O 3.08Å; C166-L211 WeakPolarHBondContact SG-CA 3.27Å; C166-N213 WeakPolarHBondContact CB-OD1 3.22Å
167	F	98.2	Very high	97.7	Very high	15 Å²	15	44.9 Å²	44.9	7%	0.066	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-14.3	-175.4	-54.5	-72.6	0	0	0	117.5	I150 Y156 L179 I182 L201 W254 H277 P278	I150-F167 HydrophobicContact CG2-CD2 4.25Å; I150-F167 HydrophobicContact CG2-CE2 3.92Å; Y156-F167 WeakPolarHBondContact CE2-O 3.39Å; Y156-F167 PolarHBondContact OH-O 3.22Å; F167-L179 WeakPolarHBondContact O-CD2 3.18Å; F167-I182 HydrophobicContact CB-CD1 3.88Å; F167-I182 HydrophobicContact CD1-CD1 3.81Å; F167-I182 HydrophobicContact CD2-CD1 4.14Å; F167-I182 HydrophobicContact CE1-CD1 4.4Å; F167-I182 HydrophobicContact CG-CD1 3.67Å; F167-L201 HydrophobicContact CB-CD1 4.25Å; F167-W254 HydrophobicContact CD2-CE3 4.43Å; F167-W254 HydrophobicContact CD2-CZ3 4.16Å; F167-W254 AromaticContact CE2-CE3 3.71Å; F167-W254 HydrophobicContact CE2-CE3 3.71Å; F167-W254 AromaticContact CE2-CZ3 3.89Å; F167-W254 HydrophobicContact CE2-CZ3 3.89Å; F167-W254 AromaticContact CZ-CE3 3.92Å; F167-W254 HydrophobicContact CZ-CE3 3.92Å; F167-W254 HydrophobicContact CZ-CZ3 4.42Å; F167-H277 AromaticContact CE1-CE1 3.89Å; F167-H277 AromaticContact CE1-NE2 3.5Å; F167-H277 AromaticContact CZ-NE2 3.74Å; F167-P278 HydrophobicContact CD1-CG 4.38Å; F167-P278 HydrophobicContact CE1-CG 3.74Å; F167-P278 HydrophobicContact CZ-CG 4.13Å
168	S	98.6	Very high	97.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.241	C	C	.	.			trans	-88.1	151.1	-174.1	-171	0	0	0	0	113.5	H163 L165 C166 G199 D200 L201	H163-S168 PolarHBondContact CD2-O 3.33Å; H163-S168 WeakPolarHBondContact NE2-CB 3.32Å; H163-S168 PolarHBondContact NE2-OG 3.34Å; L165-S168 PolarHBondContact O-N 3.11Å; C166-S168 PolarHBondContact O-N 3.44Å; S168-G199 WeakPolarHBondContact CA-O 3.41Å; S168-G199 PolarHBondContact OG-O 3.48Å; S168-D200 WeakPolarHBondContact OG-CA 3.5Å; S168-L201 PolarHBondContact OG-N 3.35Å
169	V	98.5	Very high	97.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.237	C	C	.	.			trans	-133.6	144.2	169.5	-60.7	0	0	0	0	110.3	Y156 Q161 V173 P176 G199 D200	Y156-V169 HydrophobicContact CD2-CG1 3.87Å; Y156-V169 HydrophobicContact CE2-CG1 3.94Å; Q161-V169 HydrophobicContact CB-CG1 4Å; Q161-V169 HydrophobicContact CG-CG1 4.49Å; Q161-V169 WeakPolarHBondContact O-CG1 3.49Å; V169-V173 HydrophobicContact CB-CB 4.08Å; V169-V173 HydrophobicContact CB-CG1 3.97Å; V169-V173 HydrophobicContact CG1-CG1 4.26Å; V169-V173 HydrophobicContact CG2-CB 4.14Å; V169-V173 HydrophobicContact CG2-CG1 4.1Å; V169-V173 WeakPolarHBondContact CG2-O 3.25Å; V169-P176 HydrophobicContact CG1-CG 3.59Å; V169-G199 PolarHBondContact N-O 3.49Å; V169-G199 CarbonylContact O-C 3.42Å; V169-D200 VanDerWaalsContact O-CA 3.23Å; V169-D200 WeakPolarHBondContact O-CA 3.41Å; V169-D200 PolarHBondContact O-N 2.6Å
170	Q	98.4	Very high	97.9	Very high	77 Å²	77	41.3 Å²	41.3	36%	0.36	23%	0.229	S	C	.	.			trans	-78.4	153.5	177.8	-63.9	-174.3	-64.3	0	0	111.5	H163 V173	H163-Q170 HydrophobicContact CB-CG 3.81Å; Q170-V173 VanDerWaalsContact O-CB 3.22Å; Q170-V173 WeakPolarHBondContact O-CB 3.5Å; Q170-V173 WeakPolarHBondContact O-CG2 3.24Å; Q170-V173 PolarHBondContact O-N 3.1Å
171	R	97.9	Very high	98	Very high	133 Å²	133	35.7 Å²	35.7	50%	0.502	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	143.5	170.8	-64.8	176	-172.1	82.5	-12.5	109.8	H198 D200	R171-H198 HydrophobicContact CG-CB 3.73Å; R171-H198 VanDerWaalsContact CZ-CG 3.47Å; R171-H198 PolarHBondContact NH2-CD2 2.86Å; R171-H198 PolarHBondContact NH2-CE1 2.91Å; R171-H198 PolarHBondContact NH2-ND1 3.47Å; R171-H198 PolarHBondContact NH2-NE2 2.87Å; R171-D200 IonicContact NH1-OD2 2.99Å; R171-D200 PolarHBondContact NH1-OD2 2.91Å
172	P	97.9	Very high	98.1	Very high	130 Å²	130	33.5 Å²	33.5	84%	0.844	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	cis	-93.5	18.5	3.6	38.3	-36.6	0	0	0	113.9
173	V	98	Very high	98.1	Very high	27 Å²	27	33.4 Å²	33.4	16%	0.164	19%	0.187	C	C	.	.	S	Bend	trans	-65.4	130.7	-174.4	-177.9	0	0	0	0	110.1	N160 Q161 V169 Q170	N160-V173 HydrophobicContact CB-CG2 3.99Å; Q161-V173 HydrophobicContact CG-CG1 4.18Å; V169-V173 HydrophobicContact CB-CB 4.08Å; V169-V173 HydrophobicContact CB-CG1 3.97Å; V169-V173 HydrophobicContact CG1-CG1 4.26Å; V169-V173 HydrophobicContact CG2-CB 4.14Å; V169-V173 HydrophobicContact CG2-CG1 4.1Å; V169-V173 WeakPolarHBondContact CG2-O 3.25Å; Q170-V173 VanDerWaalsContact O-CB 3.22Å; Q170-V173 WeakPolarHBondContact O-CB 3.5Å; Q170-V173 WeakPolarHBondContact O-CG2 3.24Å; Q170-V173 PolarHBondContact O-N 3.1Å
174	P	97.9	Very high	98.1	Very high	97 Å²	97	38.5 Å²	38.5	63%	0.63	21%	0.209	S	C	*	.	P	Polyproline II helix	trans	-65.8	144.9	178.3	26.9	-34.6	0	0	0	110.7	P176	P174-P176 WeakPolarHBondContact O-CD 3.49Å
175	P	98.3	Very high	98.2	Very high	19 Å²	19	38 Å²	38	12%	0.123	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-53.1	129	174.3	-24.2	33.6	0	0	0	111.4	L179 E180 Y183	P175-L179 HydrophobicContact CB-CB 4.2Å; P175-L179 HydrophobicContact CB-CD2 3.95Å; P175-L179 HydrophobicContact CB-CG 4.08Å; P175-E180 HydrophobicContact CB-CG 4.05Å; P175-E180 WeakPolarHBondContact CB-OE1 3.48Å; P175-Y183 HydrophobicContact CB-CE2 4.3Å; P175-Y183 HydrophobicContact CG-CE2 4.13Å
176	P	96.8	Very high	98.2	Very high	8 Å²	8	37.8 Å²	37.8	5%	0.052	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-68.4	163.6	175	-24.8	38.1	0	0	0	111.6	Y156 V169 P174 S178 L179 E180	Y156-P176 HydrophobicContact CD1-CB 4.39Å; Y156-P176 HydrophobicContact CD1-CG 4.34Å; Y156-P176 HydrophobicContact CD2-CG 4.14Å; Y156-P176 HydrophobicContact CE1-CB 3.66Å; Y156-P176 HydrophobicContact CE1-CG 3.88Å; Y156-P176 HydrophobicContact CE2-CB 4.27Å; Y156-P176 HydrophobicContact CE2-CG 3.65Å; Y156-P176 HydrophobicContact CG-CG 4.47Å; V169-P176 HydrophobicContact CG1-CG 3.59Å; P174-P176 WeakPolarHBondContact O-CD 3.49Å; P176-S178 VanDerWaalsContact C-N 3.25Å; P176-S178 PolarHBondContact O-N 2.85Å; P176-L179 WeakPolarHBondContact O-CA 3.21Å; P176-L179 WeakPolarHBondContact O-CB 3.49Å; P176-L179 PolarHBondContact O-N 3.1Å; P176-E180 PolarHBondContact O-N 2.66Å
177	P	97.4	Very high	98.2	Very high	84 Å²	84	40.8 Å²	40.8	55%	0.545	22%	0.223	S	C	.	.	H	α-helix	trans	-54.9	-34.6	-173.3	-29.1	35.4	0	0	0	115.4	N181 P280	P177-N181 PolarHBondContact O-N 3.17Å; P177-N181 VanDerWaalsContact O-N 3.17Å; P177-N181 PolarHBondContact O-ND2 2.59Å; P177-P280 HydrophobicContact CB-CG 3.63Å
178	S	96.7	Very high	98.2	Very high	16 Å²	16	44.8 Å²	44.8	11%	0.112	25%	0.249	C	C	.	.	H	α-helix	trans	-66.9	-37.5	175.3	-56.9	0	0	0	0	112.4	P176 N181 I182	P176-S178 VanDerWaalsContact C-N 3.25Å; P176-S178 PolarHBondContact O-N 2.85Å; S178-N181 PolarHBondContact O-N 2.72Å; S178-I182 WeakPolarHBondContact O-CG1 3.47Å; S178-I182 PolarHBondContact O-N 2.92Å
179	L	98.3	Very high	98.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-73.1	-38.2	178.5	-177	56.9	0	0	0	111.5	F167 P175 P176 N181 I182 Y183 G199 L201	F167-L179 WeakPolarHBondContact O-CD2 3.18Å; P175-L179 HydrophobicContact CB-CB 4.2Å; P175-L179 HydrophobicContact CB-CD2 3.95Å; P175-L179 HydrophobicContact CB-CG 4.08Å; P176-L179 WeakPolarHBondContact O-CA 3.21Å; P176-L179 WeakPolarHBondContact O-CB 3.49Å; P176-L179 PolarHBondContact O-N 3.1Å; L179-N181 PolarHBondContact O-N 3.39Å; L179-I182 HydrophobicContact CD1-CB 4.16Å; L179-I182 HydrophobicContact CD1-CD1 4.22Å; L179-I182 HydrophobicContact CD1-CG2 4.12Å; L179-I182 WeakPolarHBondContact O-CA 3.46Å; L179-I182 WeakPolarHBondContact O-CB 3.46Å; L179-I182 PolarHBondContact O-N 2.61Å; L179-I182 VanDerWaalsContact O-N 3.08Å; L179-Y183 HydrophobicContact CD1-CD1 4.43Å; L179-Y183 HydrophobicContact CD1-CE1 3.98Å; L179-Y183 HydrophobicContact CD1-CE2 4.21Å; L179-Y183 HydrophobicContact CD2-CE2 4.11Å; L179-Y183 HydrophobicContact CG-CD2 4.23Å; L179-Y183 HydrophobicContact CG-CE1 4.46Å; L179-Y183 HydrophobicContact CG-CE2 3.79Å; L179-Y183 PolarHBondContact O-N 3.23Å; L179-G199 WeakPolarHBondContact CD2-O 3.43Å; L179-L201 HydrophobicContact CD1-CD1 3.98Å; L179-L201 HydrophobicContact CD1-CD2 4.14Å; L179-L201 HydrophobicContact CD1-CG 4.4Å
180	E	98.6	Very high	98.2	Very high	59 Å²	59	46.5 Å²	46.5	28%	0.276	26%	0.258	S	S	.	.	H	α-helix	trans	-56.2	-41.4	170.9	-71.9	-66.4	171.2	0	0	111.9	P175 P176 Y183 K184 H195	P175-E180 HydrophobicContact CB-CG 4.05Å; P175-E180 WeakPolarHBondContact CB-OE1 3.48Å; P176-E180 PolarHBondContact O-N 2.66Å; E180-Y183 PolarHBondContact O-N 3.08Å; E180-K184 WeakPolarHBondContact O-CG 3.23Å; E180-K184 PolarHBondContact O-N 3.02Å; E180-H195 IonicContact OE1-NE2 2.63Å; E180-H195 IonicContact OE2-CD2 3.95Å; E180-H195 IonicContact OE2-NE2 2.86Å
181	N	98.6	Very high	97.9	Very high	11 Å²	11	52 Å²	52	6%	0.059	28%	0.283	C	S	.	.	H	α-helix	trans	-69.6	-35	175.6	-70.5	-23.1	0	0	0	112.8	P177 S178 L179 Y183 K184 E185 P278 V283 F288	P177-N181 PolarHBondContact O-N 3.17Å; P177-N181 VanDerWaalsContact O-N 3.17Å; P177-N181 PolarHBondContact O-ND2 2.59Å; S178-N181 PolarHBondContact O-N 2.72Å; L179-N181 PolarHBondContact O-N 3.39Å; N181-Y183 VanDerWaalsContact C-N 3.34Å; N181-K184 PolarHBondContact O-N 2.63Å; N181-E185 PolarHBondContact O-N 3.41Å; N181-E185 VanDerWaalsContact O-N 3.07Å; N181-P278 HydrophobicContact CB-CB 4.41Å; N181-P278 VanDerWaalsContact CB-O 3.31Å; N181-P278 WeakPolarHBondContact CB-O 3.39Å; N181-P278 PolarHBondContact ND2-O 2.99Å; N181-V283 HydrophobicContact CB-CG2 3.9Å; N181-F288 HydrophobicContact CB-CE1 4.24Å; N181-F288 HydrophobicContact CB-CZ 4.11Å
182	I	98.7	Very high	97.6	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-46.6	170.8	-75.9	161.9	0	0	0	110.3	F167 S178 L179 E185 L186 W204 W254 P278 F287 F293	F167-I182 HydrophobicContact CB-CD1 3.88Å; F167-I182 HydrophobicContact CD1-CD1 3.81Å; F167-I182 HydrophobicContact CD2-CD1 4.14Å; F167-I182 HydrophobicContact CE1-CD1 4.4Å; F167-I182 HydrophobicContact CG-CD1 3.67Å; S178-I182 WeakPolarHBondContact O-CG1 3.47Å; S178-I182 PolarHBondContact O-N 2.92Å; L179-I182 HydrophobicContact CD1-CB 4.16Å; L179-I182 HydrophobicContact CD1-CD1 4.22Å; L179-I182 HydrophobicContact CD1-CG2 4.12Å; L179-I182 WeakPolarHBondContact O-CA 3.46Å; L179-I182 WeakPolarHBondContact O-CB 3.46Å; L179-I182 PolarHBondContact O-N 2.61Å; L179-I182 VanDerWaalsContact O-N 3.08Å; I182-E185 PolarHBondContact O-N 3.12Å; I182-L186 HydrophobicContact CG2-CD1 3.99Å; I182-L186 PolarHBondContact O-N 2.92Å; I182-W204 HydrophobicContact CG2-CH2 4.02Å; I182-W204 HydrophobicContact CG2-CZ3 4.46Å; I182-W254 HydrophobicContact CD1-CH2 4.46Å; I182-W254 HydrophobicContact CD1-CZ3 3.77Å; I182-W254 HydrophobicContact CG1-CH2 4.4Å; I182-W254 HydrophobicContact CG1-CZ3 4.05Å; I182-P278 HydrophobicContact CD1-CB 4.39Å; I182-P278 HydrophobicContact CD1-CG 4.03Å; I182-P278 HydrophobicContact CG1-CB 3.88Å; I182-P278 HydrophobicContact CG1-CG 4.02Å; I182-F287 HydrophobicContact CB-CZ 4.41Å; I182-F287 HydrophobicContact CG1-CE1 4.35Å; I182-F287 HydrophobicContact CG1-CE2 4.47Å; I182-F287 HydrophobicContact CG1-CZ 3.7Å; I182-F293 HydrophobicContact CG2-CZ 3.94Å
183	Y	98.8	Very high	97.6	Very high	5 Å²	5	45.2 Å²	45.2	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-36.4	178.3	-66.6	-31.4	0	0	0	113.4	P175 L179 E180 N181 L186 S187 F193 H195 P196 H198 L201 W204 L313	P175-Y183 HydrophobicContact CB-CE2 4.3Å; P175-Y183 HydrophobicContact CG-CE2 4.13Å; L179-Y183 HydrophobicContact CD1-CD1 4.43Å; L179-Y183 HydrophobicContact CD1-CE1 3.98Å; L179-Y183 HydrophobicContact CD1-CE2 4.21Å; L179-Y183 HydrophobicContact CD2-CE2 4.11Å; L179-Y183 HydrophobicContact CG-CD2 4.23Å; L179-Y183 HydrophobicContact CG-CE1 4.46Å; L179-Y183 HydrophobicContact CG-CE2 3.79Å; L179-Y183 PolarHBondContact O-N 3.23Å; E180-Y183 PolarHBondContact O-N 3.08Å; N181-Y183 VanDerWaalsContact C-N 3.34Å; Y183-L186 HydrophobicContact CD1-CD1 4.09Å; Y183-L186 WeakPolarHBondContact O-CB 3.23Å; Y183-L186 PolarHBondContact O-N 3.45Å; Y183-S187 PolarHBondContact O-N 3.07Å; Y183-F193 AromaticContact CD1-CE1 3.95Å; Y183-F193 HydrophobicContact CD1-CE1 3.95Å; Y183-F193 AromaticContact CD1-CZ 3.52Å; Y183-F193 HydrophobicContact CD1-CZ 3.52Å; Y183-F193 AromaticContact CE1-CZ 3.99Å; Y183-F193 HydrophobicContact CE1-CZ 3.99Å; Y183-F193 HydrophobicContact CG-CE1 4.32Å; Y183-F193 HydrophobicContact CG-CZ 4.27Å; Y183-H195 AromaticContact CD2-CD2 3.34Å; Y183-H195 WeakPolarHBondContact CD2-CD2 3.38Å; Y183-H195 AromaticContact CD2-NE2 3.3Å; Y183-H195 VanDerWaalsContact CD2-NE2 3.3Å; Y183-H195 WeakPolarHBondContact CD2-NE2 3.44Å; Y183-H195 AromaticContact CE2-NE2 3.69Å; Y183-H195 AromaticContact CG-CD2 3.96Å; Y183-P196 HydrophobicContact CE1-CG 4.25Å; Y183-P196 HydrophobicContact CE2-CG 4.17Å; Y183-H198 WeakPolarHBondContact CE2-O 3.47Å; Y183-H198 PolarHBondContact OH-O 2.94Å; Y183-L201 HydrophobicContact CE1-CD2 4.15Å; Y183-W204 HydrophobicContact CE1-CH2 4.48Å; Y183-L313 HydrophobicContact CE1-CD1 3.97Å
184	K	98.6	Very high	97.6	Very high	109 Å²	109	49.4 Å²	49.4	47%	0.474	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-43	173.1	-74.7	172.1	-173.7	174.1	0	112.3	E180 N181 S187 T188 F288	E180-K184 WeakPolarHBondContact O-CG 3.23Å; E180-K184 PolarHBondContact O-N 3.02Å; N181-K184 PolarHBondContact O-N 2.63Å; K184-S187 PolarHBondContact O-N 2.6Å; K184-S187 PolarHBondContact O-OG 2.82Å; K184-T188 PolarHBondContact O-N 3.3Å; K184-F288 HydrophobicContact CB-CE1 3.79Å; K184-F288 HydrophobicContact CB-CZ 4.26Å; K184-F288 HydrophobicContact CD-CE1 4.5Å; K184-F288 HydrophobicContact CD-CZ 4.14Å
185	E	98.8	Very high	97.6	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.009	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-40.2	174.6	178.6	63.7	-176.8	0	0	111.4	N181 I182 S187 T188 D189 F287 F288 G289 C290 R291 F293	N181-E185 PolarHBondContact O-N 3.41Å; N181-E185 VanDerWaalsContact O-N 3.07Å; I182-E185 PolarHBondContact O-N 3.12Å; E185-S187 VanDerWaalsContact C-N 3.34Å; E185-S187 PolarHBondContact O-N 2.87Å; E185-T188 PolarHBondContact O-N 2.87Å; E185-T188 PolarHBondContact O-OG1 2.87Å; E185-D189 WeakPolarHBondContact O-CB 3.43Å; E185-D189 PolarHBondContact O-N 2.8Å; E185-F287 HydrophobicContact CB-CD1 4.29Å; E185-F287 HydrophobicContact CB-CE1 3.63Å; E185-F287 HydrophobicContact CB-CZ 4.34Å; E185-F287 HydrophobicContact CG-CE1 4.13Å; E185-F288 HydrophobicContact CB-CD1 4.35Å; E185-F288 VanDerWaalsContact OE2-CA 3.31Å; E185-F288 WeakPolarHBondContact OE2-CA 3.44Å; E185-G289 PolarHBondContact OE1-N 3.09Å; E185-G289 PolarHBondContact OE2-N 3.4Å; E185-C290 PolarHBondContact OE1-N 3.25Å; E185-R291 PolarHBondContact OE1-N 3.3Å; E185-F293 HydrophobicContact CB-CE2 4.29Å; E185-F293 HydrophobicContact CG-CD2 4.28Å; E185-F293 HydrophobicContact CG-CE2 3.9Å
186	L	98.6	Very high	97.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-42.3	174.8	-88.1	159.7	0	0	0	112.6	I182 Y183 T188 D189 I190 F193 W204 F293 W310	I182-L186 HydrophobicContact CG2-CD1 3.99Å; I182-L186 PolarHBondContact O-N 2.92Å; Y183-L186 HydrophobicContact CD1-CD1 4.09Å; Y183-L186 WeakPolarHBondContact O-CB 3.23Å; Y183-L186 PolarHBondContact O-N 3.45Å; L186-T188 PolarHBondContact O-N 3.18Å; L186-D189 PolarHBondContact O-N 2.89Å; L186-I190 HydrophobicContact CD2-CG1 3.86Å; L186-I190 WeakPolarHBondContact O-CB 3.45Å; L186-I190 PolarHBondContact O-N 2.78Å; L186-F193 HydrophobicContact CB-CB 4.44Å; L186-F193 HydrophobicContact CB-CD1 3.48Å; L186-F193 VanDerWaalsContact CB-CD1 3.48Å; L186-F193 HydrophobicContact CB-CD2 4.15Å; L186-F193 HydrophobicContact CB-CE1 3.65Å; L186-F193 HydrophobicContact CB-CE2 4.31Å; L186-F193 HydrophobicContact CB-CG 3.75Å; L186-F193 HydrophobicContact CB-CZ 4.08Å; L186-F193 HydrophobicContact CD1-CD2 4.4Å; L186-F193 HydrophobicContact CD1-CE1 4.24Å; L186-F193 HydrophobicContact CD1-CE2 3.93Å; L186-F193 HydrophobicContact CD1-CZ 3.84Å; L186-F193 HydrophobicContact CD2-CD2 4.26Å; L186-F193 HydrophobicContact CD2-CG 4.48Å; L186-W204 HydrophobicContact CD1-CH2 3.47Å; L186-W204 VanDerWaalsContact CD1-CH2 3.47Å; L186-W204 HydrophobicContact CD1-CZ2 3.48Å; L186-W204 VanDerWaalsContact CD1-CZ2 3.48Å; L186-F293 HydrophobicContact CD1-CD1 4.4Å; L186-F293 HydrophobicContact CD1-CE1 4.01Å; L186-F293 HydrophobicContact CD1-CE2 4.4Å; L186-F293 HydrophobicContact CD1-CZ 4.03Å; L186-F293 HydrophobicContact CD2-CB 3.78Å; L186-F293 HydrophobicContact CD2-CD1 3.53Å; L186-F293 HydrophobicContact CD2-CD2 3.66Å; L186-F293 HydrophobicContact CD2-CE1 3.98Å; L186-F293 HydrophobicContact CD2-CE2 4.11Å; L186-F293 HydrophobicContact CD2-CG 3.35Å; L186-F293 HydrophobicContact CD2-CZ 4.26Å; L186-F293 HydrophobicContact CG-CD1 3.98Å; L186-F293 HydrophobicContact CG-CD2 3.7Å; L186-F293 HydrophobicContact CG-CE1 3.92Å; L186-F293 HydrophobicContact CG-CE2 3.66Å; L186-F293 HydrophobicContact CG-CG 3.88Å; L186-F293 HydrophobicContact CG-CZ 3.78Å; L186-W310 HydrophobicContact CD2-CB 3.71Å; L186-W310 HydrophobicContact CD2-CG 4.1Å
187	S	98.2	Very high	97.6	Very high	63 Å²	63	52.3 Å²	52.3	44%	0.441	30%	0.299	S	S	.	.	H	α-helix	trans	-65.5	-22	179.3	63.4	0	0	0	0	114.3	Y183 K184 E185	Y183-S187 PolarHBondContact O-N 3.07Å; K184-S187 PolarHBondContact O-N 2.6Å; K184-S187 PolarHBondContact O-OG 2.82Å; E185-S187 VanDerWaalsContact C-N 3.34Å; E185-S187 PolarHBondContact O-N 2.87Å
188	T	98.2	Very high	97.7	Very high	100 Å²	100	49.1 Å²	49.1	61%	0.613	28%	0.276	S	S	*	.	H	α-helix	trans	-97.9	-22.8	176	59.8	0	0	0	0	112.4	K184 E185 L186	K184-T188 PolarHBondContact O-N 3.3Å; E185-T188 PolarHBondContact O-N 2.87Å; E185-T188 PolarHBondContact O-OG1 2.87Å; L186-T188 PolarHBondContact O-N 3.18Å
189	D	98.6	Very high	97.8	Very high	7 Å²	7	48.4 Å²	48.4	4%	0.037	27%	0.271	C	S	.	.	H	α-helix	trans	-90.3	-36.9	-179	-167.5	27.2	0	0	0	113.5	E185 L186 R291 F293 S294	E185-D189 WeakPolarHBondContact O-CB 3.43Å; E185-D189 PolarHBondContact O-N 2.8Å; L186-D189 PolarHBondContact O-N 2.89Å; D189-R291 VanDerWaalsContact CG-CA 3.42Å; D189-R291 WeakPolarHBondContact OD1-CA 3.35Å; D189-R291 WeakPolarHBondContact OD1-CB 3.34Å; D189-R291 WeakPolarHBondContact OD1-CG 3.2Å; D189-R291 IonicContact OD1-CZ 2.61Å; D189-R291 IonicContact OD1-NE 3.49Å; D189-R291 PolarHBondContact OD1-NE 3.14Å; D189-R291 IonicContact OD1-NH2 2.63Å; D189-R291 VanDerWaalsContact OD2-CA 3.23Å; D189-R291 WeakPolarHBondContact OD2-CA 3.31Å; D189-F293 WeakPolarHBondContact OD2-CA 3.29Å; D189-F293 WeakPolarHBondContact OD2-CB 3.08Å; D189-F293 PolarHBondContact OD2-N 3.1Å; D189-S294 VanDerWaalsContact CG-OG 3.29Å; D189-S294 VanDerWaalsContact OD1-CB 3.24Å; D189-S294 WeakPolarHBondContact OD1-CB 3.4Å; D189-S294 PolarHBondContact OD1-OG 2.73Å; D189-S294 PolarHBondContact OD2-N 3.09Å; D189-S294 PolarHBondContact OD2-OG 2.9Å
190	I	98.1	Very high	97.8	Very high	29 Å²	29	49.4 Å²	49.4	15%	0.149	28%	0.276	C	S	.	.	S	Bend	trans	-116.5	107.8	-177.5	-53.9	-60.3	0	0	0	108.3	L186 D192 F193 F293	L186-I190 HydrophobicContact CD2-CG1 3.86Å; L186-I190 WeakPolarHBondContact O-CB 3.45Å; L186-I190 PolarHBondContact O-N 2.78Å; I190-D192 VanDerWaalsContact C-N 3.27Å; I190-D192 PolarHBondContact O-N 3.09Å; I190-D192 VanDerWaalsContact O-N 3.12Å; I190-F193 HydrophobicContact CB-CB 3.92Å; I190-F193 HydrophobicContact CG2-CB 4.05Å; I190-F193 WeakPolarHBondContact O-CB 3.42Å; I190-F193 PolarHBondContact O-N 3.44Å; I190-F293 HydrophobicContact CD1-CB 4.05Å; I190-F293 HydrophobicContact CG1-CB 4.02Å
191	E	92.6	Very high	97.8	Very high	191 Å²	191	46.6 Å²	46.6	89%	0.893	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-39.3	-170.3	-173.2	171.9	-172.8	0	0	114.4
192	D	91.6	Very high	97.8	Very high	110 Å²	110	46.9 Å²	46.9	59%	0.588	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	3.7	-177.9	-62.7	-36	0	0	0	114.2	I190 V194 K311	I190-D192 VanDerWaalsContact C-N 3.27Å; I190-D192 PolarHBondContact O-N 3.09Å; I190-D192 VanDerWaalsContact O-N 3.12Å; D192-V194 PolarHBondContact O-N 3.04Å; D192-K311 HydrophobicContact CB-CD 3.56Å; D192-K311 VanDerWaalsContact O-CD 3.25Å; D192-K311 WeakPolarHBondContact O-CD 3.43Å; D192-K311 IonicContact OD2-NZ 3.27Å; D192-K311 PolarHBondContact OD2-NZ 2.9Å
193	F	98.2	Very high	97.8	Very high	11 Å²	11	47.2 Å²	47.2	5%	0.048	27%	0.27	C	S	.	.			trans	-77.2	124.2	-176.9	-177	-87.1	0	0	0	110.9	Y183 L186 I190 W310 K311 L313	Y183-F193 AromaticContact CD1-CE1 3.95Å; Y183-F193 HydrophobicContact CD1-CE1 3.95Å; Y183-F193 AromaticContact CD1-CZ 3.52Å; Y183-F193 HydrophobicContact CD1-CZ 3.52Å; Y183-F193 AromaticContact CE1-CZ 3.99Å; Y183-F193 HydrophobicContact CE1-CZ 3.99Å; Y183-F193 HydrophobicContact CG-CE1 4.32Å; Y183-F193 HydrophobicContact CG-CZ 4.27Å; L186-F193 HydrophobicContact CB-CB 4.44Å; L186-F193 HydrophobicContact CB-CD1 3.48Å; L186-F193 VanDerWaalsContact CB-CD1 3.48Å; L186-F193 HydrophobicContact CB-CD2 4.15Å; L186-F193 HydrophobicContact CB-CE1 3.65Å; L186-F193 HydrophobicContact CB-CE2 4.31Å; L186-F193 HydrophobicContact CB-CG 3.75Å; L186-F193 HydrophobicContact CB-CZ 4.08Å; L186-F193 HydrophobicContact CD1-CD2 4.4Å; L186-F193 HydrophobicContact CD1-CE1 4.24Å; L186-F193 HydrophobicContact CD1-CE2 3.93Å; L186-F193 HydrophobicContact CD1-CZ 3.84Å; L186-F193 HydrophobicContact CD2-CD2 4.26Å; L186-F193 HydrophobicContact CD2-CG 4.48Å; I190-F193 HydrophobicContact CB-CB 3.92Å; I190-F193 HydrophobicContact CG2-CB 4.05Å; I190-F193 WeakPolarHBondContact O-CB 3.42Å; I190-F193 PolarHBondContact O-N 3.44Å; F193-W310 WeakPolarHBondContact CE2-O 3.31Å; F193-K311 HydrophobicContact CB-CG 4.34Å; F193-K311 HydrophobicContact CD2-CG 4.06Å; F193-L313 HydrophobicContact CE2-CD1 4.09Å; F193-L313 HydrophobicContact CZ-CD1 4.36Å
194	V	97.5	Very high	97.8	Very high	115 Å²	115	47.1 Å²	47.1	70%	0.697	27%	0.27	S	S	*	.			trans	-117.5	142.3	173.9	-177.1	0	0	0	0	108.5	D192	D192-V194 PolarHBondContact O-N 3.04Å
195	H	98.3	Very high	97.8	Very high	79 Å²	79	42 Å²	42	37%	0.366	25%	0.248	S	C	.	.			trans	-54.4	122	175.8	-177	-76	0	0	0	110.2	E180 Y183 G197	E180-H195 IonicContact OE1-NE2 2.63Å; E180-H195 IonicContact OE2-CD2 3.95Å; E180-H195 IonicContact OE2-NE2 2.86Å; Y183-H195 AromaticContact CD2-CD2 3.34Å; Y183-H195 WeakPolarHBondContact CD2-CD2 3.38Å; Y183-H195 AromaticContact CD2-NE2 3.3Å; Y183-H195 VanDerWaalsContact CD2-NE2 3.3Å; Y183-H195 WeakPolarHBondContact CD2-NE2 3.44Å; Y183-H195 AromaticContact CE2-NE2 3.69Å; Y183-H195 AromaticContact CG-CD2 3.96Å; H195-G197 PolarHBondContact ND1-N 3.23Å; H195-G197 PolarHBondContact O-N 3.4Å
196	P	97.8	Very high	97.8	Very high	43 Å²	43	48.8 Å²	48.8	28%	0.279	28%	0.277	S	S	.	.			trans	-79.5	-4	-166.6	33.5	-39.3	0	0	0	113.9	Y183 H198 L313	Y183-P196 HydrophobicContact CE1-CG 4.25Å; Y183-P196 HydrophobicContact CE2-CG 4.17Å; P196-H198 VanDerWaalsContact C-N 3.31Å; P196-H198 PolarHBondContact O-CD2 3.4Å; P196-H198 PolarHBondContact O-N 3.23Å; P196-L313 HydrophobicContact CB-CB 4.4Å; P196-L313 HydrophobicContact CG-CD1 3.97Å
197	G	98	Very high	97.8	Very high	64 Å²	64	50.1 Å²	50.1	66%	0.66	28%	0.284	S	S	*	.	S	Bend	trans	80.7	8.1	-179.7	0	0	0	0	0	114.2	H195	H195-G197 PolarHBondContact ND1-N 3.23Å; H195-G197 PolarHBondContact O-N 3.4Å
198	H	98.6	Very high	97.8	Very high	17 Å²	17	47.1 Å²	47.1	8%	0.079	26%	0.263	C	S	.	.	S	Bend	trans	-150.3	170.2	175.6	61.2	85.5	0	0	0	111.9	R171 Y183 P196 D200 L313	R171-H198 HydrophobicContact CG-CB 3.73Å; R171-H198 VanDerWaalsContact CZ-CG 3.47Å; R171-H198 PolarHBondContact NH2-CD2 2.86Å; R171-H198 PolarHBondContact NH2-CE1 2.91Å; R171-H198 PolarHBondContact NH2-ND1 3.47Å; R171-H198 PolarHBondContact NH2-NE2 2.87Å; Y183-H198 WeakPolarHBondContact CE2-O 3.47Å; Y183-H198 PolarHBondContact OH-O 2.94Å; P196-H198 VanDerWaalsContact C-N 3.31Å; P196-H198 PolarHBondContact O-CD2 3.4Å; P196-H198 PolarHBondContact O-N 3.23Å; H198-D200 PolarHBondContact CE1-O 3.08Å; H198-D200 PolarHBondContact ND1-N 3.45Å; H198-D200 PolarHBondContact ND1-O 2.85Å; H198-L313 PolarHBondContact CE1-OXT 3.41Å; H198-L313 VanDerWaalsContact CE1-OXT 3.23Å
199	G	98.4	Very high	97.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.234	C	C	.	.			trans	-104.9	6.8	179.2	0	0	0	0	0	116.2	S168 V169 L179 L201	S168-G199 WeakPolarHBondContact CA-O 3.41Å; S168-G199 PolarHBondContact OG-O 3.48Å; V169-G199 PolarHBondContact N-O 3.49Å; V169-G199 CarbonylContact O-C 3.42Å; L179-G199 WeakPolarHBondContact CD2-O 3.43Å; G199-L201 PolarHBondContact O-N 3.06Å
200	D	98.8	Very high	97.9	Very high	21 Å²	21	42.2 Å²	42.2	11%	0.112	23%	0.233	C	C	.	.			trans	-75.7	121.1	-179	-165.9	-15.5	0	0	0	110.9	H163 S168 V169 R171 H198 S202	H163-D200 IonicContact CE1-OD1 3.62Å; S168-D200 WeakPolarHBondContact OG-CA 3.5Å; V169-D200 VanDerWaalsContact O-CA 3.23Å; V169-D200 WeakPolarHBondContact O-CA 3.41Å; V169-D200 PolarHBondContact O-N 2.6Å; R171-D200 IonicContact NH1-OD2 2.99Å; R171-D200 PolarHBondContact NH1-OD2 2.91Å; H198-D200 PolarHBondContact CE1-O 3.08Å; H198-D200 PolarHBondContact ND1-N 3.45Å; H198-D200 PolarHBondContact ND1-O 2.85Å; D200-S202 WeakPolarHBondContact OD1-CB 3.41Å; D200-S202 PolarHBondContact OD1-N 3.44Å; D200-S202 PolarHBondContact OD1-OG 2.81Å
201	L	98.8	Very high	97.9	Very high	1 Å²	1	41 Å²	41	1%	0.005	23%	0.226	C	C	.	.			trans	-106.6	14.7	-178.2	-57.2	-179.1	0	0	0	112.4	F167 S168 L179 Y183 G199 G203 W204 A205 L211 L313	F167-L201 HydrophobicContact CB-CD1 4.25Å; S168-L201 PolarHBondContact OG-N 3.35Å; L179-L201 HydrophobicContact CD1-CD1 3.98Å; L179-L201 HydrophobicContact CD1-CD2 4.14Å; L179-L201 HydrophobicContact CD1-CG 4.4Å; Y183-L201 HydrophobicContact CE1-CD2 4.15Å; G199-L201 PolarHBondContact O-N 3.06Å; L201-G203 PolarHBondContact O-N 3.37Å; L201-W204 HydrophobicContact CB-CE3 4.24Å; L201-W204 HydrophobicContact CD1-CE3 4.05Å; L201-W204 HydrophobicContact CD1-CZ3 3.82Å; L201-W204 HydrophobicContact CD2-CD2 4.23Å; L201-W204 HydrophobicContact CD2-CE3 3.89Å; L201-W204 HydrophobicContact CD2-CH2 3.84Å; L201-W204 HydrophobicContact CD2-CZ2 4.2Å; L201-W204 HydrophobicContact CD2-CZ3 3.7Å; L201-W204 HydrophobicContact CG-CE3 4.29Å; L201-W204 HydrophobicContact CG-CZ3 4.28Å; L201-W204 PolarHBondContact O-N 2.64Å; L201-W204 VanDerWaalsContact O-N 3.15Å; L201-A205 PolarHBondContact O-N 2.89Å; L201-L211 HydrophobicContact CB-CD1 3.59Å; L201-L211 HydrophobicContact CD1-CD1 4.24Å; L201-L313 HydrophobicContact CD2-CD1 4.29Å; L201-L313 HydrophobicContact CD2-CD2 3.81Å
202	S	98.7	Very high	98.2	Very high	16 Å²	16	31.9 Å²	31.9	11%	0.112	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-29.9	179.5	-60	0	0	0	0	112.5	D200 A205 K206	D200-S202 WeakPolarHBondContact OD1-CB 3.41Å; D200-S202 PolarHBondContact OD1-N 3.44Å; D200-S202 PolarHBondContact OD1-OG 2.81Å; S202-A205 PolarHBondContact O-N 3.29Å; S202-K206 WeakPolarHBondContact O-CG 3.23Å; S202-K206 PolarHBondContact O-N 3.4Å
203	G	98.6	Very high	98.4	Very high	9 Å²	9	27.3 Å²	27.3	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-57.5	-46.6	174.3	0	0	0	0	0	112.7	L201 A205 K206 Q207 E312	L201-G203 PolarHBondContact O-N 3.37Å; G203-A205 PolarHBondContact O-N 2.84Å; G203-K206 PolarHBondContact O-N 3.1Å; G203-Q207 WeakPolarHBondContact O-CG 3.45Å; G203-Q207 PolarHBondContact O-N 3.46Å; G203-Q207 PolarHBondContact O-NE2 3.15Å; G203-E312 CarbonylContact C-O 3.43Å; G203-E312 VanDerWaalsContact CA-O 3.31Å; G203-E312 WeakPolarHBondContact CA-O 3.3Å
204	W	98.8	Very high	98.2	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-65.4	-40.7	174	-61.3	-9.6	0	0	0	112.2	I182 Y183 L186 L201 K206 Q207 V209 F293 W310 L313	I182-W204 HydrophobicContact CG2-CH2 4.02Å; I182-W204 HydrophobicContact CG2-CZ3 4.46Å; Y183-W204 HydrophobicContact CE1-CH2 4.48Å; L186-W204 HydrophobicContact CD1-CH2 3.47Å; L186-W204 VanDerWaalsContact CD1-CH2 3.47Å; L186-W204 HydrophobicContact CD1-CZ2 3.48Å; L186-W204 VanDerWaalsContact CD1-CZ2 3.48Å; L201-W204 HydrophobicContact CB-CE3 4.24Å; L201-W204 HydrophobicContact CD1-CE3 4.05Å; L201-W204 HydrophobicContact CD1-CZ3 3.82Å; L201-W204 HydrophobicContact CD2-CD2 4.23Å; L201-W204 HydrophobicContact CD2-CE3 3.89Å; L201-W204 HydrophobicContact CD2-CH2 3.84Å; L201-W204 HydrophobicContact CD2-CZ2 4.2Å; L201-W204 HydrophobicContact CD2-CZ3 3.7Å; L201-W204 HydrophobicContact CG-CE3 4.29Å; L201-W204 HydrophobicContact CG-CZ3 4.28Å; L201-W204 PolarHBondContact O-N 2.64Å; L201-W204 VanDerWaalsContact O-N 3.15Å; W204-K206 VanDerWaalsContact C-N 3.31Å; W204-K206 PolarHBondContact O-N 3.09Å; W204-Q207 WeakPolarHBondContact O-CB 3.43Å; W204-Q207 PolarHBondContact O-N 3.48Å; W204-V209 HydrophobicContact CB-CB 3.96Å; W204-V209 HydrophobicContact CB-CG1 4.45Å; W204-V209 HydrophobicContact CB-CG2 3.99Å; W204-V209 VanDerWaalsContact O-CB 3.29Å; W204-V209 WeakPolarHBondContact O-CB 3.21Å; W204-V209 WeakPolarHBondContact O-CG2 3.14Å; W204-V209 PolarHBondContact O-N 3.19Å; W204-V209 VanDerWaalsContact O-N 3.09Å; W204-F293 HydrophobicContact CH2-CE1 4.37Å; W204-W310 AromaticContact CD2-CE3 3.8Å; W204-W310 HydrophobicContact CD2-CE3 3.8Å; W204-W310 AromaticContact CD2-CZ3 3.99Å; W204-W310 HydrophobicContact CD2-CZ3 3.99Å; W204-W310 AromaticContact CE2-CE3 3.71Å; W204-W310 HydrophobicContact CE3-CE3 4.26Å; W204-W310 HydrophobicContact CE3-CZ3 4.12Å; W204-W310 HydrophobicContact CG-CE3 4.13Å; W204-W310 HydrophobicContact CG-CZ3 4.28Å; W204-W310 HydrophobicContact CZ2-CE3 4.12Å; W204-W310 AromaticContact NE1-CE3 3.92Å; W204-W310 PolarHBondContact NE1-O 3.4Å; W204-L313 VanDerWaalsContact CD1-CD2 3.47Å; W204-L313 HydrophobicContact CD2-CD2 3.95Å; W204-L313 HydrophobicContact CG-CD2 3.85Å; W204-L313 HydrophobicContact CZ2-CD1 3.8Å; W204-L313 HydrophobicContact CZ2-CD2 4.29Å; W204-L313 HydrophobicContact CZ2-CG 4.37Å; W204-L313 VanDerWaalsContact NE1-CD2 3.31Å
205	A	98.8	Very high	98.2	Very high	3 Å²	3	21.4 Å²	21.4	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-39	-178.6	0	0	0	0	0	112.4	M140 C141 L165 L201 S202 G203 Q207 G208 V209 L211	M140-A205 HydrophobicContact CB-CB 3.51Å; M140-A205 HydrophobicContact CG-CB 3.58Å; M140-A205 HydrophobicContact SD-CB 4.36Å; C141-A205 PolarHBondContact SG-O 2.82Å; L165-A205 HydrophobicContact CD1-CB 4.14Å; L165-A205 HydrophobicContact CD2-CB 4.41Å; L201-A205 PolarHBondContact O-N 2.89Å; S202-A205 PolarHBondContact O-N 3.29Å; G203-A205 PolarHBondContact O-N 2.84Å; A205-Q207 VanDerWaalsContact C-N 3.26Å; A205-Q207 PolarHBondContact O-N 2.79Å; A205-G208 PolarHBondContact O-N 3.24Å; A205-V209 WeakPolarHBondContact CA-O 3.33Å; A205-L211 HydrophobicContact CB-CD1 4.35Å
206	K	98.8	Very high	98.2	Very high	143 Å²	143	18 Å²	18	62%	0.622	11%	0.109	S	C	*	.	H	α-helix	trans	-64.4	-29.4	174.2	-70.7	170.3	-176.4	177.2	0	113.2	M140 S202 G203 W204 G208	M140-K206 WeakPolarHBondContact O-CA 3.19Å; M140-K206 HydrophobicContact SD-CG 4.43Å; S202-K206 WeakPolarHBondContact O-CG 3.23Å; S202-K206 PolarHBondContact O-N 3.4Å; G203-K206 PolarHBondContact O-N 3.1Å; W204-K206 VanDerWaalsContact C-N 3.31Å; W204-K206 PolarHBondContact O-N 3.09Å; K206-G208 PolarHBondContact O-N 2.94Å
207	Q	98.7	Very high	98.2	Very high	28 Å²	28	16 Å²	16	13%	0.131	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	2.9	177.5	-66.2	178	60.4	0	0	113.9	K147 G203 W204 A205 I308 D309 E312	K147-Q207 WeakPolarHBondContact CE-O 3.35Å; K147-Q207 PolarHBondContact NZ-O 3.28Å; K147-Q207 VanDerWaalsContact NZ-O 3.16Å; G203-Q207 WeakPolarHBondContact O-CG 3.45Å; G203-Q207 PolarHBondContact O-N 3.46Å; G203-Q207 PolarHBondContact O-NE2 3.15Å; W204-Q207 WeakPolarHBondContact O-CB 3.43Å; W204-Q207 PolarHBondContact O-N 3.48Å; A205-Q207 VanDerWaalsContact C-N 3.26Å; A205-Q207 PolarHBondContact O-N 2.79Å; Q207-I308 HydrophobicContact CB-CD1 4.27Å; Q207-D309 PolarHBondContact NE2-O 2.7Å; Q207-E312 PolarHBondContact NE2-OE2 3.38Å
208	G	98.7	Very high	98.2	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	21	-177.9	0	0	0	0	0	114.3	D145 K147 V148 A205 K206	D145-G208 WeakPolarHBondContact O-CA 3.22Å; K147-G208 PolarHBondContact N-O 3.49Å; V148-G208 PolarHBondContact N-O 3.38Å; V148-G208 VanDerWaalsContact N-O 3.15Å; A205-G208 PolarHBondContact O-N 3.24Å; K206-G208 PolarHBondContact O-N 2.94Å
209	V	98.9	Very high	98.2	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.006	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	102.8	167.3	-174.8	0	0	0	0	109.1	V148 I150 W204 A205 L211 I308 W310	V148-V209 HydrophobicContact CB-CB 4.49Å; V148-V209 HydrophobicContact CB-CG1 4.26Å; V148-V209 HydrophobicContact CB-CG2 4.19Å; V148-V209 HydrophobicContact CG1-CG1 4.33Å; V148-V209 HydrophobicContact CG2-CG2 4.48Å; V148-V209 CarbonylContact O-C 3.42Å; V148-V209 WeakPolarHBondContact O-CA 3.43Å; I150-V209 HydrophobicContact CD1-CG1 3.81Å; I150-V209 HydrophobicContact CG1-CG1 3.92Å; W204-V209 HydrophobicContact CB-CB 3.96Å; W204-V209 HydrophobicContact CB-CG1 4.45Å; W204-V209 HydrophobicContact CB-CG2 3.99Å; W204-V209 VanDerWaalsContact O-CB 3.29Å; W204-V209 WeakPolarHBondContact O-CB 3.21Å; W204-V209 WeakPolarHBondContact O-CG2 3.14Å; W204-V209 PolarHBondContact O-N 3.19Å; W204-V209 VanDerWaalsContact O-N 3.09Å; A205-V209 WeakPolarHBondContact CA-O 3.33Å; V209-L211 HydrophobicContact CG1-CD2 4.04Å; V209-L211 HydrophobicContact CG1-CG 4.39Å; V209-L211 PolarHBondContact O-N 3.36Å; V209-I308 HydrophobicContact CG2-CD1 3.81Å; V209-I308 HydrophobicContact CG2-CG1 3.9Å; V209-I308 HydrophobicContact CG2-CG2 3.88Å; V209-W310 HydrophobicContact CG1-CZ3 4.39Å; V209-W310 HydrophobicContact CG2-CH2 4.02Å; V209-W310 HydrophobicContact CG2-CZ3 3.95Å
210	L	98.9	Very high	98.2	Very high	4 Å²	4	15.1 Å²	15.1	2%	0.021	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	111	174.6	175.1	61.7	0	0	0	110.2	W98 W137 V146 V148 V149 I150 L212 V238 L242	W98-L210 HydrophobicContact CH2-CD1 3.75Å; W98-L210 HydrophobicContact CH2-CD2 3.91Å; W98-L210 HydrophobicContact CH2-CG 4.35Å; W98-L210 HydrophobicContact CZ2-CD1 4.29Å; W98-L210 HydrophobicContact CZ3-CD1 4.47Å; W98-L210 HydrophobicContact CZ3-CD2 4.35Å; W137-L210 HydrophobicContact CB-CD1 4.07Å; W137-L210 HydrophobicContact CD2-CD1 4.43Å; W137-L210 HydrophobicContact CE3-CD1 3.78Å; V146-L210 HydrophobicContact CG1-CB 3.98Å; V146-L210 HydrophobicContact CG2-CB 4.49Å; V148-L210 PolarHBondContact O-N 3.38Å; V149-L210 HydrophobicContact CG1-CD2 4.06Å; V149-L210 HydrophobicContact CG1-CG 4.42Å; V149-L210 HydrophobicContact CG2-CB 4.25Å; V149-L210 HydrophobicContact CG2-CD2 4.19Å; I150-L210 PolarHBondContact N-O 3.17Å; L210-L212 HydrophobicContact CD1-CB 4.17Å; L210-L212 HydrophobicContact CD2-CB 4.27Å; L210-L212 HydrophobicContact CD2-CD2 4.3Å; L210-L212 HydrophobicContact CG-CB 3.93Å; L210-L212 PolarHBondContact O-N 2.89Å; L210-V238 HydrophobicContact CD2-CG1 4.31Å; L210-L242 HydrophobicContact CD2-CD1 3.52Å
211	L	98.8	Very high	98.1	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	80.1	177.1	-64	172.8	0	0	0	110.7	I150 L165 C166 L201 A205 V209	I150-L211 HydrophobicContact CB-CD2 4.11Å; I150-L211 HydrophobicContact CD1-CD2 3.92Å; I150-L211 HydrophobicContact CG1-CD2 4.28Å; L165-L211 HydrophobicContact CB-CB 4Å; L165-L211 HydrophobicContact CB-CD1 4Å; L165-L211 HydrophobicContact CD1-CD1 4.23Å; L165-L211 HydrophobicContact CD2-CB 4.28Å; C166-L211 PolarHBondContact N-O 3.38Å; C166-L211 VanDerWaalsContact N-O 3.08Å; C166-L211 WeakPolarHBondContact SG-CA 3.27Å; L201-L211 HydrophobicContact CB-CD1 3.59Å; L201-L211 HydrophobicContact CD1-CD1 4.24Å; A205-L211 HydrophobicContact CB-CD1 4.35Å; V209-L211 HydrophobicContact CG1-CD2 4.04Å; V209-L211 HydrophobicContact CG1-CG 4.39Å; V209-L211 PolarHBondContact O-N 3.36Å
212	L	98.3	Very high	98	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.5	-170.7	-177.2	67.1	0	0	0	111.9	W137 I150 L151 G152 L210 L216 T235 V238 V239	W137-L212 HydrophobicContact CD2-CD1 3.87Å; W137-L212 HydrophobicContact CE3-CD1 4.21Å; W137-L212 HydrophobicContact CG-CD1 4.22Å; W137-L212 HydrophobicContact CZ2-CD1 4.23Å; W137-L212 HydrophobicContact CZ3-CD1 4.5Å; I150-L212 PolarHBondContact O-N 3.22Å; I150-L212 VanDerWaalsContact O-N 3.08Å; L151-L212 CarbonylContact C-O 3.53Å; L151-L212 WeakPolarHBondContact CA-O 3.32Å; L151-L212 HydrophobicContact CD2-CB 4.08Å; L151-L212 HydrophobicContact CD2-CD2 4.09Å; L151-L212 HydrophobicContact CD2-CG 4.32Å; G152-L212 PolarHBondContact N-O 3.27Å; L210-L212 HydrophobicContact CD1-CB 4.17Å; L210-L212 HydrophobicContact CD2-CB 4.27Å; L210-L212 HydrophobicContact CD2-CD2 4.3Å; L210-L212 HydrophobicContact CG-CB 3.93Å; L210-L212 PolarHBondContact O-N 2.89Å; L212-L216 HydrophobicContact CD1-CD2 3.98Å; L212-T235 HydrophobicContact CD1-CG2 4.15Å; L212-T235 HydrophobicContact CD2-CG2 4.5Å; L212-T235 HydrophobicContact CG-CG2 4.46Å; L212-V238 HydrophobicContact CD2-CB 4.13Å; L212-V238 HydrophobicContact CD2-CG1 3.87Å; L212-V239 HydrophobicContact CD2-CG2 4.46Å
213	N	96.6	Very high	97.7	Very high	15 Å²	15	26.3 Å²	26.3	8%	0.08	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	151.4	164.2	-76.6	-45.9	0	0	0	110.5	G152 Q153 C166 V215 L216 T235	G152-N213 VanDerWaalsContact CA-OD1 3.26Å; G152-N213 WeakPolarHBondContact CA-OD1 3.48Å; Q153-N213 PolarHBondContact N-OD1 3.17Å; C166-N213 WeakPolarHBondContact CB-OD1 3.22Å; N213-V215 WeakPolarHBondContact CB-O 3.34Å; N213-L216 HydrophobicContact CB-CD2 4.27Å; N213-L216 WeakPolarHBondContact O-CD2 3.37Å; N213-T235 WeakPolarHBondContact O-CG2 3.16Å
214	A	93.7	Very high	97.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-69.1	-37.3	173.3	0	0	0	0	0	113.1	G152 Q153 W231 T235 Y257 K261	G152-A214 PolarHBondContact O-N 3.09Å; Q153-A214 PolarHBondContact O-N 3.49Å; Q153-A214 VanDerWaalsContact O-N 3.16Å; A214-W231 CarbonylContact O-C 3.59Å; A214-T235 WeakPolarHBondContact O-CG2 3.42Å; A214-T235 PolarHBondContact O-OG1 2.97Å; A214-Y257 HydrophobicContact CB-CD1 4.04Å; A214-Y257 HydrophobicContact CB-CE1 3.2Å; A214-K261 HydrophobicContact CB-CD 4.2Å
215	V	96.8	Very high	97.4	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.012	15%	0.152	C	C	.	.	S	Bend	trans	-107.4	130	171.7	-176.3	0	0	0	0	107.9	Q153 D154 P155 N213 T217 H226 W231 E232	Q153-V215 PolarHBondContact O-N 3.16Å; D154-V215 HydrophobicContact CB-CB 4.21Å; P155-V215 VanDerWaalsContact CD-O 3.24Å; P155-V215 WeakPolarHBondContact CD-O 3.44Å; N213-V215 WeakPolarHBondContact CB-O 3.34Å; V215-T217 WeakPolarHBondContact CG1-O 3.42Å; V215-H226 HydrophobicContact CG1-CB 4.1Å; V215-W231 HydrophobicContact CB-CB 4.45Å; V215-W231 HydrophobicContact CG1-CB 4.29Å; V215-W231 HydrophobicContact CG1-CG 4.3Å; V215-E232 HydrophobicContact CG2-CG 4.43Å; V215-E232 WeakPolarHBondContact CG2-OE1 3.46Å
216	L	97.9	Very high	97.3	Very high	7 Å²	7	29.4 Å²	29.4	4%	0.037	15%	0.151	C	C	.	.			trans	-100.2	-3.9	-171.4	-58.8	-173	0	0	0	114.7	P129 V134 F135 W137 L212 N213 W231 F234 T235	P129-L216 WeakPolarHBondContact CD-O 3.47Å; V134-L216 HydrophobicContact CG1-CB 4.05Å; F135-L216 HydrophobicContact CD1-CD1 4.4Å; F135-L216 HydrophobicContact CE1-CD1 4.06Å; W137-L216 HydrophobicContact CZ2-CD1 4.05Å; L212-L216 HydrophobicContact CD1-CD2 3.98Å; N213-L216 HydrophobicContact CB-CD2 4.27Å; N213-L216 WeakPolarHBondContact O-CD2 3.37Å; L216-W231 HydrophobicContact CB-CD2 3.76Å; L216-W231 HydrophobicContact CB-CE3 3.76Å; L216-W231 HydrophobicContact CB-CG 4.38Å; L216-W231 HydrophobicContact CB-CH2 4.12Å; L216-W231 HydrophobicContact CB-CZ2 4.11Å; L216-W231 HydrophobicContact CB-CZ3 3.98Å; L216-W231 HydrophobicContact CD1-CE3 3.67Å; L216-W231 HydrophobicContact CD1-CH2 4.33Å; L216-W231 HydrophobicContact CD1-CZ3 3.6Å; L216-W231 HydrophobicContact CG-CD2 4.13Å; L216-W231 HydrophobicContact CG-CE3 3.76Å; L216-W231 HydrophobicContact CG-CZ3 4.11Å; L216-F234 HydrophobicContact CD1-CD1 4.19Å; L216-F234 HydrophobicContact CD1-CE1 4.2Å; L216-T235 HydrophobicContact CD1-CG2 4.14Å; L216-T235 HydrophobicContact CD2-CG2 4.09Å; L216-T235 HydrophobicContact CG-CG2 3.99Å
217	T	98.5	Very high	97.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.			trans	-141.5	155.6	176.8	56.6	0	0	0	0	110.9	V118 V127 Y128 V134 V215 H226 W231	V118-T217 HydrophobicContact CG1-CG2 4.2Å; V118-T217 HydrophobicContact CG2-CG2 4.49Å; V127-T217 HydrophobicContact CG1-CG2 4.28Å; Y128-T217 CarbonylContact O-C 3.44Å; Y128-T217 WeakPolarHBondContact O-CA 3.4Å; V134-T217 HydrophobicContact CG1-CG2 4.23Å; V134-T217 HydrophobicContact CG2-CG2 4.05Å; V215-T217 WeakPolarHBondContact CG1-O 3.42Å; T217-H226 VanDerWaalsContact O-CB 3.31Å; T217-H226 WeakPolarHBondContact O-CB 3.47Å; T217-H226 PolarHBondContact OG1-ND1 3.02Å; T217-W231 HydrophobicContact CG2-CZ2 3.81Å; T217-W231 PolarHBondContact OG1-NE1 3.5Å
218	V	98.5	Very high	97.1	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	147.9	177	66.9	0	0	0	0	110	V127 Y128 P155 H157 Q222	V127-V218 CarbonylContact C-O 3.59Å; V127-V218 WeakPolarHBondContact CA-O 3.38Å; Y128-V218 PolarHBondContact N-O 3.02Å; Y128-V218 PolarHBondContact O-N 3Å; P155-V218 HydrophobicContact CB-CG1 4.08Å; P155-V218 HydrophobicContact CG-CG1 4.39Å; H157-V218 HydrophobicContact CB-CG1 4Å; H157-V218 HydrophobicContact CB-CG2 3.97Å; V218-Q222 WeakPolarHBondContact CG2-O 3.38Å
219	R	98.6	Very high	97.1	Very high	47 Å²	47	40.2 Å²	40.2	18%	0.177	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	139.9	172.3	-167.8	-171.9	-63.5	167.5	-17.8	108.9	E121 Y125 H221 Q222 S225	E121-R219 IonicContact OE1-CZ 3.93Å; E121-R219 IonicContact OE1-NE 3.21Å; E121-R219 IonicContact OE1-NH2 2.73Å; E121-R219 PolarHBondContact OE1-NH2 2.95Å; E121-R219 IonicContact OE2-CZ 3.73Å; E121-R219 IonicContact OE2-NE 3.95Å; E121-R219 PolarHBondContact OE2-NE 2.98Å; E121-R219 IonicContact OE2-NH2 2.7Å; E121-R219 PolarHBondContact OE2-NH2 2.95Å; Y125-R219 HydrophobicContact CG-CG 4.06Å; R219-H221 PolarHBondContact O-N 3.27Å; R219-Q222 HydrophobicContact CB-CB 4.35Å; R219-Q222 PolarHBondContact O-N 2.9Å; R219-Q222 VanDerWaalsContact O-N 3.07Å; R219-S225 WeakPolarHBondContact CB-OG 3.44Å; R219-S225 PolarHBondContact N-OG 2.86Å
220	A	98	Very high	97	Very high	16 Å²	16	40.8 Å²	40.8	13%	0.132	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	131.6	179	0	0	0	0	0	111.4	T126 Y128 Q222	T126-A220 HydrophobicContact CG2-CB 4.14Å; T126-A220 WeakPolarHBondContact O-CB 3.42Å; T126-A220 PolarHBondContact O-N 2.96Å; Y128-A220 HydrophobicContact CD2-CB 4.21Å; Y128-A220 HydrophobicContact CE2-CB 3.48Å; Y128-A220 VanDerWaalsContact CE2-CB 3.48Å; A220-Q222 PolarHBondContact O-N 3.27Å; A220-Q222 VanDerWaalsContact O-N 3.13Å
221	H	96.9	Very high	97	Very high	131 Å²	131	40.7 Å²	40.7	61%	0.606	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	10.1	179	-45.5	-71.9	0	0	0	116.2	H157 R219	H157-H221 PolarHBondContact O-N 2.84Å; R219-H221 PolarHBondContact O-N 3.27Å
222	Q	96	Very high	96.8	Very high	88 Å²	88	41.9 Å²	41.9	41%	0.411	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-125.4	85.1	-179.2	-61.6	-178.2	18.6	0	0	110.4	V218 R219 A220 N224 S225	V218-Q222 WeakPolarHBondContact CG2-O 3.38Å; R219-Q222 HydrophobicContact CB-CB 4.35Å; R219-Q222 PolarHBondContact O-N 2.9Å; R219-Q222 VanDerWaalsContact O-N 3.07Å; A220-Q222 PolarHBondContact O-N 3.27Å; A220-Q222 VanDerWaalsContact O-N 3.13Å; Q222-N224 PolarHBondContact O-N 2.57Å; Q222-S225 VanDerWaalsContact O-CB 3.26Å; Q222-S225 WeakPolarHBondContact O-CB 3.37Å; Q222-S225 PolarHBondContact O-N 3.3Å; Q222-S225 VanDerWaalsContact O-N 3.14Å; Q222-S225 PolarHBondContact O-OG 2.8Å
223	A	92.3	Very high	96.8	Very high	54 Å²	54	46.5 Å²	46.5	45%	0.446	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	138.5	174.6	0	0	0	0	0	111.1	S225	A223-S225 PolarHBondContact O-N 2.98Å; A223-S225 VanDerWaalsContact O-N 3.15Å
224	N	93.6	Very high	96.9	Very high	47 Å²	47	45.8 Å²	45.8	25%	0.251	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	16.9	-178.6	-59.2	-68.1	0	0	0	116.3	Q153 D154 Q222 H226 K227	Q153-N224 PolarHBondContact NE2-ND2 3.15Å; Q153-N224 PolarHBondContact NE2-OD1 3.21Å; D154-N224 PolarHBondContact OD2-N 3.3Å; Q222-N224 PolarHBondContact O-N 2.57Å; N224-H226 PolarHBondContact O-N 3.41Å; N224-H226 VanDerWaalsContact O-N 3.17Å; N224-K227 HydrophobicContact CB-CB 4.41Å; N224-K227 HydrophobicContact CB-CD 4.16Å; N224-K227 WeakPolarHBondContact O-CB 3.43Å; N224-K227 VanDerWaalsContact O-CG 3.22Å; N224-K227 WeakPolarHBondContact O-CG 3.48Å; N224-K227 PolarHBondContact O-N 2.92Å; N224-K227 VanDerWaalsContact O-N 3.14Å
225	S	97.5	Very high	97.1	Very high	31 Å²	31	45.8 Å²	45.8	22%	0.217	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.2	-177.3	65.3	0	0	0	0	114.3	R219 Q222 A223	R219-S225 WeakPolarHBondContact CB-OG 3.44Å; R219-S225 PolarHBondContact N-OG 2.86Å; Q222-S225 VanDerWaalsContact O-CB 3.26Å; Q222-S225 WeakPolarHBondContact O-CB 3.37Å; Q222-S225 PolarHBondContact O-N 3.3Å; Q222-S225 VanDerWaalsContact O-N 3.14Å; Q222-S225 PolarHBondContact O-OG 2.8Å; A223-S225 PolarHBondContact O-N 2.98Å; A223-S225 VanDerWaalsContact O-N 3.15Å
226	H	98.1	Very high	97.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	13.6	-179.8	-64.9	-166.1	0	0	0	113	F117 E121 V215 T217 N224 R229	F117-H226 HydrophobicContact CE1-CB 4.1Å; F117-H226 AromaticContact CE1-CD2 3.9Å; F117-H226 AromaticContact CE1-CG 3.7Å; F117-H226 AromaticContact CE1-ND1 3.82Å; F117-H226 AromaticContact CZ-CD2 3.75Å; E121-H226 IonicContact OE2-CD2 3.53Å; E121-H226 IonicContact OE2-NE2 2.73Å; E121-H226 PolarHBondContact OE2-NE2 3.42Å; E121-H226 VanDerWaalsContact OE2-NE2 3.09Å; V215-H226 HydrophobicContact CG1-CB 4.1Å; T217-H226 VanDerWaalsContact O-CB 3.31Å; T217-H226 WeakPolarHBondContact O-CB 3.47Å; T217-H226 PolarHBondContact OG1-ND1 3.02Å; N224-H226 PolarHBondContact O-N 3.41Å; N224-H226 VanDerWaalsContact O-N 3.17Å; H226-R229 WeakPolarHBondContact O-CB 3.33Å; H226-R229 WeakPolarHBondContact O-CG 3.28Å
227	K	96.1	Very high	97.1	Very high	106 Å²	106	49.8 Å²	49.8	46%	0.461	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	149.4	172	76.1	177.9	179.6	167.8	0	110.7	N224 R229 E232	N224-K227 HydrophobicContact CB-CB 4.41Å; N224-K227 HydrophobicContact CB-CD 4.16Å; N224-K227 WeakPolarHBondContact O-CB 3.43Å; N224-K227 VanDerWaalsContact O-CG 3.22Å; N224-K227 WeakPolarHBondContact O-CG 3.48Å; N224-K227 PolarHBondContact O-N 2.92Å; N224-K227 VanDerWaalsContact O-N 3.14Å; K227-R229 WeakPolarHBondContact O-CG 3.22Å; K227-R229 PolarHBondContact O-N 3.05Å; K227-R229 VanDerWaalsContact O-N 3.12Å; K227-E232 WeakPolarHBondContact CA-OE1 3.2Å
228	E	96	Very high	97	Very high	158 Å²	158	49.9 Å²	49.9	74%	0.738	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	22.2	174.5	-58.8	168.3	-171.3	0	0	113.4	E232	E228-E232 PolarHBondContact N-OE1 3.19Å; E228-E232 PolarHBondContact N-OE2 3.08Å
229	R	98.1	Very high	97	Very high	135 Å²	135	50.2 Å²	50.2	51%	0.509	25%	0.251	S	S	.	.	S	Bend	trans	-95.8	-6.8	177	-60.6	-61.7	-174.2	175.7	2.3	113.5	L114 F117 H226 K227	L114-R229 HydrophobicContact CD1-CB 4.18Å; L114-R229 WeakPolarHBondContact CD1-O 3.48Å; F117-R229 HydrophobicContact CD1-CB 3.84Å; F117-R229 HydrophobicContact CD1-CG 3.98Å; F117-R229 HydrophobicContact CE1-CB 3.83Å; F117-R229 HydrophobicContact CE1-CG 3.54Å; F117-R229 HydrophobicContact CE2-CG 4.23Å; F117-R229 HydrophobicContact CZ-CB 4.45Å; F117-R229 HydrophobicContact CZ-CG 3.68Å; H226-R229 WeakPolarHBondContact O-CB 3.33Å; H226-R229 WeakPolarHBondContact O-CG 3.28Å; K227-R229 WeakPolarHBondContact O-CG 3.22Å; K227-R229 PolarHBondContact O-N 3.05Å; K227-R229 VanDerWaalsContact O-N 3.12Å
230	G	97.8	Very high	96.9	Very high	12 Å²	12	50.3 Å²	50.3	12%	0.124	26%	0.259	C	S	.	.	S	Bend	trans	124.5	-8.6	175.4	0	0	0	0	0	114.6	Y110 E232 Q233 F234	Y110-G230 WeakPolarHBondContact CE2-O 3.2Å; G230-E232 VanDerWaalsContact C-N 3.27Å; G230-E232 PolarHBondContact O-N 2.86Å; G230-Q233 PolarHBondContact O-N 3.48Å; G230-F234 PolarHBondContact O-N 3.21Å
231	W	97.9	Very high	96.9	Very high	2 Å²	2	51 Å²	51	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-36.7	176.6	-78.1	122.6	0	0	0	112.3	L114 M115 V118 V134 F135 A214 V215 L216 T217 Q233 F234 T235	L114-W231 HydrophobicContact CD1-CD2 4.05Å; L114-W231 HydrophobicContact CD1-CG 3.97Å; L114-W231 HydrophobicContact CD2-CD2 3.68Å; L114-W231 HydrophobicContact CD2-CE3 3.66Å; L114-W231 HydrophobicContact CD2-CG 4.16Å; L114-W231 HydrophobicContact CD2-CH2 4.36Å; L114-W231 HydrophobicContact CD2-CZ2 4.38Å; L114-W231 HydrophobicContact CD2-CZ3 3.98Å; L114-W231 HydrophobicContact CG-CD2 4.31Å; M115-W231 HydrophobicContact CE-CH2 3.44Å; M115-W231 VanDerWaalsContact CE-CH2 3.44Å; M115-W231 HydrophobicContact CE-CZ2 3.82Å; M115-W231 HydrophobicContact CE-CZ3 4.01Å; V118-W231 HydrophobicContact CG2-CZ2 4.15Å; V134-W231 HydrophobicContact CG1-CH2 3.82Å; V134-W231 HydrophobicContact CG1-CZ2 4.14Å; F135-W231 HydrophobicContact CE1-CH2 4.22Å; F135-W231 HydrophobicContact CE1-CZ3 4.03Å; F135-W231 AromaticContact CZ-CH2 3.71Å; F135-W231 HydrophobicContact CZ-CH2 3.71Å; F135-W231 AromaticContact CZ-CZ3 3.94Å; F135-W231 HydrophobicContact CZ-CZ3 3.94Å; A214-W231 CarbonylContact O-C 3.59Å; V215-W231 HydrophobicContact CB-CB 4.45Å; V215-W231 HydrophobicContact CG1-CB 4.29Å; V215-W231 HydrophobicContact CG1-CG 4.3Å; L216-W231 HydrophobicContact CB-CD2 3.76Å; L216-W231 HydrophobicContact CB-CE3 3.76Å; L216-W231 HydrophobicContact CB-CG 4.38Å; L216-W231 HydrophobicContact CB-CH2 4.12Å; L216-W231 HydrophobicContact CB-CZ2 4.11Å; L216-W231 HydrophobicContact CB-CZ3 3.98Å; L216-W231 HydrophobicContact CD1-CE3 3.67Å; L216-W231 HydrophobicContact CD1-CH2 4.33Å; L216-W231 HydrophobicContact CD1-CZ3 3.6Å; L216-W231 HydrophobicContact CG-CD2 4.13Å; L216-W231 HydrophobicContact CG-CE3 3.76Å; L216-W231 HydrophobicContact CG-CZ3 4.11Å; T217-W231 HydrophobicContact CG2-CZ2 3.81Å; T217-W231 PolarHBondContact OG1-NE1 3.5Å; W231-Q233 VanDerWaalsContact C-N 3.31Å; W231-Q233 PolarHBondContact O-N 3.47Å; W231-F234 HydrophobicContact CE3-CB 4.49Å; W231-F234 HydrophobicContact CE3-CD1 4.02Å; W231-F234 AromaticContact CZ3-CD1 4Å; W231-F234 HydrophobicContact CZ3-CD1 4Å; W231-F234 HydrophobicContact CZ3-CE1 4.45Å; W231-F234 PolarHBondContact O-N 2.86Å; W231-F234 VanDerWaalsContact O-N 3.15Å; W231-T235 WeakPolarHBondContact O-CG2 3.28Å; W231-T235 PolarHBondContact O-N 3.35Å; W231-T235 PolarHBondContact O-OG1 2.98Å; W231-T235 VanDerWaalsContact O-OG1 3.05Å
232	E	96.3	Very high	97	Very high	27 Å²	27	44.8 Å²	44.8	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-45.6	-179.8	-66.3	86.7	165.2	0	0	111.3	V215 K227 E228 G230 F234 T235 D236 Y257 K261	V215-E232 HydrophobicContact CG2-CG 4.43Å; V215-E232 WeakPolarHBondContact CG2-OE1 3.46Å; K227-E232 WeakPolarHBondContact CA-OE1 3.2Å; E228-E232 PolarHBondContact N-OE1 3.19Å; E228-E232 PolarHBondContact N-OE2 3.08Å; G230-E232 VanDerWaalsContact C-N 3.27Å; G230-E232 PolarHBondContact O-N 2.86Å; E232-F234 VanDerWaalsContact C-N 3.34Å; E232-T235 PolarHBondContact O-N 3.28Å; E232-T235 PolarHBondContact O-OG1 2.92Å; E232-D236 VanDerWaalsContact O-CB 3.31Å; E232-D236 WeakPolarHBondContact O-CB 3.39Å; E232-D236 PolarHBondContact O-N 2.79Å; E232-Y257 WeakPolarHBondContact CG-OH 3.45Å; E232-K261 PolarHBondContact O-NZ 3.38Å
233	Q	97.6	Very high	97.1	Very high	98 Å²	98	41.7 Å²	41.7	46%	0.458	22%	0.216	S	C	.	.	H	α-helix	trans	-64.4	-39.9	177.3	-177.2	174	2.1	0	0	111.6	Y110 G230 W231 D236 A237	Y110-Q233 VanDerWaalsContact CD1-CD 3.44Å; Y110-Q233 HydrophobicContact CD1-CG 4.25Å; Y110-Q233 HydrophobicContact CD2-CB 4.05Å; Y110-Q233 HydrophobicContact CD2-CG 4.11Å; Y110-Q233 HydrophobicContact CE1-CG 3.94Å; Y110-Q233 HydrophobicContact CE2-CB 3.83Å; Y110-Q233 HydrophobicContact CE2-CG 3.84Å; Y110-Q233 HydrophobicContact CG-CG 4.32Å; G230-Q233 PolarHBondContact O-N 3.48Å; W231-Q233 VanDerWaalsContact C-N 3.31Å; W231-Q233 PolarHBondContact O-N 3.47Å; Q233-D236 PolarHBondContact O-N 3.43Å; Q233-A237 PolarHBondContact O-N 3.47Å; Q233-A237 VanDerWaalsContact O-N 3.09Å
234	F	98.1	Very high	97.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.8	-46.7	176.7	178.5	-108.8	0	0	0	111.8	F94 L102 E105 F106 Y110 F111 F135 W137 L216 G230 W231 E232 D236 A237 V238	F94-F234 HydrophobicContact CE2-CE1 4.45Å; F94-F234 AromaticContact CE2-CZ 3.83Å; F94-F234 HydrophobicContact CE2-CZ 3.83Å; F94-F234 AromaticContact CZ-CZ 3.89Å; F94-F234 HydrophobicContact CZ-CZ 3.89Å; L102-F234 HydrophobicContact CD1-CZ 4.46Å; E105-F234 HydrophobicContact CB-CD2 3.86Å; E105-F234 HydrophobicContact CB-CE2 3.98Å; E105-F234 HydrophobicContact CG-CD2 4.07Å; E105-F234 HydrophobicContact CG-CE2 4.24Å; F106-F234 HydrophobicContact CD1-CE2 4.46Å; F106-F234 AromaticContact CE1-CE2 3.85Å; F106-F234 HydrophobicContact CE1-CE2 3.85Å; F106-F234 HydrophobicContact CE1-CZ 4.16Å; Y110-F234 HydrophobicContact CE2-CB 4.06Å; Y110-F234 WeakPolarHBondContact OH-CA 3.26Å; F111-F234 HydrophobicContact CD2-CB 4.34Å; F111-F234 AromaticContact CD2-CD2 3.72Å; F111-F234 HydrophobicContact CD2-CD2 3.72Å; F111-F234 HydrophobicContact CD2-CE2 4.31Å; F111-F234 HydrophobicContact CD2-CG 4.12Å; F111-F234 HydrophobicContact CE2-CB 4.45Å; F111-F234 HydrophobicContact CE2-CD1 4.34Å; F111-F234 AromaticContact CE2-CD2 3.52Å; F111-F234 HydrophobicContact CE2-CD2 3.52Å; F111-F234 AromaticContact CE2-CE2 3.77Å; F111-F234 HydrophobicContact CE2-CE2 3.77Å; F111-F234 AromaticContact CE2-CG 3.84Å; F111-F234 HydrophobicContact CE2-CG 3.84Å; F111-F234 HydrophobicContact CE2-CZ 4.26Å; F135-F234 AromaticContact CE1-CE1 3.89Å; F135-F234 HydrophobicContact CE1-CE1 3.89Å; F135-F234 HydrophobicContact CE1-CZ 4.32Å; W137-F234 HydrophobicContact CH2-CE1 4.19Å; W137-F234 HydrophobicContact CH2-CZ 4.49Å; W137-F234 AromaticContact CZ2-CE1 3.93Å; W137-F234 HydrophobicContact CZ2-CE1 3.93Å; L216-F234 HydrophobicContact CD1-CD1 4.19Å; L216-F234 HydrophobicContact CD1-CE1 4.2Å; G230-F234 PolarHBondContact O-N 3.21Å; W231-F234 HydrophobicContact CE3-CB 4.49Å; W231-F234 HydrophobicContact CE3-CD1 4.02Å; W231-F234 AromaticContact CZ3-CD1 4Å; W231-F234 HydrophobicContact CZ3-CD1 4Å; W231-F234 HydrophobicContact CZ3-CE1 4.45Å; W231-F234 PolarHBondContact O-N 2.86Å; W231-F234 VanDerWaalsContact O-N 3.15Å; E232-F234 VanDerWaalsContact C-N 3.34Å; F234-D236 VanDerWaalsContact C-N 3.3Å; F234-D236 PolarHBondContact O-N 3.08Å; F234-A237 VanDerWaalsContact O-CB 3.32Å; F234-A237 WeakPolarHBondContact O-CB 3.22Å; F234-A237 PolarHBondContact O-N 3.45Å; F234-A237 VanDerWaalsContact O-N 3.1Å; F234-V238 HydrophobicContact CE1-CG2 4.4Å; F234-V238 PolarHBondContact O-N 3.35Å; F234-V238 VanDerWaalsContact O-N 3.17Å
235	T	97.4	Very high	97.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-73.2	-24.4	179.4	58.6	0	0	0	0	112.1	L212 N213 A214 L216 W231 E232 A237 V238 V239 K261	L212-T235 HydrophobicContact CD1-CG2 4.15Å; L212-T235 HydrophobicContact CD2-CG2 4.5Å; L212-T235 HydrophobicContact CG-CG2 4.46Å; N213-T235 WeakPolarHBondContact O-CG2 3.16Å; A214-T235 WeakPolarHBondContact O-CG2 3.42Å; A214-T235 PolarHBondContact O-OG1 2.97Å; L216-T235 HydrophobicContact CD1-CG2 4.14Å; L216-T235 HydrophobicContact CD2-CG2 4.09Å; L216-T235 HydrophobicContact CG-CG2 3.99Å; W231-T235 WeakPolarHBondContact O-CG2 3.28Å; W231-T235 PolarHBondContact O-N 3.35Å; W231-T235 PolarHBondContact O-OG1 2.98Å; W231-T235 VanDerWaalsContact O-OG1 3.05Å; E232-T235 PolarHBondContact O-N 3.28Å; E232-T235 PolarHBondContact O-OG1 2.92Å; T235-A237 VanDerWaalsContact C-N 3.35Å; T235-V238 WeakPolarHBondContact O-CB 3.24Å; T235-V238 PolarHBondContact O-N 3.25Å; T235-V239 WeakPolarHBondContact O-CG2 3.19Å; T235-V239 PolarHBondContact O-N 3.48Å; T235-K261 WeakPolarHBondContact OG1-CE 3.38Å; T235-K261 PolarHBondContact OG1-NZ 2.91Å
236	D	96.9	Very high	97.6	Very high	72 Å²	72	46.1 Å²	46.1	39%	0.385	23%	0.227	S	C	.	.	H	α-helix	trans	-63	-40.7	165.8	-76.4	-25.4	0	0	0	111.1	E232 Q233 F234 V238 V239 S240 K261	E232-D236 VanDerWaalsContact O-CB 3.31Å; E232-D236 WeakPolarHBondContact O-CB 3.39Å; E232-D236 PolarHBondContact O-N 2.79Å; Q233-D236 PolarHBondContact O-N 3.43Å; F234-D236 VanDerWaalsContact C-N 3.3Å; F234-D236 PolarHBondContact O-N 3.08Å; D236-V238 VanDerWaalsContact C-N 3.3Å; D236-V238 PolarHBondContact O-N 2.93Å; D236-V239 PolarHBondContact O-N 2.7Å; D236-S240 WeakPolarHBondContact O-CB 3.15Å; D236-S240 PolarHBondContact O-N 3.26Å; D236-K261 VanDerWaalsContact CG-NZ 3.31Å; D236-K261 IonicContact OD1-NZ 4Å; D236-K261 PolarHBondContact OD1-NZ 3.48Å; D236-K261 IonicContact OD2-NZ 3.64Å
237	A	98	Very high	97.5	Very high	21 Å²	21	51.2 Å²	51.2	17%	0.174	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-37.8	174.9	0	0	0	0	0	111.8	E105 Q233 F234 T235 W241	E105-A237 HydrophobicContact CG-CB 3.84Å; Q233-A237 PolarHBondContact O-N 3.47Å; Q233-A237 VanDerWaalsContact O-N 3.09Å; F234-A237 VanDerWaalsContact O-CB 3.32Å; F234-A237 WeakPolarHBondContact O-CB 3.22Å; F234-A237 PolarHBondContact O-N 3.45Å; F234-A237 VanDerWaalsContact O-N 3.1Å; T235-A237 VanDerWaalsContact C-N 3.35Å; A237-W241 WeakPolarHBondContact O-CB 3.42Å; A237-W241 PolarHBondContact O-N 2.93Å
238	V	98.2	Very high	97.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-52.4	173.7	-179.5	0	0	0	0	111.3	W98 L102 W137 L210 L212 F234 T235 D236 S240 W241 L242	W98-V238 HydrophobicContact CZ3-CG1 3.89Å; L102-V238 HydrophobicContact CD1-CG2 3.83Å; L102-V238 HydrophobicContact CD2-CG2 4.19Å; W137-V238 HydrophobicContact CH2-CG1 4.47Å; W137-V238 HydrophobicContact CH2-CG2 3.75Å; W137-V238 HydrophobicContact CZ3-CG1 4.1Å; W137-V238 HydrophobicContact CZ3-CG2 4.2Å; L210-V238 HydrophobicContact CD2-CG1 4.31Å; L212-V238 HydrophobicContact CD2-CB 4.13Å; L212-V238 HydrophobicContact CD2-CG1 3.87Å; F234-V238 HydrophobicContact CE1-CG2 4.4Å; F234-V238 PolarHBondContact O-N 3.35Å; F234-V238 VanDerWaalsContact O-N 3.17Å; T235-V238 WeakPolarHBondContact O-CB 3.24Å; T235-V238 PolarHBondContact O-N 3.25Å; D236-V238 VanDerWaalsContact C-N 3.3Å; D236-V238 PolarHBondContact O-N 2.93Å; V238-S240 VanDerWaalsContact C-N 3.35Å; V238-S240 PolarHBondContact O-N 3.36Å; V238-W241 PolarHBondContact O-N 3.44Å; V238-L242 HydrophobicContact CG1-CD1 4.28Å; V238-L242 PolarHBondContact O-N 3.49Å; V238-L242 VanDerWaalsContact O-N 3.11Å
239	V	97	Very high	97.7	Very high	8 Å²	8	38.8 Å²	38.8	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-42.9	-179.8	172.7	0	0	0	0	111	L151 L212 T235 D236 L242 N243 F251 K261 I265	L151-V239 HydrophobicContact CD1-CG2 4.23Å; L151-V239 HydrophobicContact CD2-CG2 4.13Å; L212-V239 HydrophobicContact CD2-CG2 4.46Å; T235-V239 WeakPolarHBondContact O-CG2 3.19Å; T235-V239 PolarHBondContact O-N 3.48Å; D236-V239 PolarHBondContact O-N 2.7Å; V239-L242 PolarHBondContact O-N 3.21Å; V239-N243 VanDerWaalsContact O-CB 3.3Å; V239-N243 WeakPolarHBondContact O-CB 3.42Å; V239-N243 PolarHBondContact O-N 3.16Å; V239-F251 HydrophobicContact CG1-CE1 4.24Å; V239-K261 HydrophobicContact CG2-CD 4.48Å; V239-I265 HydrophobicContact CG1-CG1 4.26Å
240	S	97.8	Very high	97.7	Very high	49 Å²	49	32.4 Å²	32.4	34%	0.343	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-44.8	177.3	-175.9	0	0	0	0	111.7	D236 V238 L242 N243 Q244	D236-S240 WeakPolarHBondContact O-CB 3.15Å; D236-S240 PolarHBondContact O-N 3.26Å; V238-S240 VanDerWaalsContact C-N 3.35Å; V238-S240 PolarHBondContact O-N 3.36Å; S240-L242 PolarHBondContact O-N 2.86Å; S240-N243 WeakPolarHBondContact O-CB 3.47Å; S240-N243 PolarHBondContact O-N 2.63Å; S240-Q244 WeakPolarHBondContact O-CB 3.25Å; S240-Q244 WeakPolarHBondContact O-CG 3.3Å; S240-Q244 PolarHBondContact O-N 3.49Å
241	W	98.4	Very high	97.8	Very high	32 Å²	32	31.8 Å²	31.8	12%	0.121	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-47.1	177	-172.4	93.8	0	0	0	111.3	H101 I143 A237 V238 N243 Q244 N245	H101-W241 HydrophobicContact CB-CD2 4.32Å; H101-W241 HydrophobicContact CB-CZ2 3.85Å; H101-W241 AromaticContact CD2-CZ2 3.54Å; H101-W241 AromaticContact CE1-CZ2 3.85Å; H101-W241 AromaticContact CG-CE2 3.63Å; H101-W241 AromaticContact CG-CZ2 3.35Å; H101-W241 AromaticContact CG-NE1 3.73Å; H101-W241 AromaticContact ND1-CE2 3.87Å; H101-W241 AromaticContact ND1-CZ2 3.57Å; H101-W241 AromaticContact ND1-NE1 3.71Å; H101-W241 AromaticContact NE2-CZ2 3.86Å; I143-W241 HydrophobicContact CB-CZ3 4.43Å; I143-W241 HydrophobicContact CD1-CD2 3.91Å; I143-W241 HydrophobicContact CD1-CE3 3.4Å; I143-W241 VanDerWaalsContact CD1-CE3 3.4Å; I143-W241 HydrophobicContact CD1-CH2 3.91Å; I143-W241 HydrophobicContact CD1-CZ2 4.35Å; I143-W241 HydrophobicContact CD1-CZ3 3.44Å; I143-W241 VanDerWaalsContact CD1-CZ3 3.44Å; I143-W241 HydrophobicContact CG1-CE3 3.86Å; I143-W241 HydrophobicContact CG1-CH2 4.03Å; I143-W241 HydrophobicContact CG1-CZ3 3.45Å; I143-W241 VanDerWaalsContact CG1-CZ3 3.45Å; I143-W241 HydrophobicContact CG2-CH2 3.95Å; I143-W241 HydrophobicContact CG2-CZ3 4.25Å; A237-W241 WeakPolarHBondContact O-CB 3.42Å; A237-W241 PolarHBondContact O-N 2.93Å; V238-W241 PolarHBondContact O-N 3.44Å; W241-N243 PolarHBondContact O-N 2.9Å; W241-Q244 PolarHBondContact O-N 3.4Å; W241-N245 HydrophobicContact CD2-CB 4.08Å; W241-N245 HydrophobicContact CE3-CB 4.19Å; W241-N245 HydrophobicContact CH2-CB 3.94Å; W241-N245 HydrophobicContact CZ2-CB 3.82Å; W241-N245 HydrophobicContact CZ3-CB 4.1Å; W241-N245 VanDerWaalsContact O-CB 3.28Å; W241-N245 WeakPolarHBondContact O-CB 3.32Å; W241-N245 PolarHBondContact O-N 3.05Å; W241-N245 PolarHBondContact O-ND2 3.39Å
242	L	98.3	Very high	97.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-44	178	-71.7	167.5	0	0	0	111.9	I143 V146 V149 L210 V238 V239 S240 Q244 N245 S246 L249	I143-L242 HydrophobicContact CG1-CD2 4.25Å; V146-L242 HydrophobicContact CB-CD2 4.17Å; V146-L242 HydrophobicContact CG1-CD2 4.26Å; V146-L242 HydrophobicContact CG2-CD2 4.37Å; V149-L242 HydrophobicContact CG2-CD1 4.05Å; L210-L242 HydrophobicContact CD2-CD1 3.52Å; V238-L242 HydrophobicContact CG1-CD1 4.28Å; V238-L242 PolarHBondContact O-N 3.49Å; V238-L242 VanDerWaalsContact O-N 3.11Å; V239-L242 PolarHBondContact O-N 3.21Å; S240-L242 PolarHBondContact O-N 2.86Å; L242-Q244 VanDerWaalsContact C-N 3.27Å; L242-Q244 PolarHBondContact O-N 2.97Å; L242-N245 PolarHBondContact O-N 2.86Å; L242-S246 VanDerWaalsContact O-CB 3.25Å; L242-S246 WeakPolarHBondContact O-CB 3.4Å; L242-S246 PolarHBondContact O-N 3.18Å; L242-L249 HydrophobicContact CB-CD1 3.92Å; L242-L249 HydrophobicContact CD2-CD1 4.39Å
243	N	97.8	Very high	97.9	Very high	22 Å²	22	30.4 Å²	30.4	12%	0.118	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-35.8	177.1	-172.2	47.7	0	0	0	112.6	V239 S240 W241 A264 D266 R269 H270	V239-N243 VanDerWaalsContact O-CB 3.3Å; V239-N243 WeakPolarHBondContact O-CB 3.42Å; V239-N243 PolarHBondContact O-N 3.16Å; S240-N243 WeakPolarHBondContact O-CB 3.47Å; S240-N243 PolarHBondContact O-N 2.63Å; W241-N243 PolarHBondContact O-N 2.9Å; N243-A264 PolarHBondContact ND2-O 3.03Å; N243-D266 PolarHBondContact OD1-N 2.86Å; N243-R269 PolarHBondContact O-NH1 3.34Å; N243-H270 WeakPolarHBondContact CA-NE2 3.41Å; N243-H270 PolarHBondContact O-NE2 3.31Å; N243-H270 PolarHBondContact OD1-CD2 2.95Å
244	Q	97.9	Very high	97.8	Very high	119 Å²	119	26 Å²	26	56%	0.556	14%	0.141	S	C	*	.	H	α-helix	trans	-89	-26.2	-177.3	-69.8	176.2	-4.4	0	0	113.8	S240 W241 L242 R269	S240-Q244 WeakPolarHBondContact O-CB 3.25Å; S240-Q244 WeakPolarHBondContact O-CG 3.3Å; S240-Q244 PolarHBondContact O-N 3.49Å; W241-Q244 PolarHBondContact O-N 3.4Å; L242-Q244 VanDerWaalsContact C-N 3.27Å; L242-Q244 PolarHBondContact O-N 2.97Å; Q244-R269 VanDerWaalsContact C-NH1 3.31Å; Q244-R269 VanDerWaalsContact C-NH2 3.33Å; Q244-R269 PolarHBondContact O-NH1 3.11Å; Q244-R269 PolarHBondContact O-NH2 2.73Å
245	N	98	Very high	97.7	Very high	90 Å²	90	26.5 Å²	26.5	48%	0.481	15%	0.147	S	C	.	.	H	α-helix	trans	-115.7	-10.2	-168.2	-64.2	-90.6	0	0	0	114.1	W241 L242	W241-N245 HydrophobicContact CD2-CB 4.08Å; W241-N245 HydrophobicContact CE3-CB 4.19Å; W241-N245 HydrophobicContact CH2-CB 3.94Å; W241-N245 HydrophobicContact CZ2-CB 3.82Å; W241-N245 HydrophobicContact CZ3-CB 4.1Å; W241-N245 VanDerWaalsContact O-CB 3.28Å; W241-N245 WeakPolarHBondContact O-CB 3.32Å; W241-N245 PolarHBondContact O-N 3.05Å; W241-N245 PolarHBondContact O-ND2 3.39Å; L242-N245 PolarHBondContact O-N 2.86Å
246	S	96.9	Very high	97.4	Very high	16 Å²	16	31.2 Å²	31.2	11%	0.112	18%	0.18	C	C	.	.			trans	-113.7	171.4	177	-55.4	0	0	0	0	111	L242 R269 H270	L242-S246 VanDerWaalsContact O-CB 3.25Å; L242-S246 WeakPolarHBondContact O-CB 3.4Å; L242-S246 PolarHBondContact O-N 3.18Å; S246-R269 PolarHBondContact O-NE 3.4Å; S246-R269 PolarHBondContact O-NH2 2.95Å; S246-H270 PolarHBondContact O-CE1 3.41Å; S246-H270 VanDerWaalsContact O-CE1 3.24Å
247	N	96.6	Very high	97	Very high	107 Å²	107	31.2 Å²	31.2	57%	0.572	18%	0.175	S	C	*	.	S	Bend	trans	-138.2	147.8	175.6	-169.9	28.4	0	0	0	110.7	L249 R269 K305	N247-L249 VanDerWaalsContact C-N 3.29Å; N247-L249 PolarHBondContact O-N 3.41Å; N247-R269 VanDerWaalsContact OD1-CG 3.28Å; N247-R269 WeakPolarHBondContact OD1-CG 3.48Å; N247-R269 PolarHBondContact OD1-O 2.8Å; N247-K305 WeakPolarHBondContact O-CE 3.17Å; N247-K305 PolarHBondContact O-NZ 3.13Å
248	G	97.8	Very high	96.8	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.031	17%	0.168	C	C	.	.	S	Bend	trans	59.1	36.9	176.3	0	0	0	0	0	113.5	R269 K305	G248-R269 WeakPolarHBondContact CA-O 3.43Å; G248-R269 PolarHBondContact N-O 3.26Å; G248-K305 VanDerWaalsContact C-NZ 3.26Å; G248-K305 WeakPolarHBondContact O-CE 3.26Å; G248-K305 PolarHBondContact O-NZ 2.81Å
249	L	98.7	Very high	96.6	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	18%	0.181	C	C	.	.			trans	-76.7	152.4	171.4	-58.9	177.8	0	0	0	109.5	V146 K147 L242 N247 F251 H270 H271	V146-L249 HydrophobicContact CG1-CD2 4.45Å; V146-L249 WeakPolarHBondContact O-CD2 3.48Å; K147-L249 WeakPolarHBondContact O-CA 3.34Å; L242-L249 HydrophobicContact CB-CD1 3.92Å; L242-L249 HydrophobicContact CD2-CD1 4.39Å; N247-L249 VanDerWaalsContact C-N 3.29Å; N247-L249 PolarHBondContact O-N 3.41Å; L249-F251 HydrophobicContact CB-CD2 4.24Å; L249-F251 HydrophobicContact CB-CE2 3.77Å; L249-F251 HydrophobicContact CB-CZ 4.42Å; L249-F251 HydrophobicContact CD1-CE2 4.09Å; L249-F251 HydrophobicContact CD1-CZ 3.97Å; L249-H270 WeakPolarHBondContact CB-ND1 3.45Å; L249-H270 PolarHBondContact N-ND1 2.81Å; L249-H271 PolarHBondContact O-N 2.82Å
250	V	98.8	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.8	170.4	-173.3	0	0	0	0	109.2	K147 V148 V149 L252 H271 L273 T296 L299 L300	K147-V250 PolarHBondContact O-N 2.99Å; K147-V250 VanDerWaalsContact O-N 3.1Å; V148-V250 CarbonylContact C-O 3.58Å; V148-V250 VanDerWaalsContact CA-O 3.29Å; V148-V250 WeakPolarHBondContact CA-O 3.17Å; V148-V250 WeakPolarHBondContact CG1-O 3.5Å; V149-V250 PolarHBondContact N-O 3.5Å; V250-L252 HydrophobicContact CG1-CD2 3.9Å; V250-H271 WeakPolarHBondContact CA-O 3.49Å; V250-H271 HydrophobicContact CG2-CB 4.28Å; V250-L273 HydrophobicContact CG1-CD1 4.23Å; V250-L273 HydrophobicContact CG1-CG 4.43Å; V250-T296 HydrophobicContact CB-CG2 4.01Å; V250-T296 HydrophobicContact CG1-CG2 4.01Å; V250-T296 HydrophobicContact CG2-CG2 4.18Å; V250-L299 HydrophobicContact CG1-CD1 4.24Å; V250-L299 HydrophobicContact CG2-CB 3.82Å; V250-L299 HydrophobicContact CG2-CD1 4.46Å; V250-L300 HydrophobicContact CG2-CD2 4.01Å; V250-L300 HydrophobicContact CG2-CG 4.11Å
251	F	98.8	Very high	95.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122	176.3	-69.7	-96.8	0	0	0	110.4	V149 V239 L249 L253 I265 H270 H271 V272 L273	V149-F251 HydrophobicContact CB-CD1 3.55Å; V149-F251 HydrophobicContact CB-CE1 3.79Å; V149-F251 HydrophobicContact CB-CG 4.29Å; V149-F251 HydrophobicContact CG1-CD1 3.88Å; V149-F251 HydrophobicContact CG1-CE1 4.01Å; V149-F251 HydrophobicContact CG2-CD1 3.98Å; V149-F251 HydrophobicContact CG2-CE1 3.71Å; V149-F251 HydrophobicContact CG2-CZ 4.24Å; V149-F251 CarbonylContact O-C 3.59Å; V149-F251 WeakPolarHBondContact O-CA 3.41Å; V239-F251 HydrophobicContact CG1-CE1 4.24Å; L249-F251 HydrophobicContact CB-CD2 4.24Å; L249-F251 HydrophobicContact CB-CE2 3.77Å; L249-F251 HydrophobicContact CB-CZ 4.42Å; L249-F251 HydrophobicContact CD1-CE2 4.09Å; L249-F251 HydrophobicContact CD1-CZ 3.97Å; F251-L253 HydrophobicContact CB-CD2 4.22Å; F251-L253 HydrophobicContact CB-CG 4.48Å; F251-I265 HydrophobicContact CB-CD1 3.89Å; F251-I265 HydrophobicContact CD1-CD1 3.44Å; F251-I265 VanDerWaalsContact CD1-CD1 3.44Å; F251-I265 HydrophobicContact CD1-CG1 4.38Å; F251-I265 HydrophobicContact CD2-CD1 3.94Å; F251-I265 HydrophobicContact CD2-CG2 3.86Å; F251-I265 HydrophobicContact CE1-CD1 3.85Å; F251-I265 HydrophobicContact CE1-CG1 4.33Å; F251-I265 HydrophobicContact CE2-CD1 4.29Å; F251-I265 HydrophobicContact CE2-CG1 4.48Å; F251-I265 HydrophobicContact CE2-CG2 3.8Å; F251-I265 HydrophobicContact CG-CD1 3.5Å; F251-I265 VanDerWaalsContact CG-CD1 3.5Å; F251-I265 HydrophobicContact CG-CG1 4.5Å; F251-I265 HydrophobicContact CZ-CD1 4.25Å; F251-I265 HydrophobicContact CZ-CG1 4.38Å; F251-I265 HydrophobicContact CZ-CG2 4.43Å; F251-H270 HydrophobicContact CD2-CB 3.97Å; F251-H270 HydrophobicContact CE2-CB 3.77Å; F251-H270 AromaticContact CE2-CG 3.77Å; F251-H270 AromaticContact CE2-ND1 3.93Å; F251-H271 PolarHBondContact N-O 3.07Å; F251-V272 HydrophobicContact CB-CG2 4.37Å; F251-L273 PolarHBondContact O-N 3.39Å
252	L	98.7	Very high	95.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	106.5	175.2	-52.7	-170.2	0	0	0	109.3	V148 V149 I150 L151 V250 W254 L273 H292 T296	V148-L252 HydrophobicContact CG1-CD1 4.22Å; V148-L252 HydrophobicContact CG1-CG 4.15Å; V149-L252 PolarHBondContact O-N 3.22Å; I150-L252 HydrophobicContact CD1-CD1 4.05Å; I150-L252 HydrophobicContact CG1-CB 4.21Å; I150-L252 HydrophobicContact CG1-CD1 4.01Å; I150-L252 HydrophobicContact CG1-CG 4.33Å; L151-L252 PolarHBondContact N-O 2.83Å; V250-L252 HydrophobicContact CG1-CD2 3.9Å; L252-W254 HydrophobicContact CB-CZ2 4.23Å; L252-W254 HydrophobicContact CD1-CZ2 3.8Å; L252-L273 HydrophobicContact CD2-CB 3.84Å; L252-L273 HydrophobicContact CD2-CD1 3.81Å; L252-L273 HydrophobicContact CD2-CG 4.22Å; L252-H292 HydrophobicContact CD1-CB 4.37Å; L252-H292 HydrophobicContact CD2-CB 4.24Å; L252-T296 WeakPolarHBondContact CD2-OG1 3.36Å
253	L	97.5	Very high	95.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	92	-174.9	-50.4	-175.5	0	0	0	110.1	L151 F251 A258 Q259 I265 V272 L273 Q274 T275	L151-L253 HydrophobicContact CB-CD2 4.4Å; L151-L253 HydrophobicContact CD1-CD2 3.73Å; L151-L253 HydrophobicContact CG-CD2 4.21Å; F251-L253 HydrophobicContact CB-CD2 4.22Å; F251-L253 HydrophobicContact CB-CG 4.48Å; L253-A258 HydrophobicContact CB-CB 4.22Å; L253-Q259 HydrophobicContact CB-CG 4.09Å; L253-I265 HydrophobicContact CD1-CD1 4.45Å; L253-V272 HydrophobicContact CD1-CG1 3.41Å; L253-V272 VanDerWaalsContact CD1-CG1 3.41Å; L253-V272 HydrophobicContact CG-CG1 3.96Å; L253-L273 PolarHBondContact N-O 2.98Å; L253-Q274 HydrophobicContact CB-CG 4.18Å; L253-Q274 HydrophobicContact CD1-CG 4.22Å; L253-Q274 WeakPolarHBondContact O-CA 3.47Å; L253-T275 PolarHBondContact O-N 3.13Å
254	W	97.2	Very high	95	Very high	5 Å²	5	45.2 Å²	45.2	2%	0.019	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	110.1	-176.4	-58.6	-27.5	0	0	0	111.7	I150 F167 I182 L252 T275 P278 F287 H292 F293	I150-W254 HydrophobicContact CD1-CH2 3.97Å; I150-W254 HydrophobicContact CD1-CZ3 4.45Å; I150-W254 HydrophobicContact CG2-CD2 4.4Å; I150-W254 HydrophobicContact CG2-CE3 3.8Å; I150-W254 HydrophobicContact CG2-CH2 4Å; I150-W254 HydrophobicContact CG2-CZ3 3.57Å; F167-W254 HydrophobicContact CD2-CE3 4.43Å; F167-W254 HydrophobicContact CD2-CZ3 4.16Å; F167-W254 AromaticContact CE2-CE3 3.71Å; F167-W254 HydrophobicContact CE2-CE3 3.71Å; F167-W254 AromaticContact CE2-CZ3 3.89Å; F167-W254 HydrophobicContact CE2-CZ3 3.89Å; F167-W254 AromaticContact CZ-CE3 3.92Å; F167-W254 HydrophobicContact CZ-CE3 3.92Å; F167-W254 HydrophobicContact CZ-CZ3 4.42Å; I182-W254 HydrophobicContact CD1-CH2 4.46Å; I182-W254 HydrophobicContact CD1-CZ3 3.77Å; I182-W254 HydrophobicContact CG1-CH2 4.4Å; I182-W254 HydrophobicContact CG1-CZ3 4.05Å; L252-W254 HydrophobicContact CB-CZ2 4.23Å; L252-W254 HydrophobicContact CD1-CZ2 3.8Å; W254-T275 HydrophobicContact CG-CG2 4.48Å; W254-P278 HydrophobicContact CE3-CG 4.25Å; W254-F287 HydrophobicContact CD2-CD2 4.47Å; W254-F287 AromaticContact CD2-CE2 3.78Å; W254-F287 HydrophobicContact CD2-CE2 3.78Å; W254-F287 AromaticContact CE2-CE2 3.74Å; W254-F287 HydrophobicContact CE3-CE2 4.09Å; W254-F287 HydrophobicContact CG-CD2 4.41Å; W254-F287 HydrophobicContact CG-CE2 4.17Å; W254-F287 HydrophobicContact CH2-CE2 4.35Å; W254-F287 HydrophobicContact CZ2-CE2 4.04Å; W254-F287 HydrophobicContact CZ3-CE2 4.37Å; W254-H292 AromaticContact CD1-CE1 3.93Å; W254-H292 AromaticContact CD1-ND1 3.78Å; W254-H292 AromaticContact NE1-CE1 3.65Å; W254-H292 AromaticContact NE1-CG 3.93Å; W254-H292 AromaticContact NE1-ND1 3.05Å; W254-H292 PolarHBondContact NE1-ND1 2.87Å; W254-F293 HydrophobicContact CH2-CE1 4.26Å; W254-F293 AromaticContact CH2-CZ 3.99Å; W254-F293 HydrophobicContact CH2-CZ 3.99Å; W254-F293 HydrophobicContact CZ2-CE1 4.46Å; W254-F293 HydrophobicContact CZ2-CZ 4.13Å
255	G	94.3	Very high	94.9	Very high	11 Å²	11	40 Å²	40	11%	0.113	23%	0.228	C	C	.	.	S	Bend	trans	89	163.3	-177.6	0	0	0	0	0	114.3	Y257 A258 Q259 T275	G255-Y257 VanDerWaalsContact C-N 3.29Å; G255-Y257 PolarHBondContact O-N 3.25Å; G255-A258 PolarHBondContact O-N 2.93Å; G255-Q259 WeakPolarHBondContact O-CG 3.21Å; G255-Q259 PolarHBondContact O-N 3.46Å; G255-T275 PolarHBondContact N-O 3.24Å
256	S	91.5	Very high	94.9	Very high	98 Å²	98	39.2 Å²	39.2	69%	0.685	22%	0.224	S	C	*	.	H	α-helix	trans	-59.2	-36.4	-171.7	54.3	0	0	0	0	113.7	Q259 K260	S256-Q259 PolarHBondContact O-N 3.46Å; S256-K260 WeakPolarHBondContact O-CB 3.31Å; S256-K260 PolarHBondContact O-N 2.96Å
257	Y	89.8	Confident	94.9	Very high	73 Å²	73	45.6 Å²	45.6	29%	0.286	25%	0.246	S	C	.	.	H	α-helix	trans	-64.1	-51.7	179.5	-165.3	-72	0	0	0	111.4	Q153 A214 E232 G255 Q259 K260 K261	Q153-Y257 HydrophobicContact CG-CD1 4.47Å; Q153-Y257 HydrophobicContact CG-CD2 4.15Å; Q153-Y257 HydrophobicContact CG-CG 4.11Å; A214-Y257 HydrophobicContact CB-CD1 4.04Å; A214-Y257 HydrophobicContact CB-CE1 3.2Å; E232-Y257 WeakPolarHBondContact CG-OH 3.45Å; G255-Y257 VanDerWaalsContact C-N 3.29Å; G255-Y257 PolarHBondContact O-N 3.25Å; Y257-Q259 VanDerWaalsContact C-N 3.29Å; Y257-Q259 PolarHBondContact O-N 3.27Å; Y257-K260 PolarHBondContact O-N 3.34Å; Y257-K261 PolarHBondContact O-N 3.36Å
258	A	92	Very high	95	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-40.1	177.2	0	0	0	0	0	111.5	L151 L253 G255 K260 K261 G262	L151-A258 HydrophobicContact CB-CB 3.97Å; L151-A258 WeakPolarHBondContact O-CB 3.34Å; L253-A258 HydrophobicContact CB-CB 4.22Å; G255-A258 PolarHBondContact O-N 2.93Å; A258-K260 PolarHBondContact O-N 2.89Å; A258-K261 PolarHBondContact O-N 3.43Å; A258-G262 PolarHBondContact O-N 3.07Å
259	Q	94.1	Very high	94.9	Very high	63 Å²	63	54.3 Å²	54.3	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-62.6	-40.9	176.8	-67	167.4	9.8	0	0	112.3	L253 G255 S256 Y257 G262 S263 Q274 T275	L253-Q259 HydrophobicContact CB-CG 4.09Å; G255-Q259 WeakPolarHBondContact O-CG 3.21Å; G255-Q259 PolarHBondContact O-N 3.46Å; S256-Q259 PolarHBondContact O-N 3.46Å; Y257-Q259 VanDerWaalsContact C-N 3.29Å; Y257-Q259 PolarHBondContact O-N 3.27Å; Q259-G262 PolarHBondContact O-N 3.39Å; Q259-S263 PolarHBondContact O-N 3.02Å; Q259-Q274 HydrophobicContact CG-CB 4.23Å; Q259-Q274 HydrophobicContact CG-CG 4.49Å; Q259-T275 PolarHBondContact NE2-O 3.35Å
260	K	92.3	Very high	94.9	Very high	169 Å²	169	54.4 Å²	54.4	74%	0.735	28%	0.276	S	S	*	.	H	α-helix	trans	-64.9	-45.6	175.9	-172.1	178.2	179.8	-177.7	0	111.4	S256 Y257 A258 G262 S263	S256-K260 WeakPolarHBondContact O-CB 3.31Å; S256-K260 PolarHBondContact O-N 2.96Å; Y257-K260 PolarHBondContact O-N 3.34Å; A258-K260 PolarHBondContact O-N 2.89Å; K260-G262 VanDerWaalsContact C-N 3.33Å; K260-G262 PolarHBondContact O-N 2.88Å; K260-S263 VanDerWaalsContact O-CB 3.28Å; K260-S263 WeakPolarHBondContact O-CB 3.34Å; K260-S263 PolarHBondContact O-N 3.23Å; K260-S263 PolarHBondContact O-OG 3.43Å
261	K	89.3	Confident	94.9	Very high	22 Å²	22	56.9 Å²	56.9	10%	0.096	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-39.3	177.3	179.8	172.8	-85.9	-70.9	0	112	L151 A214 E232 T235 D236 V239 Y257 A258 S263	L151-K261 HydrophobicContact CD1-CB 4.37Å; L151-K261 HydrophobicContact CD1-CD 3.91Å; L151-K261 HydrophobicContact CD1-CG 4Å; A214-K261 HydrophobicContact CB-CD 4.2Å; E232-K261 PolarHBondContact O-NZ 3.38Å; T235-K261 WeakPolarHBondContact OG1-CE 3.38Å; T235-K261 PolarHBondContact OG1-NZ 2.91Å; D236-K261 VanDerWaalsContact CG-NZ 3.31Å; D236-K261 IonicContact OD1-NZ 4Å; D236-K261 PolarHBondContact OD1-NZ 3.48Å; D236-K261 IonicContact OD2-NZ 3.64Å; V239-K261 HydrophobicContact CG2-CD 4.48Å; Y257-K261 PolarHBondContact O-N 3.36Å; A258-K261 PolarHBondContact O-N 3.43Å; K261-S263 VanDerWaalsContact C-N 3.27Å; K261-S263 PolarHBondContact O-N 3.45Å
262	G	91.1	Very high	94.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-80.7	5.4	177.6	0	0	0	0	0	115.6	A258 Q259 K260 A264 I265	A258-G262 PolarHBondContact O-N 3.07Å; Q259-G262 PolarHBondContact O-N 3.39Å; K260-G262 VanDerWaalsContact C-N 3.33Å; K260-G262 PolarHBondContact O-N 2.88Å; G262-A264 PolarHBondContact O-N 3.42Å; G262-I265 VanDerWaalsContact CA-CD1 3.46Å; G262-I265 WeakPolarHBondContact O-CB 3.34Å; G262-I265 WeakPolarHBondContact O-CD1 3.3Å; G262-I265 WeakPolarHBondContact O-CG1 3.44Å; G262-I265 PolarHBondContact O-N 2.73Å
263	S	92.1	Very high	94.9	Very high	88 Å²	88	59.7 Å²	59.7	62%	0.615	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-63.9	-26.8	-177.5	59.5	0	0	0	0	113.9	Q259 K260 K261	Q259-S263 PolarHBondContact O-N 3.02Å; K260-S263 VanDerWaalsContact O-CB 3.28Å; K260-S263 WeakPolarHBondContact O-CB 3.34Å; K260-S263 PolarHBondContact O-N 3.23Å; K260-S263 PolarHBondContact O-OG 3.43Å; K261-S263 VanDerWaalsContact C-N 3.27Å; K261-S263 PolarHBondContact O-N 3.45Å
264	A	91.8	Very high	94.9	Very high	81 Å²	81	63.3 Å²	63.3	67%	0.669	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-89.9	3.6	-179.6	0	0	0	0	0	114.4	N243 G262	N243-A264 PolarHBondContact ND2-O 3.03Å; G262-A264 PolarHBondContact O-N 3.42Å
265	I	96.6	Very high	95	Very high	9 Å²	9	64 Å²	64	5%	0.046	32%	0.324	C	S	.	.	S	Bend	trans	-70.7	132.6	178.7	-63	163.3	0	0	0	109.5	V239 F251 L253 G262 R267 H270 V272	V239-I265 HydrophobicContact CG1-CG1 4.26Å; F251-I265 HydrophobicContact CB-CD1 3.89Å; F251-I265 HydrophobicContact CD1-CD1 3.44Å; F251-I265 VanDerWaalsContact CD1-CD1 3.44Å; F251-I265 HydrophobicContact CD1-CG1 4.38Å; F251-I265 HydrophobicContact CD2-CD1 3.94Å; F251-I265 HydrophobicContact CD2-CG2 3.86Å; F251-I265 HydrophobicContact CE1-CD1 3.85Å; F251-I265 HydrophobicContact CE1-CG1 4.33Å; F251-I265 HydrophobicContact CE2-CD1 4.29Å; F251-I265 HydrophobicContact CE2-CG1 4.48Å; F251-I265 HydrophobicContact CE2-CG2 3.8Å; F251-I265 HydrophobicContact CG-CD1 3.5Å; F251-I265 VanDerWaalsContact CG-CD1 3.5Å; F251-I265 HydrophobicContact CG-CG1 4.5Å; F251-I265 HydrophobicContact CZ-CD1 4.25Å; F251-I265 HydrophobicContact CZ-CG1 4.38Å; F251-I265 HydrophobicContact CZ-CG2 4.43Å; L253-I265 HydrophobicContact CD1-CD1 4.45Å; G262-I265 VanDerWaalsContact CA-CD1 3.46Å; G262-I265 WeakPolarHBondContact O-CB 3.34Å; G262-I265 WeakPolarHBondContact O-CD1 3.3Å; G262-I265 WeakPolarHBondContact O-CG1 3.44Å; G262-I265 PolarHBondContact O-N 2.73Å; I265-R267 PolarHBondContact O-N 3.43Å; I265-R267 VanDerWaalsContact O-N 3.1Å; I265-H270 HydrophobicContact CG2-CB 3.91Å; I265-V272 HydrophobicContact CB-CG2 4.14Å; I265-V272 HydrophobicContact CD1-CG2 4.34Å; I265-V272 HydrophobicContact CG2-CG2 3.71Å
266	D	97.7	Very high	95.1	Very high	74 Å²	74	64.3 Å²	64.3	40%	0.396	33%	0.326	S	S	.	.			trans	-72.9	103.2	175.1	-177	-11.1	0	0	0	109.9	N243 K268 R269 H270	N243-D266 PolarHBondContact OD1-N 2.86Å; D266-K268 PolarHBondContact O-N 3.32Å; D266-K268 WeakPolarHBondContact OD1-CB 3.48Å; D266-K268 PolarHBondContact OD1-N 2.8Å; D266-R269 HydrophobicContact CB-CB 4.01Å; D266-R269 PolarHBondContact O-N 3.02Å; D266-R269 VanDerWaalsContact O-N 3.12Å; D266-R269 PolarHBondContact OD1-N 3.39Å; D266-H270 PolarHBondContact O-N 3.28Å
267	R	97.6	Very high	95.4	Very high	151 Å²	151	61.7 Å²	61.7	57%	0.57	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.5	-178.9	-59.8	-172.4	-177.4	-153.2	-5	114.1	I265 H270 V272	I265-R267 PolarHBondContact O-N 3.43Å; I265-R267 VanDerWaalsContact O-N 3.1Å; R267-H270 CarbonylContact C-O 3.55Å; R267-H270 WeakPolarHBondContact CA-O 3.16Å; R267-V272 HydrophobicContact CG-CG2 4.16Å
268	K	96.7	Very high	95.7	Very high	212 Å²	212	58.2 Å²	58.2	92%	0.922	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-27	170.5	-65.9	-175.1	176.2	-178.7	0	111.4	D266	D266-K268 PolarHBondContact O-N 3.32Å; D266-K268 WeakPolarHBondContact OD1-CB 3.48Å; D266-K268 PolarHBondContact OD1-N 2.8Å
269	R	97.4	Very high	95.9	Very high	81 Å²	81	59.3 Å²	59.3	31%	0.306	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-30.9	-178	-169.4	178.5	178.4	170.4	-2.2	113.1	N243 Q244 S246 N247 G248 D266	N243-R269 PolarHBondContact O-NH1 3.34Å; Q244-R269 VanDerWaalsContact C-NH1 3.31Å; Q244-R269 VanDerWaalsContact C-NH2 3.33Å; Q244-R269 PolarHBondContact O-NH1 3.11Å; Q244-R269 PolarHBondContact O-NH2 2.73Å; S246-R269 PolarHBondContact O-NE 3.4Å; S246-R269 PolarHBondContact O-NH2 2.95Å; N247-R269 VanDerWaalsContact OD1-CG 3.28Å; N247-R269 WeakPolarHBondContact OD1-CG 3.48Å; N247-R269 PolarHBondContact OD1-O 2.8Å; G248-R269 WeakPolarHBondContact CA-O 3.43Å; G248-R269 PolarHBondContact N-O 3.26Å; D266-R269 HydrophobicContact CB-CB 4.01Å; D266-R269 PolarHBondContact O-N 3.02Å; D266-R269 VanDerWaalsContact O-N 3.12Å; D266-R269 PolarHBondContact OD1-N 3.39Å
270	H	98.6	Very high	95.9	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.009	30%	0.304	C	S	.	.	S	Bend	trans	-130.8	158.6	-176.6	-55.4	-82.1	0	0	0	111.4	N243 S246 L249 F251 I265 D266 R267	N243-H270 WeakPolarHBondContact CA-NE2 3.41Å; N243-H270 PolarHBondContact O-NE2 3.31Å; N243-H270 PolarHBondContact OD1-CD2 2.95Å; S246-H270 PolarHBondContact O-CE1 3.41Å; S246-H270 VanDerWaalsContact O-CE1 3.24Å; L249-H270 WeakPolarHBondContact CB-ND1 3.45Å; L249-H270 PolarHBondContact N-ND1 2.81Å; F251-H270 HydrophobicContact CD2-CB 3.97Å; F251-H270 HydrophobicContact CE2-CB 3.77Å; F251-H270 AromaticContact CE2-CG 3.77Å; F251-H270 AromaticContact CE2-ND1 3.93Å; I265-H270 HydrophobicContact CG2-CB 3.91Å; D266-H270 PolarHBondContact O-N 3.28Å; R267-H270 CarbonylContact C-O 3.55Å; R267-H270 WeakPolarHBondContact CA-O 3.16Å
271	H	98.6	Very high	95.9	Very high	53 Å²	53	58.8 Å²	58.8	25%	0.245	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.6	174.4	-50.4	-70.6	0	0	0	109.7	L249 V250 F251 L299 S303	L249-H271 PolarHBondContact O-N 2.82Å; V250-H271 WeakPolarHBondContact CA-O 3.49Å; V250-H271 HydrophobicContact CG2-CB 4.28Å; F251-H271 PolarHBondContact N-O 3.07Å; H271-L299 HydrophobicContact CB-CD1 3.83Å; H271-L299 HydrophobicContact CB-CD2 4.4Å; H271-L299 HydrophobicContact CB-CG 4.48Å; H271-S303 PolarHBondContact NE2-OG 3.29Å; H271-S303 VanDerWaalsContact NE2-OG 3.15Å
272	V	98.5	Very high	96.2	Very high	27 Å²	27	58.9 Å²	58.9	16%	0.164	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	118.2	179.7	-177.8	0	0	0	0	108.9	F251 L253 I265 R267 Q274	F251-V272 HydrophobicContact CB-CG2 4.37Å; L253-V272 HydrophobicContact CD1-CG1 3.41Å; L253-V272 VanDerWaalsContact CD1-CG1 3.41Å; L253-V272 HydrophobicContact CG-CG1 3.96Å; I265-V272 HydrophobicContact CB-CG2 4.14Å; I265-V272 HydrophobicContact CD1-CG2 4.34Å; I265-V272 HydrophobicContact CG2-CG2 3.71Å; R267-V272 HydrophobicContact CG-CG2 4.16Å; V272-Q274 HydrophobicContact CG1-CG 3.78Å
273	L	98.6	Very high	96.5	Very high	31 Å²	31	58.9 Å²	58.9	16%	0.162	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.1	173.9	-60.1	179.9	0	0	0	109.1	V250 F251 L252 L253 H292 K295 L299	V250-L273 HydrophobicContact CG1-CD1 4.23Å; V250-L273 HydrophobicContact CG1-CG 4.43Å; F251-L273 PolarHBondContact O-N 3.39Å; L252-L273 HydrophobicContact CD2-CB 3.84Å; L252-L273 HydrophobicContact CD2-CD1 3.81Å; L252-L273 HydrophobicContact CD2-CG 4.22Å; L253-L273 PolarHBondContact N-O 2.98Å; L273-H292 VanDerWaalsContact C-CE1 3.45Å; L273-H292 VanDerWaalsContact CB-CE1 3.44Å; L273-H292 WeakPolarHBondContact CB-CE1 3.49Å; L273-H292 HydrophobicContact CD1-CB 4.47Å; L273-K295 HydrophobicContact CD1-CB 3.84Å; L273-L299 HydrophobicContact CD1-CD1 4.1Å; L273-L299 HydrophobicContact CD2-CD1 4.16Å; L273-L299 HydrophobicContact CG-CD1 4.21Å
274	Q	98.3	Very high	96.8	Very high	76 Å²	76	64 Å²	64	36%	0.355	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.1	-173.7	-49.1	-172.4	-92.5	0	0	109.7	L253 Q259 V272	L253-Q274 HydrophobicContact CB-CG 4.18Å; L253-Q274 HydrophobicContact CD1-CG 4.22Å; L253-Q274 WeakPolarHBondContact O-CA 3.47Å; Q259-Q274 HydrophobicContact CG-CB 4.23Å; Q259-Q274 HydrophobicContact CG-CG 4.49Å; V272-Q274 HydrophobicContact CG1-CG 3.78Å
275	T	98.2	Very high	97	Very high	19 Å²	19	70.1 Å²	70.1	12%	0.117	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	-178.6	170.7	-170.9	0	0	0	0	110.6	L253 W254 G255 Q259 G286 F287 C290	L253-T275 PolarHBondContact O-N 3.13Å; W254-T275 HydrophobicContact CG-CG2 4.48Å; G255-T275 PolarHBondContact N-O 3.24Å; Q259-T275 PolarHBondContact NE2-O 3.35Å; T275-G286 PolarHBondContact OG1-O 3.41Å; T275-F287 HydrophobicContact CG2-CD2 3.98Å; T275-F287 PolarHBondContact OG1-N 3.44Å; T275-C290 HydrophobicContact CG2-CB 3.85Å
276	A	97.1	Very high	97.1	Very high	18 Å²	18	71 Å²	71	15%	0.149	34%	0.335	C	S	.	.			trans	-61	161	172.6	0	0	0	0	0	112	S282 R285	A276-S282 WeakPolarHBondContact CB-O 3.44Å; A276-R285 HydrophobicContact CB-CB 4.04Å
277	H	96.8	Very high	97.1	Very high	44 Å²	44	67.5 Å²	67.5	20%	0.204	32%	0.316	C	S	.	.			trans	-72.1	145.8	176.6	-173.5	-86.3	0	0	0	110.6	F167 S279 S282	F167-H277 AromaticContact CE1-CE1 3.89Å; F167-H277 AromaticContact CE1-NE2 3.5Å; F167-H277 AromaticContact CZ-NE2 3.74Å; H277-S279 WeakPolarHBondContact ND1-CB 3.44Å; H277-S279 PolarHBondContact ND1-N 3.08Å; H277-S279 PolarHBondContact O-N 2.92Å; H277-S282 WeakPolarHBondContact CB-OG 3.48Å; H277-S282 CarbonylContact O-C 3Å; H277-S282 PolarHBondContact O-OG 3.04Å
278	P	97	Very high	97.1	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-69.3	6.3	178.1	27.3	-36.6	0	0	0	114.9	F167 N181 I182 W254 F287	F167-P278 HydrophobicContact CD1-CG 4.38Å; F167-P278 HydrophobicContact CE1-CG 3.74Å; F167-P278 HydrophobicContact CZ-CG 4.13Å; N181-P278 HydrophobicContact CB-CB 4.41Å; N181-P278 VanDerWaalsContact CB-O 3.31Å; N181-P278 WeakPolarHBondContact CB-O 3.39Å; N181-P278 PolarHBondContact ND2-O 2.99Å; I182-P278 HydrophobicContact CD1-CB 4.39Å; I182-P278 HydrophobicContact CD1-CG 4.03Å; I182-P278 HydrophobicContact CG1-CB 3.88Å; I182-P278 HydrophobicContact CG1-CG 4.02Å; W254-P278 HydrophobicContact CE3-CG 4.25Å; P278-F287 HydrophobicContact CB-CD1 4.01Å; P278-F287 HydrophobicContact CB-CD2 3.89Å; P278-F287 HydrophobicContact CB-CE1 3.86Å; P278-F287 HydrophobicContact CB-CE2 3.74Å; P278-F287 HydrophobicContact CB-CG 4.04Å; P278-F287 HydrophobicContact CB-CZ 3.74Å; P278-F287 HydrophobicContact CG-CD2 4.4Å; P278-F287 HydrophobicContact CG-CE2 4.11Å; P278-F287 HydrophobicContact CG-CZ 4.43Å
279	S	94.8	Very high	97.2	Very high	26 Å²	26	55.8 Å²	55.8	18%	0.182	29%	0.285	C	S	.	.	S	Bend	trans	-64.9	145.2	177.9	168.9	0	0	0	0	109.6	H277 L281 S282 V283	H277-S279 WeakPolarHBondContact ND1-CB 3.44Å; H277-S279 PolarHBondContact ND1-N 3.08Å; H277-S279 PolarHBondContact O-N 2.92Å; S279-L281 PolarHBondContact O-N 3.05Å; S279-L281 PolarHBondContact OG-N 2.84Å; S279-S282 PolarHBondContact O-N 3.33Å; S279-S282 PolarHBondContact O-OG 2.84Å; S279-V283 WeakPolarHBondContact O-CB 3.1Å; S279-V283 PolarHBondContact O-N 3.29Å
280	P	94.2	Very high	97.3	Very high	69 Å²	69	52.3 Å²	52.3	45%	0.448	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-28.8	174	-28.8	35.4	0	0	0	114.4	P177 S282	P177-P280 HydrophobicContact CB-CG 3.63Å; P280-S282 VanDerWaalsContact C-N 3.29Å; P280-S282 PolarHBondContact O-N 2.98Å
281	L	94.1	Very high	97.3	Very high	151 Å²	151	58.2 Å²	58.2	79%	0.791	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-21	179.2	-61.7	178	0	0	0	114.2	S279	S279-L281 PolarHBondContact O-N 3.05Å; S279-L281 PolarHBondContact OG-N 2.84Å
282	S	95.3	Very high	97.3	Very high	24 Å²	24	56 Å²	56	17%	0.168	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	-9	-170.5	54.7	0	0	0	0	114.6	A276 H277 S279 P280 Y284 R285	A276-S282 WeakPolarHBondContact CB-O 3.44Å; H277-S282 WeakPolarHBondContact CB-OG 3.48Å; H277-S282 CarbonylContact O-C 3Å; H277-S282 PolarHBondContact O-OG 3.04Å; S279-S282 PolarHBondContact O-N 3.33Å; S279-S282 PolarHBondContact O-OG 2.84Å; P280-S282 VanDerWaalsContact C-N 3.29Å; P280-S282 PolarHBondContact O-N 2.98Å; S282-Y284 VanDerWaalsContact C-N 3.28Å; S282-Y284 PolarHBondContact O-N 3.06Å; S282-R285 VanDerWaalsContact O-CB 3.3Å; S282-R285 WeakPolarHBondContact O-CB 3.47Å; S282-R285 PolarHBondContact O-N 3.23Å
283	V	97.6	Very high	97.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-57.6	-39	-171.2	69.5	0	0	0	0	113	N181 S279 R285 F287 F288	N181-V283 HydrophobicContact CB-CG2 3.9Å; S279-V283 WeakPolarHBondContact O-CB 3.1Å; S279-V283 PolarHBondContact O-N 3.29Å; V283-R285 PolarHBondContact O-N 3.25Å; V283-F287 HydrophobicContact CG2-CB 3.95Å; V283-F287 HydrophobicContact CG2-CD1 3.71Å; V283-F287 HydrophobicContact CG2-CG 4.19Å; V283-F287 WeakPolarHBondContact O-CB 3.41Å; V283-F287 PolarHBondContact O-N 3.03Å; V283-F288 HydrophobicContact CB-CD2 4.34Å; V283-F288 HydrophobicContact CB-CE2 4.13Å; V283-F288 HydrophobicContact CB-CZ 4.5Å; V283-F288 HydrophobicContact CG1-CD2 4.05Å; V283-F288 HydrophobicContact CG1-CE2 3.61Å; V283-F288 HydrophobicContact CG1-CZ 4.26Å; V283-F288 HydrophobicContact CG2-CD1 3.87Å; V283-F288 HydrophobicContact CG2-CD2 3.58Å; V283-F288 HydrophobicContact CG2-CE1 3.69Å; V283-F288 HydrophobicContact CG2-CE2 3.41Å; V283-F288 VanDerWaalsContact CG2-CE2 3.41Å; V283-F288 HydrophobicContact CG2-CG 3.8Å; V283-F288 HydrophobicContact CG2-CZ 3.47Å; V283-F288 VanDerWaalsContact CG2-CZ 3.47Å; V283-F288 PolarHBondContact O-N 3.4Å; V283-F288 VanDerWaalsContact O-N 3.16Å
284	Y	97.3	Very high	97.3	Very high	194 Å²	194	54.9 Å²	54.9	76%	0.761	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-74.4	-7.2	178	-60.9	-74.9	0	0	0	114.2	S282 G286 F288	S282-Y284 VanDerWaalsContact C-N 3.28Å; S282-Y284 PolarHBondContact O-N 3.06Å; Y284-G286 PolarHBondContact O-N 2.92Å; Y284-F288 AromaticContact CD1-CD2 3.86Å; Y284-F288 HydrophobicContact CD1-CD2 3.86Å; Y284-F288 HydrophobicContact CD1-CE2 4.29Å; Y284-F288 AromaticContact CE1-CD2 3.79Å; Y284-F288 HydrophobicContact CE1-CD2 3.79Å; Y284-F288 AromaticContact CE1-CE2 3.83Å; Y284-F288 HydrophobicContact CE1-CE2 3.83Å
285	R	96.9	Very high	97.3	Very high	211 Å²	211	55.4 Å²	55.4	80%	0.796	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-85.9	11.9	178	-54.8	-176.2	-176.8	-167.5	-0.9	112.8	A276 S282 V283	A276-R285 HydrophobicContact CB-CB 4.04Å; S282-R285 VanDerWaalsContact O-CB 3.3Å; S282-R285 WeakPolarHBondContact O-CB 3.47Å; S282-R285 PolarHBondContact O-N 3.23Å; V283-R285 PolarHBondContact O-N 3.25Å
286	G	97	Very high	97.4	Very high	28 Å²	28	54.5 Å²	54.5	29%	0.289	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	135	-5.2	171.7	0	0	0	0	0	115.7	T275 Y284 C290	T275-G286 PolarHBondContact OG1-O 3.41Å; Y284-G286 PolarHBondContact O-N 2.92Å; G286-C290 WeakPolarHBondContact O-CB 3.4Å
287	F	98.5	Very high	97.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-48.6	175.4	-176.9	-88.6	0	0	0	110.3	I182 E185 W254 T275 P278 V283 G289 C290	I182-F287 HydrophobicContact CB-CZ 4.41Å; I182-F287 HydrophobicContact CG1-CE1 4.35Å; I182-F287 HydrophobicContact CG1-CE2 4.47Å; I182-F287 HydrophobicContact CG1-CZ 3.7Å; E185-F287 HydrophobicContact CB-CD1 4.29Å; E185-F287 HydrophobicContact CB-CE1 3.63Å; E185-F287 HydrophobicContact CB-CZ 4.34Å; E185-F287 HydrophobicContact CG-CE1 4.13Å; W254-F287 HydrophobicContact CD2-CD2 4.47Å; W254-F287 AromaticContact CD2-CE2 3.78Å; W254-F287 HydrophobicContact CD2-CE2 3.78Å; W254-F287 AromaticContact CE2-CE2 3.74Å; W254-F287 HydrophobicContact CE3-CE2 4.09Å; W254-F287 HydrophobicContact CG-CD2 4.41Å; W254-F287 HydrophobicContact CG-CE2 4.17Å; W254-F287 HydrophobicContact CH2-CE2 4.35Å; W254-F287 HydrophobicContact CZ2-CE2 4.04Å; W254-F287 HydrophobicContact CZ3-CE2 4.37Å; T275-F287 HydrophobicContact CG2-CD2 3.98Å; T275-F287 PolarHBondContact OG1-N 3.44Å; P278-F287 HydrophobicContact CB-CD1 4.01Å; P278-F287 HydrophobicContact CB-CD2 3.89Å; P278-F287 HydrophobicContact CB-CE1 3.86Å; P278-F287 HydrophobicContact CB-CE2 3.74Å; P278-F287 HydrophobicContact CB-CG 4.04Å; P278-F287 HydrophobicContact CB-CZ 3.74Å; P278-F287 HydrophobicContact CG-CD2 4.4Å; P278-F287 HydrophobicContact CG-CE2 4.11Å; P278-F287 HydrophobicContact CG-CZ 4.43Å; V283-F287 HydrophobicContact CG2-CB 3.95Å; V283-F287 HydrophobicContact CG2-CD1 3.71Å; V283-F287 HydrophobicContact CG2-CG 4.19Å; V283-F287 WeakPolarHBondContact O-CB 3.41Å; V283-F287 PolarHBondContact O-N 3.03Å; F287-G289 PolarHBondContact O-N 2.74Å; F287-C290 WeakPolarHBondContact O-CB 3.35Å; F287-C290 PolarHBondContact O-N 3.46Å; F287-C290 VanDerWaalsContact O-N 3.11Å; F287-C290 PolarHBondContact O-SG 3.02Å
288	F	98.6	Very high	97.5	Very high	61 Å²	61	57.2 Å²	57.2	27%	0.268	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	128	169.9	-71.3	-38.2	0	0	0	110.7	N181 K184 E185 V283 Y284 C290	N181-F288 HydrophobicContact CB-CE1 4.24Å; N181-F288 HydrophobicContact CB-CZ 4.11Å; K184-F288 HydrophobicContact CB-CE1 3.79Å; K184-F288 HydrophobicContact CB-CZ 4.26Å; K184-F288 HydrophobicContact CD-CE1 4.5Å; K184-F288 HydrophobicContact CD-CZ 4.14Å; E185-F288 HydrophobicContact CB-CD1 4.35Å; E185-F288 VanDerWaalsContact OE2-CA 3.31Å; E185-F288 WeakPolarHBondContact OE2-CA 3.44Å; V283-F288 HydrophobicContact CB-CD2 4.34Å; V283-F288 HydrophobicContact CB-CE2 4.13Å; V283-F288 HydrophobicContact CB-CZ 4.5Å; V283-F288 HydrophobicContact CG1-CD2 4.05Å; V283-F288 HydrophobicContact CG1-CE2 3.61Å; V283-F288 HydrophobicContact CG1-CZ 4.26Å; V283-F288 HydrophobicContact CG2-CD1 3.87Å; V283-F288 HydrophobicContact CG2-CD2 3.58Å; V283-F288 HydrophobicContact CG2-CE1 3.69Å; V283-F288 HydrophobicContact CG2-CE2 3.41Å; V283-F288 VanDerWaalsContact CG2-CE2 3.41Å; V283-F288 HydrophobicContact CG2-CG 3.8Å; V283-F288 HydrophobicContact CG2-CZ 3.47Å; V283-F288 VanDerWaalsContact CG2-CZ 3.47Å; V283-F288 PolarHBondContact O-N 3.4Å; V283-F288 VanDerWaalsContact O-N 3.16Å; Y284-F288 AromaticContact CD1-CD2 3.86Å; Y284-F288 HydrophobicContact CD1-CD2 3.86Å; Y284-F288 HydrophobicContact CD1-CE2 4.29Å; Y284-F288 AromaticContact CE1-CD2 3.79Å; Y284-F288 HydrophobicContact CE1-CD2 3.79Å; Y284-F288 AromaticContact CE1-CE2 3.83Å; Y284-F288 HydrophobicContact CE1-CE2 3.83Å; F288-C290 VanDerWaalsContact C-N 3.33Å
289	G	98.4	Very high	97.6	Very high	55 Å²	55	58.6 Å²	58.6	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	6.8	-174.1	0	0	0	0	0	114.3	E185 F287 R291	E185-G289 PolarHBondContact OE1-N 3.09Å; E185-G289 PolarHBondContact OE2-N 3.4Å; F287-G289 PolarHBondContact O-N 2.74Å; G289-R291 PolarHBondContact O-N 2.8Å
290	C	98.6	Very high	97.8	Very high	9 Å²	9	57.3 Å²	57.3	6%	0.061	29%	0.286	C	S	.	.			trans	-66.4	-30.1	178.6	75.4	0	0	0	0	112.2	E185 T275 G286 F287 F288 H292 K295	E185-C290 PolarHBondContact OE1-N 3.25Å; T275-C290 HydrophobicContact CG2-CB 3.85Å; G286-C290 WeakPolarHBondContact O-CB 3.4Å; F287-C290 WeakPolarHBondContact O-CB 3.35Å; F287-C290 PolarHBondContact O-N 3.46Å; F287-C290 VanDerWaalsContact O-N 3.11Å; F287-C290 PolarHBondContact O-SG 3.02Å; F288-C290 VanDerWaalsContact C-N 3.33Å; C290-H292 PolarHBondContact O-N 2.88Å; C290-H292 PolarHBondContact SG-CD2 3.46Å; C290-H292 PolarHBondContact SG-N 3.32Å; C290-K295 PolarHBondContact O-NZ 3.04Å
291	R	98.7	Very high	98	Very high	125 Å²	125	59.9 Å²	59.9	47%	0.472	29%	0.291	S	S	.	.			trans	55	37.6	-178.4	-58.5	-163.3	72.4	178.6	7.9	113.6	E185 D189 G289 F293 S294 K295	E185-R291 PolarHBondContact OE1-N 3.3Å; D189-R291 VanDerWaalsContact CG-CA 3.42Å; D189-R291 WeakPolarHBondContact OD1-CA 3.35Å; D189-R291 WeakPolarHBondContact OD1-CB 3.34Å; D189-R291 WeakPolarHBondContact OD1-CG 3.2Å; D189-R291 IonicContact OD1-CZ 2.61Å; D189-R291 IonicContact OD1-NE 3.49Å; D189-R291 PolarHBondContact OD1-NE 3.14Å; D189-R291 IonicContact OD1-NH2 2.63Å; D189-R291 VanDerWaalsContact OD2-CA 3.23Å; D189-R291 WeakPolarHBondContact OD2-CA 3.31Å; G289-R291 PolarHBondContact O-N 2.8Å; R291-F293 VanDerWaalsContact C-N 3.28Å; R291-F293 PolarHBondContact O-N 3.12Å; R291-S294 PolarHBondContact O-OG 2.8Å; R291-K295 VanDerWaalsContact O-CB 3.27Å; R291-K295 WeakPolarHBondContact O-CB 3.44Å; R291-K295 WeakPolarHBondContact O-CD 3.43Å; R291-K295 WeakPolarHBondContact O-CG 3.47Å; R291-K295 PolarHBondContact O-N 3.38Å
292	H	98.8	Very high	98.1	Very high	7 Å²	7	59.4 Å²	59.4	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-27.7	-175.8	-84.4	-152.8	0	0	0	112.6	L252 W254 L273 C290 T296	L252-H292 HydrophobicContact CD1-CB 4.37Å; L252-H292 HydrophobicContact CD2-CB 4.24Å; W254-H292 AromaticContact CD1-CE1 3.93Å; W254-H292 AromaticContact CD1-ND1 3.78Å; W254-H292 AromaticContact NE1-CE1 3.65Å; W254-H292 AromaticContact NE1-CG 3.93Å; W254-H292 AromaticContact NE1-ND1 3.05Å; W254-H292 PolarHBondContact NE1-ND1 2.87Å; L273-H292 VanDerWaalsContact C-CE1 3.45Å; L273-H292 VanDerWaalsContact CB-CE1 3.44Å; L273-H292 WeakPolarHBondContact CB-CE1 3.49Å; L273-H292 HydrophobicContact CD1-CB 4.47Å; C290-H292 PolarHBondContact O-N 2.88Å; C290-H292 PolarHBondContact SG-CD2 3.46Å; C290-H292 PolarHBondContact SG-N 3.32Å; H292-T296 WeakPolarHBondContact O-CB 3.42Å; H292-T296 PolarHBondContact O-N 3.27Å; H292-T296 PolarHBondContact O-OG1 3.42Å
293	F	98.8	Very high	98.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-74.8	-46.4	-174.8	-55.9	-81.4	0	0	0	111.1	I182 E185 L186 D189 I190 W204 W254 R291 T296 N297 W310	I182-F293 HydrophobicContact CG2-CZ 3.94Å; E185-F293 HydrophobicContact CB-CE2 4.29Å; E185-F293 HydrophobicContact CG-CD2 4.28Å; E185-F293 HydrophobicContact CG-CE2 3.9Å; L186-F293 HydrophobicContact CD1-CD1 4.4Å; L186-F293 HydrophobicContact CD1-CE1 4.01Å; L186-F293 HydrophobicContact CD1-CE2 4.4Å; L186-F293 HydrophobicContact CD1-CZ 4.03Å; L186-F293 HydrophobicContact CD2-CB 3.78Å; L186-F293 HydrophobicContact CD2-CD1 3.53Å; L186-F293 HydrophobicContact CD2-CD2 3.66Å; L186-F293 HydrophobicContact CD2-CE1 3.98Å; L186-F293 HydrophobicContact CD2-CE2 4.11Å; L186-F293 HydrophobicContact CD2-CG 3.35Å; L186-F293 HydrophobicContact CD2-CZ 4.26Å; L186-F293 HydrophobicContact CG-CD1 3.98Å; L186-F293 HydrophobicContact CG-CD2 3.7Å; L186-F293 HydrophobicContact CG-CE1 3.92Å; L186-F293 HydrophobicContact CG-CE2 3.66Å; L186-F293 HydrophobicContact CG-CG 3.88Å; L186-F293 HydrophobicContact CG-CZ 3.78Å; D189-F293 WeakPolarHBondContact OD2-CA 3.29Å; D189-F293 WeakPolarHBondContact OD2-CB 3.08Å; D189-F293 PolarHBondContact OD2-N 3.1Å; I190-F293 HydrophobicContact CD1-CB 4.05Å; I190-F293 HydrophobicContact CG1-CB 4.02Å; W204-F293 HydrophobicContact CH2-CE1 4.37Å; W254-F293 HydrophobicContact CH2-CE1 4.26Å; W254-F293 AromaticContact CH2-CZ 3.99Å; W254-F293 HydrophobicContact CH2-CZ 3.99Å; W254-F293 HydrophobicContact CZ2-CE1 4.46Å; W254-F293 HydrophobicContact CZ2-CZ 4.13Å; R291-F293 VanDerWaalsContact C-N 3.28Å; R291-F293 PolarHBondContact O-N 3.12Å; F293-T296 PolarHBondContact O-N 3.26Å; F293-N297 PolarHBondContact O-N 3.49Å; F293-W310 HydrophobicContact CB-CD2 4.31Å; F293-W310 HydrophobicContact CB-CG 4.22Å; F293-W310 AromaticContact CD1-CD2 3.78Å; F293-W310 HydrophobicContact CD1-CD2 3.78Å; F293-W310 AromaticContact CD1-CE2 3.93Å; F293-W310 AromaticContact CD1-CE3 3.88Å; F293-W310 HydrophobicContact CD1-CE3 3.88Å; F293-W310 HydrophobicContact CD1-CG 4.3Å; F293-W310 HydrophobicContact CD1-CH2 4.29Å; F293-W310 HydrophobicContact CD1-CZ2 4.19Å; F293-W310 HydrophobicContact CD1-CZ3 4.14Å; F293-W310 HydrophobicContact CE1-CE3 4.4Å; F293-W310 HydrophobicContact CE1-CZ3 4.48Å; F293-W310 PolarHBondContact O-NE1 2.96Å; F293-W310 VanDerWaalsContact O-NE1 3.07Å
294	S	98.7	Very high	98.1	Very high	34 Å²	34	63.8 Å²	63.8	24%	0.238	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-47.2	174.4	62.5	0	0	0	0	111.7	D189 R291 T296 N297 E298	D189-S294 VanDerWaalsContact CG-OG 3.29Å; D189-S294 VanDerWaalsContact OD1-CB 3.24Å; D189-S294 WeakPolarHBondContact OD1-CB 3.4Å; D189-S294 PolarHBondContact OD1-OG 2.73Å; D189-S294 PolarHBondContact OD2-N 3.09Å; D189-S294 PolarHBondContact OD2-OG 2.9Å; R291-S294 PolarHBondContact O-OG 2.8Å; S294-T296 VanDerWaalsContact C-N 3.27Å; S294-T296 PolarHBondContact O-N 2.9Å; S294-N297 PolarHBondContact O-N 3.12Å; S294-N297 VanDerWaalsContact O-N 3.09Å; S294-E298 PolarHBondContact O-N 3.16Å
295	K	98.9	Very high	98.1	Very high	87 Å²	87	57 Å²	57	38%	0.378	30%	0.3	S	S	.	.	H	α-helix	trans	-57.6	-39	175.2	-72.8	172.3	-176.3	167.2	0	112.2	L273 C290 R291 E298 L299	L273-K295 HydrophobicContact CD1-CB 3.84Å; C290-K295 PolarHBondContact O-NZ 3.04Å; R291-K295 VanDerWaalsContact O-CB 3.27Å; R291-K295 WeakPolarHBondContact O-CB 3.44Å; R291-K295 WeakPolarHBondContact O-CD 3.43Å; R291-K295 WeakPolarHBondContact O-CG 3.47Å; R291-K295 PolarHBondContact O-N 3.38Å; K295-E298 PolarHBondContact O-N 3.28Å; K295-L299 WeakPolarHBondContact O-CB 3.44Å; K295-L299 WeakPolarHBondContact O-CD1 3.45Å; K295-L299 WeakPolarHBondContact O-CG 3.48Å; K295-L299 PolarHBondContact O-N 3.39Å
296	T	98.9	Very high	98.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.6	-48.2	175.7	-66.8	0	0	0	0	111	V148 V250 L252 H292 F293 S294 E298 L299 L300 W310	V148-T296 HydrophobicContact CB-CG2 4.47Å; V148-T296 HydrophobicContact CG1-CG2 4.11Å; V148-T296 HydrophobicContact CG2-CG2 3.48Å; V148-T296 VanDerWaalsContact CG2-CG2 3.48Å; V250-T296 HydrophobicContact CB-CG2 4.01Å; V250-T296 HydrophobicContact CG1-CG2 4.01Å; V250-T296 HydrophobicContact CG2-CG2 4.18Å; L252-T296 WeakPolarHBondContact CD2-OG1 3.36Å; H292-T296 WeakPolarHBondContact O-CB 3.42Å; H292-T296 PolarHBondContact O-N 3.27Å; H292-T296 PolarHBondContact O-OG1 3.42Å; F293-T296 PolarHBondContact O-N 3.26Å; S294-T296 VanDerWaalsContact C-N 3.27Å; S294-T296 PolarHBondContact O-N 2.9Å; T296-E298 VanDerWaalsContact C-N 3.32Å; T296-E298 PolarHBondContact O-N 3.02Å; T296-L299 PolarHBondContact O-N 2.68Å; T296-L300 HydrophobicContact CG2-CD1 4.03Å; T296-L300 HydrophobicContact CG2-CG 4.3Å; T296-L300 VanDerWaalsContact O-CG 3.31Å; T296-L300 WeakPolarHBondContact O-CG 3.49Å; T296-L300 PolarHBondContact O-N 3.31Å; T296-W310 HydrophobicContact CG2-CZ2 3.86Å
297	N	98.8	Very high	98.3	Very high	25 Å²	25	55.9 Å²	55.9	13%	0.134	30%	0.298	C	S	.	.	H	α-helix	trans	-64.7	-35.8	179.6	-78.5	-10.6	0	0	0	112.7	F293 S294 Q301 P307 I308 W310	F293-N297 PolarHBondContact O-N 3.49Å; S294-N297 PolarHBondContact O-N 3.12Å; S294-N297 VanDerWaalsContact O-N 3.09Å; N297-Q301 VanDerWaalsContact O-CG 3.29Å; N297-Q301 WeakPolarHBondContact O-CG 3.36Å; N297-Q301 PolarHBondContact O-N 3.46Å; N297-Q301 VanDerWaalsContact O-N 3.08Å; N297-Q301 PolarHBondContact O-NE2 2.77Å; N297-P307 HydrophobicContact CB-CB 3.81Å; N297-P307 VanDerWaalsContact CG-CB 3.46Å; N297-P307 WeakPolarHBondContact OD1-CB 3.22Å; N297-I308 PolarHBondContact ND2-O 3.39Å; N297-I308 PolarHBondContact OD1-N 3.25Å; N297-I308 PolarHBondContact OD1-O 3.15Å; N297-W310 PolarHBondContact ND2-NE1 2.78Å
298	E	98.8	Very high	98.3	Very high	95 Å²	95	56.1 Å²	56.1	44%	0.444	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-45.6	173.3	-167.9	-164.6	150.9	0	0	111.7	S294 K295 T296 Q301 K302	S294-E298 PolarHBondContact O-N 3.16Å; K295-E298 PolarHBondContact O-N 3.28Å; T296-E298 VanDerWaalsContact C-N 3.32Å; T296-E298 PolarHBondContact O-N 3.02Å; E298-Q301 PolarHBondContact O-N 2.98Å; E298-K302 WeakPolarHBondContact O-CG 3.22Å; E298-K302 PolarHBondContact O-N 3.25Å; E298-K302 WeakPolarHBondContact OE1-CE 3.1Å; E298-K302 IonicContact OE1-NZ 2.95Å; E298-K302 PolarHBondContact OE1-NZ 3.44Å
299	L	98.8	Very high	98.3	Very high	28 Å²	28	56.6 Å²	56.6	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-67.2	-37.6	179.2	-68.9	167.4	0	0	0	112.4	V250 H271 L273 K295 T296 K302 S303	V250-L299 HydrophobicContact CG1-CD1 4.24Å; V250-L299 HydrophobicContact CG2-CB 3.82Å; V250-L299 HydrophobicContact CG2-CD1 4.46Å; H271-L299 HydrophobicContact CB-CD1 3.83Å; H271-L299 HydrophobicContact CB-CD2 4.4Å; H271-L299 HydrophobicContact CB-CG 4.48Å; L273-L299 HydrophobicContact CD1-CD1 4.1Å; L273-L299 HydrophobicContact CD2-CD1 4.16Å; L273-L299 HydrophobicContact CG-CD1 4.21Å; K295-L299 WeakPolarHBondContact O-CB 3.44Å; K295-L299 WeakPolarHBondContact O-CD1 3.45Å; K295-L299 WeakPolarHBondContact O-CG 3.48Å; K295-L299 PolarHBondContact O-N 3.39Å; T296-L299 PolarHBondContact O-N 2.68Å; L299-K302 HydrophobicContact CD2-CD 4.5Å; L299-K302 PolarHBondContact O-N 2.81Å; L299-S303 PolarHBondContact O-N 2.84Å; L299-S303 VanDerWaalsContact O-N 3.11Å; L299-S303 PolarHBondContact O-OG 3.37Å
300	L	98.6	Very high	98.3	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-45.6	173.5	-73	177.1	0	0	0	111.2	K147 V148 V250 T296 K302 S303 G304 K305 I308	K147-L300 HydrophobicContact CB-CD1 4.44Å; K147-L300 HydrophobicContact CB-CD2 3.93Å; V148-L300 HydrophobicContact CG2-CD1 3.91Å; V250-L300 HydrophobicContact CG2-CD2 4.01Å; V250-L300 HydrophobicContact CG2-CG 4.11Å; T296-L300 HydrophobicContact CG2-CD1 4.03Å; T296-L300 HydrophobicContact CG2-CG 4.3Å; T296-L300 VanDerWaalsContact O-CG 3.31Å; T296-L300 WeakPolarHBondContact O-CG 3.49Å; T296-L300 PolarHBondContact O-N 3.31Å; L300-K302 PolarHBondContact O-N 2.83Å; L300-S303 CarbonylContact O-C 3.37Å; L300-S303 WeakPolarHBondContact O-CA 3.31Å; L300-S303 PolarHBondContact O-N 3.17Å; L300-G304 PolarHBondContact O-N 3.42Å; L300-K305 CarbonylContact C-O 3.48Å; L300-K305 HydrophobicContact CB-CB 4.17Å; L300-K305 HydrophobicContact CD2-CB 4.18Å; L300-K305 HydrophobicContact CD2-CD 3.78Å; L300-K305 WeakPolarHBondContact O-CB 3.4Å; L300-K305 PolarHBondContact O-N 2.65Å; L300-I308 HydrophobicContact CD1-CD1 4.28Å; L300-I308 HydrophobicContact CD1-CG1 3.88Å
301	Q	98.3	Very high	98.2	Very high	122 Å²	122	58 Å²	58	57%	0.57	29%	0.294	S	S	*	.	H	α-helix	trans	-61	-43.2	176.3	-74.9	170.8	76.5	0	0	111.8	N297 E298 S303 G304	N297-Q301 VanDerWaalsContact O-CG 3.29Å; N297-Q301 WeakPolarHBondContact O-CG 3.36Å; N297-Q301 PolarHBondContact O-N 3.46Å; N297-Q301 VanDerWaalsContact O-N 3.08Å; N297-Q301 PolarHBondContact O-NE2 2.77Å; E298-Q301 PolarHBondContact O-N 2.98Å; Q301-S303 PolarHBondContact O-N 3.05Å; Q301-G304 PolarHBondContact O-N 3Å
302	K	96.8	Very high	98.1	Very high	141 Å²	141	57.3 Å²	57.3	61%	0.613	30%	0.296	S	S	*	.	H	α-helix	trans	-59	-27	173.3	-75.5	170.2	170.5	169.9	0	113.2	E298 L299 L300	E298-K302 WeakPolarHBondContact O-CG 3.22Å; E298-K302 PolarHBondContact O-N 3.25Å; E298-K302 WeakPolarHBondContact OE1-CE 3.1Å; E298-K302 IonicContact OE1-NZ 2.95Å; E298-K302 PolarHBondContact OE1-NZ 3.44Å; L299-K302 HydrophobicContact CD2-CD 4.5Å; L299-K302 PolarHBondContact O-N 2.81Å; L300-K302 PolarHBondContact O-N 2.83Å
303	S	95.3	Very high	97.9	Very high	45 Å²	45	59.2 Å²	59.2	32%	0.315	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	12.2	175	-62.8	0	0	0	0	113.7	H271 L299 L300 Q301 K305	H271-S303 PolarHBondContact NE2-OG 3.29Å; H271-S303 VanDerWaalsContact NE2-OG 3.15Å; L299-S303 PolarHBondContact O-N 2.84Å; L299-S303 VanDerWaalsContact O-N 3.11Å; L299-S303 PolarHBondContact O-OG 3.37Å; L300-S303 CarbonylContact O-C 3.37Å; L300-S303 WeakPolarHBondContact O-CA 3.31Å; L300-S303 PolarHBondContact O-N 3.17Å; Q301-S303 PolarHBondContact O-N 3.05Å; S303-K305 VanDerWaalsContact C-N 3.29Å; S303-K305 PolarHBondContact O-N 3.07Å
304	G	97.3	Very high	97.9	Very high	73 Å²	73	62.2 Å²	62.2	75%	0.753	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	21.1	178.2	0	0	0	0	0	114.4	L300 Q301	L300-G304 PolarHBondContact O-N 3.42Å; Q301-G304 PolarHBondContact O-N 3Å
305	K	97.9	Very high	97.8	Very high	50 Å²	50	63.7 Å²	63.7	22%	0.217	33%	0.326	C	S	.	.			trans	-105.4	144.4	-177.9	-62.3	177.1	177.9	-177.1	0	111.1	K147 N247 G248 L300 S303	K147-K305 HydrophobicContact CD-CB 4.46Å; K147-K305 HydrophobicContact CG-CD 4.33Å; N247-K305 WeakPolarHBondContact O-CE 3.17Å; N247-K305 PolarHBondContact O-NZ 3.13Å; G248-K305 VanDerWaalsContact C-NZ 3.26Å; G248-K305 WeakPolarHBondContact O-CE 3.26Å; G248-K305 PolarHBondContact O-NZ 2.81Å; L300-K305 CarbonylContact C-O 3.48Å; L300-K305 HydrophobicContact CB-CB 4.17Å; L300-K305 HydrophobicContact CD2-CB 4.18Å; L300-K305 HydrophobicContact CD2-CD 3.78Å; L300-K305 WeakPolarHBondContact O-CB 3.4Å; L300-K305 PolarHBondContact O-N 2.65Å; S303-K305 VanDerWaalsContact C-N 3.29Å; S303-K305 PolarHBondContact O-N 3.07Å
306	K	97.9	Very high	97.8	Very high	169 Å²	169	62.4 Å²	62.4	74%	0.735	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-60.8	131.9	171.5	-170.4	-176.8	177.4	-173	0	109.7	K147	K147-K306 PolarHBondContact NZ-O 3.17Å
307	P	98.5	Very high	97.7	Very high	48 Å²	48	66.1 Å²	66.1	31%	0.312	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-59.7	165.2	176.4	25.9	-35.1	0	0	0	112.1	N297	N297-P307 HydrophobicContact CB-CB 3.81Å; N297-P307 VanDerWaalsContact CG-CB 3.46Å; N297-P307 WeakPolarHBondContact OD1-CB 3.22Å
308	I	98.7	Very high	97.6	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.021	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-84.5	131.2	169.2	-54.1	-56	0	0	0	108.3	K147 V148 Q207 V209 N297 L300 W310	K147-I308 HydrophobicContact CB-CD1 4.44Å; K147-I308 HydrophobicContact CD-CD1 4.46Å; V148-I308 HydrophobicContact CG2-CD1 4.2Å; V148-I308 HydrophobicContact CG2-CG1 3.82Å; Q207-I308 HydrophobicContact CB-CD1 4.27Å; V209-I308 HydrophobicContact CG2-CD1 3.81Å; V209-I308 HydrophobicContact CG2-CG1 3.9Å; V209-I308 HydrophobicContact CG2-CG2 3.88Å; N297-I308 PolarHBondContact ND2-O 3.39Å; N297-I308 PolarHBondContact OD1-N 3.25Å; N297-I308 PolarHBondContact OD1-O 3.15Å; L300-I308 HydrophobicContact CD1-CD1 4.28Å; L300-I308 HydrophobicContact CD1-CG1 3.88Å; I308-W310 HydrophobicContact CB-CD2 4.07Å; I308-W310 HydrophobicContact CB-CE3 4.42Å; I308-W310 HydrophobicContact CB-CH2 4.16Å; I308-W310 HydrophobicContact CB-CZ2 3.77Å; I308-W310 HydrophobicContact CB-CZ3 4.47Å; I308-W310 HydrophobicContact CG1-CH2 4.13Å; I308-W310 HydrophobicContact CG1-CZ2 3.93Å; I308-W310 HydrophobicContact CG2-CD2 3.68Å; I308-W310 HydrophobicContact CG2-CE3 3.64Å; I308-W310 HydrophobicContact CG2-CG 4.34Å; I308-W310 HydrophobicContact CG2-CH2 3.98Å; I308-W310 HydrophobicContact CG2-CZ2 4.01Å; I308-W310 HydrophobicContact CG2-CZ3 3.8Å; I308-W310 PolarHBondContact O-N 3.14Å
309	D	98.5	Very high	97.6	Very high	72 Å²	72	66.9 Å²	66.9	39%	0.385	35%	0.349	S	S	.	.			trans	-81.9	98.1	163.5	-170.9	-7.7	0	0	0	108.7	Q207 K311 E312	Q207-D309 PolarHBondContact NE2-O 2.7Å; D309-K311 PolarHBondContact O-N 3.22Å; D309-K311 WeakPolarHBondContact OD1-CB 3.4Å; D309-K311 PolarHBondContact OD1-N 2.86Å; D309-E312 HydrophobicContact CB-CB 4.08Å; D309-E312 PolarHBondContact O-N 2.9Å
310	W	98.5	Very high	97.5	Very high	3 Å²	3	69.6 Å²	69.6	1%	0.011	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.3	-179.7	-59.7	111.4	0	0	0	113.1	V148 L186 F193 W204 V209 F293 T296 N297 I308	V148-W310 HydrophobicContact CG1-CH2 4.38Å; L186-W310 HydrophobicContact CD2-CB 3.71Å; L186-W310 HydrophobicContact CD2-CG 4.1Å; F193-W310 WeakPolarHBondContact CE2-O 3.31Å; W204-W310 AromaticContact CD2-CE3 3.8Å; W204-W310 HydrophobicContact CD2-CE3 3.8Å; W204-W310 AromaticContact CD2-CZ3 3.99Å; W204-W310 HydrophobicContact CD2-CZ3 3.99Å; W204-W310 AromaticContact CE2-CE3 3.71Å; W204-W310 HydrophobicContact CE3-CE3 4.26Å; W204-W310 HydrophobicContact CE3-CZ3 4.12Å; W204-W310 HydrophobicContact CG-CE3 4.13Å; W204-W310 HydrophobicContact CG-CZ3 4.28Å; W204-W310 HydrophobicContact CZ2-CE3 4.12Å; W204-W310 AromaticContact NE1-CE3 3.92Å; W204-W310 PolarHBondContact NE1-O 3.4Å; V209-W310 HydrophobicContact CG1-CZ3 4.39Å; V209-W310 HydrophobicContact CG2-CH2 4.02Å; V209-W310 HydrophobicContact CG2-CZ3 3.95Å; F293-W310 HydrophobicContact CB-CD2 4.31Å; F293-W310 HydrophobicContact CB-CG 4.22Å; F293-W310 AromaticContact CD1-CD2 3.78Å; F293-W310 HydrophobicContact CD1-CD2 3.78Å; F293-W310 AromaticContact CD1-CE2 3.93Å; F293-W310 AromaticContact CD1-CE3 3.88Å; F293-W310 HydrophobicContact CD1-CE3 3.88Å; F293-W310 HydrophobicContact CD1-CG 4.3Å; F293-W310 HydrophobicContact CD1-CH2 4.29Å; F293-W310 HydrophobicContact CD1-CZ2 4.19Å; F293-W310 HydrophobicContact CD1-CZ3 4.14Å; F293-W310 HydrophobicContact CE1-CE3 4.4Å; F293-W310 HydrophobicContact CE1-CZ3 4.48Å; F293-W310 PolarHBondContact O-NE1 2.96Å; F293-W310 VanDerWaalsContact O-NE1 3.07Å; T296-W310 HydrophobicContact CG2-CZ2 3.86Å; N297-W310 PolarHBondContact ND2-NE1 2.78Å; I308-W310 HydrophobicContact CB-CD2 4.07Å; I308-W310 HydrophobicContact CB-CE3 4.42Å; I308-W310 HydrophobicContact CB-CH2 4.16Å; I308-W310 HydrophobicContact CB-CZ2 3.77Å; I308-W310 HydrophobicContact CB-CZ3 4.47Å; I308-W310 HydrophobicContact CG1-CH2 4.13Å; I308-W310 HydrophobicContact CG1-CZ2 3.93Å; I308-W310 HydrophobicContact CG2-CD2 3.68Å; I308-W310 HydrophobicContact CG2-CE3 3.64Å; I308-W310 HydrophobicContact CG2-CG 4.34Å; I308-W310 HydrophobicContact CG2-CH2 3.98Å; I308-W310 HydrophobicContact CG2-CZ2 4.01Å; I308-W310 HydrophobicContact CG2-CZ3 3.8Å; I308-W310 PolarHBondContact O-N 3.14Å
311	K	97.2	Very high	97.4	Very high	91 Å²	91	75 Å²	75	40%	0.396	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-17.1	177.8	-56.6	178.2	-69.6	-177.8	0	112.8	D192 F193 D309 L313	D192-K311 HydrophobicContact CB-CD 3.56Å; D192-K311 VanDerWaalsContact O-CD 3.25Å; D192-K311 WeakPolarHBondContact O-CD 3.43Å; D192-K311 IonicContact OD2-NZ 3.27Å; D192-K311 PolarHBondContact OD2-NZ 2.9Å; F193-K311 HydrophobicContact CB-CG 4.34Å; F193-K311 HydrophobicContact CD2-CG 4.06Å; D309-K311 PolarHBondContact O-N 3.22Å; D309-K311 WeakPolarHBondContact OD1-CB 3.4Å; D309-K311 PolarHBondContact OD1-N 2.86Å; K311-L313 PolarHBondContact O-N 2.93Å
312	E	97	Very high	97.3	Very high	110 Å²	110	71.1 Å²	71.1	51%	0.514	38%	0.376	S	S	.	.			trans	-78.5	87.7	179.2	-176.4	-179.3	-176.4	0	0	110	G203 Q207 D309	G203-E312 CarbonylContact C-O 3.43Å; G203-E312 VanDerWaalsContact CA-O 3.31Å; G203-E312 WeakPolarHBondContact CA-O 3.3Å; Q207-E312 PolarHBondContact NE2-OE2 3.38Å; D309-E312 HydrophobicContact CB-CB 4.08Å; D309-E312 PolarHBondContact O-N 2.9Å
313	L	94.2	Very high	97.4	Very high	47 Å²	47	64.7 Å²	64.7	25%	0.246	36%	0.355	C	S	.	.			trans	-132.6	0	-175.1	-76.8	-179.9	0	0	0	113	Y183 F193 P196 H198 L201 W204 K311	Y183-L313 HydrophobicContact CE1-CD1 3.97Å; F193-L313 HydrophobicContact CE2-CD1 4.09Å; F193-L313 HydrophobicContact CZ-CD1 4.36Å; P196-L313 HydrophobicContact CB-CB 4.4Å; P196-L313 HydrophobicContact CG-CD1 3.97Å; H198-L313 PolarHBondContact CE1-OXT 3.41Å; H198-L313 VanDerWaalsContact CE1-OXT 3.23Å; L201-L313 HydrophobicContact CD2-CD1 4.29Å; L201-L313 HydrophobicContact CD2-CD2 3.81Å; W204-L313 VanDerWaalsContact CD1-CD2 3.47Å; W204-L313 HydrophobicContact CD2-CD2 3.95Å; W204-L313 HydrophobicContact CG-CD2 3.85Å; W204-L313 HydrophobicContact CZ2-CD1 3.8Å; W204-L313 HydrophobicContact CZ2-CD2 4.29Å; W204-L313 HydrophobicContact CZ2-CG 4.37Å; W204-L313 VanDerWaalsContact NE1-CD2 3.31Å; K311-L313 PolarHBondContact O-N 2.93Å

Retrieved 313 of 313 residues in 241.3 ms (Link to these results)

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