A0A087YLR4_POEFO Loading...

A-kinase anchoring protein 10

AlphaFold DB , UniProt , Accession A0A087YLR4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 604 aa.

Structure Viewer

Loading PAE data...

(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	30.6	Very low	35.3	Very low	238 Å²	238	176.1 Å²	176.1	100%	1.172	85%	0.849	S	S	*	*				0	151.3	0	-63.5	171.4	176.6	0	0	108.9
2	S	38.7	Very low	34.6	Very low	91 Å²	91	175.3 Å²	175.3	64%	0.636	84%	0.843	S	S	*	*			cis	-177.2	153.4	-33.9	-85.8	0	0	0	0	109.5
3	F	34.3	Very low	35.3	Very low	183 Å²	183	169.4 Å²	169.4	80%	0.803	83%	0.827	S	S	*	*			trans	63.1	174.3	162.3	-58.4	-60.2	0	0	0	118
4	F	39.1	Very low	34.8	Very low	173 Å²	173	168.9 Å²	168.9	76%	0.759	82%	0.822	S	S	*	*			cis	-147.2	167.5	-5.3	-132.4	-66	0	0	0	110.2
5	K	42.4	Very low	34.5	Very low	196 Å²	196	172.3 Å²	172.3	85%	0.852	82%	0.823	S	S	*	*			trans	-48.8	157.1	169.5	-68.6	176.3	171.4	176.8	0	114.9
6	R	40	Very low	34.1	Very low	244 Å²	244	169.1 Å²	169.1	92%	0.921	82%	0.817	S	S	*	*			trans	-145.3	166.3	170.1	-160.3	173.3	-75	-177.3	-1.9	113.9
7	K	37.5	Very low	33.9	Very low	196 Å²	196	166.7 Å²	166.7	85%	0.852	82%	0.816	S	S	*	*			trans	-68.9	151.3	-171.1	-63	180	171.6	-177.5	0	117.4
8	A	36.2	Very low	33.7	Very low	100 Å²	100	165.6 Å²	165.6	83%	0.826	81%	0.814	S	S	*	*			trans	51	149	133	0	0	0	0	0	122.9
9	K	31.9	Very low	33.5	Very low	210 Å²	210	160.9 Å²	160.9	91%	0.913	80%	0.804	S	S	*	*				177	157.7	116.4	-166.8	158.9	180	177.5	0	113.5
10	S	27.6	Very low	33.3	Very low	103 Å²	103	162.6 Å²	162.6	72%	0.72	81%	0.806	S	S	*	*			trans	-66.1	152.7	177.9	155.9	0	0	0	0	116.2
11	K	30.5	Very low	33	Very low	203 Å²	203	160.7 Å²	160.7	88%	0.883	80%	0.803	S	S	*	*				-175.1	158.2	123.9	-109.8	-167.7	172.9	-162.1	0	117.6
12	E	26.6	Very low	32.8	Very low	167 Å²	167	156.5 Å²	156.5	78%	0.78	79%	0.786	S	S	*	*			trans	-80.1	176.4	160.6	-122.3	-170.1	124.6	0	0	111.3
13	P	43.9	Very low	32.3	Very low	98 Å²	98	161.4 Å²	161.4	64%	0.636	80%	0.796	S	S	*	*			cis	-143.1	-154.6	44.3	41.2	-16.9	0	0	0	113.7
14	E	27.6	Very low	32	Very low	162 Å²	162	159.1 Å²	159.1	76%	0.757	80%	0.796	S	S	*	*			cis	-147.5	-124.9	4.2	-157.9	134.5	138.4	0	0	115.4
15	R	30.1	Very low	31.7	Very low	220 Å²	220	156.1 Å²	156.1	83%	0.83	79%	0.794	S	S	*	*			trans	-155.7	146.1	-152	-89.5	-179.3	161.8	-171	-4.9	118.7
16	V	29.4	Very low	31	Very low	121 Å²	121	153.5 Å²	153.5	73%	0.733	79%	0.794	S	S	*	*			trans	67.8	157	137.3	176.7	0	0	0	0	116.8
17	T	29.4	Very low	30.4	Very low	129 Å²	129	146.7 Å²	146.7	79%	0.791	78%	0.784	S	S	*	*			cis	-151.8	175.7	10.8	7.3	0	0	0	0	107.4
18	D	30.1	Very low	30.4	Very low	147 Å²	147	142.3 Å²	142.3	79%	0.786	78%	0.776	S	S	*	*			cis	-177.2	169.4	-35.5	-179	36.2	0	0	0	110.5
19	A	30.8	Very low	29.8	Very low	76 Å²	76	146.6 Å²	146.6	63%	0.628	78%	0.778	S	S	*	*			trans	74.9	125.7	154.5	0	0	0	0	0	124.9
20	K	29.3	Very low	29.8	Very low	195 Å²	195	141.7 Å²	141.7	85%	0.848	77%	0.771	S	S	*	*			trans	84.4	98.8	134.2	-83.9	-175.3	171.4	174.9	0	125.2
21	V	27.9	Very low	30.2	Very low	122 Å²	122	142.3 Å²	142.3	74%	0.739	77%	0.772	S	S	*	*				71.5	120.9	104.3	167.8	0	0	0	0	122.7
22	N	26.3	Very low	30.1	Very low	151 Å²	151	137.1 Å²	137.1	81%	0.807	76%	0.762	S	S	*	*			trans	102.4	147.7	139.4	-106.1	-20	0	0	0	124.9
23	K	26.8	Very low	30.1	Very low	193 Å²	193	138 Å²	138	84%	0.839	77%	0.765	S	S	*	*			trans	84.2	122.8	157.1	-77.5	-176.1	175.2	-177.3	0	122.6
24	V	28.1	Very low	29.1	Very low	135 Å²	135	136.1 Å²	136.1	82%	0.818	76%	0.763	S	S	*	*			trans	-84.7	143.4	156.6	165.7	0	0	0	0	107.8
25	P	34.2	Very low	29.2	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	77%	0.768	S	S	*	*				-161.9	168.6	92.3	43.5	-22.4	0	0	0	120.8
26	V	25.8	Very low	29	Very low	141 Å²	141	134.9 Å²	134.9	86%	0.855	77%	0.769	S	S	*	*			trans	76.9	147.2	144	158.6	0	0	0	0	120.6
27	S	28.8	Very low	28.9	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	78%	0.777	S	S	*	*			trans	-120.1	154.7	176.5	167.6	0	0	0	0	109.9
28	P	36.6	Very low	29	Very low	103 Å²	103	139 Å²	139	67%	0.669	78%	0.776	S	S	*	*			trans	-149.6	155.7	134.7	34.8	-17.1	0	0	0	118.3
29	H	25.1	Very low	28.9	Very low	190 Å²	190	138.9 Å²	138.9	88%	0.88	78%	0.775	S	S	*	*			trans	57.6	124.7	145.2	-69.4	-58.2	0	0	0	124.3
30	S	30.4	Very low	28.7	Very low	108 Å²	108	140 Å²	140	76%	0.755	78%	0.784	S	S	*	*			trans	-75.2	170.9	152.6	-31.3	0	0	0	0	112
31	P	36.2	Very low	28.7	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	79%	0.785	S	S	*	*				-159	157	92.7	41.9	-22.5	0	0	0	120.3
32	S	27.8	Very low	29.3	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	79%	0.793	S	S	*	*			trans	69.4	156	134.4	69.1	0	0	0	0	126.3
33	H	26.8	Very low	29.4	Very low	185 Å²	185	140.4 Å²	140.4	86%	0.856	80%	0.796	S	S	*	*			trans	72	138.9	172.2	-64.1	-88.8	0	0	0	119.5
34	G	24.2	Very low	29.6	Very low	58 Å²	58	135.3 Å²	135.3	60%	0.598	79%	0.79	S	S	*	*			cis	171.3	162.4	-8.8	0	0	0	0	0	115.1
35	L	28.1	Very low	30	Very low	165 Å²	165	134.1 Å²	134.1	86%	0.864	79%	0.794	S	S	*	*			trans	67.5	127	-176.9	-62.7	97.3	0	0	0	115.1
36	K	27.8	Very low	30.2	Very low	192 Å²	192	131.6 Å²	131.6	84%	0.835	79%	0.787	S	S	*	*			cis	92.5	107.2	41.4	-83.4	-167.2	171.1	-173.2	0	114.1
37	N	26.7	Very low	30.9	Very low	170 Å²	170	130.3 Å²	130.3	91%	0.909	78%	0.782	S	S	*	*				-163.9	175	129.4	-101.9	-17.1	0	0	0	111.4
38	H	31.7	Very low	31.5	Very low	166 Å²	166	128.9 Å²	128.9	77%	0.769	77%	0.772	S	S	*	*			trans	-114.3	163	-155.2	-120.5	-97.4	0	0	0	115
39	N	28.1	Very low	31.9	Very low	145 Å²	145	131.4 Å²	131.4	78%	0.775	78%	0.775	S	S	*	*			trans	70.5	111	159.4	-57	-12	0	0	0	119.4
40	A	26.3	Very low	32.6	Very low	99 Å²	99	129.3 Å²	129.3	82%	0.818	77%	0.767	S	S	*	*			trans	-152.2	128.9	145	0	0	0	0	0	111.7
41	V	28.9	Very low	33.2	Very low	142 Å²	142	126.4 Å²	126.4	86%	0.861	75%	0.75	S	S	*	*			trans	-0.4	141.9	158.1	-173.1	0	0	0	0	119.9
42	L	40.3	Very low	33.6	Very low	172 Å²	172	126 Å²	126	90%	0.901	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-60.5	124.2	166.3	-70.8	156	0	0	0	111.9
43	D	29.2	Very low	34.3	Very low	163 Å²	163	123.7 Å²	123.7	87%	0.872	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-92.9	139.8	169.1	-158	-0.1	0	0	0	110.7
44	A	30.8	Very low	35.2	Very low	86 Å²	86	117.7 Å²	117.7	71%	0.711	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-87.6	135.1	-171.5	0	0	0	0	0	111.4	G46	A44-G46 PolarHBondContact O-N 3.03Å
45	A	35.1	Very low	36.2	Very low	110 Å²	110	120.1 Å²	120.1	91%	0.909	70%	0.704	S	S	*	*			trans	-66.5	102.7	179.6	0	0	0	0	0	111.3
46	G	39.8	Very low	36.8	Very low	56 Å²	56	115.8 Å²	115.8	58%	0.577	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-63.4	172	169.8	0	0	0	0	0	113.1	A44 S48	A44-G46 PolarHBondContact O-N 3.03Å; G46-S48 PolarHBondContact O-N 2.91Å
47	P	40.7	Very low	37.5	Very low	115 Å²	115	109.3 Å²	109.3	75%	0.747	67%	0.67	S	S	*	*	S	Bend	trans	-55.1	139.3	-177.8	23.5	-34.4	0	0	0	111.7	H49	P47-H49 PolarHBondContact O-N 3.1Å
48	S	41.1	Very low	38.1	Very low	71 Å²	71	105.8 Å²	105.8	50%	0.497	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-59.8	131.2	-164.4	69.3	0	0	0	0	112.5	G46 M50 A51	G46-S48 PolarHBondContact O-N 2.91Å; S48-M50 PolarHBondContact O-N 3.15Å; S48-A51 PolarHBondContact O-N 3.49Å
49	H	44.1	Very low	38.8	Very low	157 Å²	157	104.4 Å²	104.4	73%	0.727	65%	0.647	S	S	*	*	H	α-helix	trans	-55.6	-25	175.4	-172.1	-73.8	0	0	0	112	P47 I52 S53	P47-H49 PolarHBondContact O-N 3.1Å; H49-I52 PolarHBondContact O-N 3.23Å; H49-S53 VanDerWaalsContact O-CB 3.31Å; H49-S53 WeakPolarHBondContact O-CB 3.35Å; H49-S53 PolarHBondContact O-N 2.89Å; H49-S53 PolarHBondContact O-OG 3.1Å
50	M	41.1	Very low	39.3	Very low	145 Å²	145	101.4 Å²	101.4	71%	0.714	63%	0.631	S	S	*	*	H	α-helix	trans	-52.4	-51	170.7	-67.4	-68.2	-74.7	0	0	112.3	S48 I52 S53 A54	S48-M50 PolarHBondContact O-N 3.15Å; M50-I52 PolarHBondContact O-N 2.95Å; M50-S53 WeakPolarHBondContact CA-OG 3.49Å; M50-S53 PolarHBondContact O-N 3.5Å; M50-S53 PolarHBondContact O-OG 3.47Å; M50-A54 WeakPolarHBondContact O-CB 3.46Å; M50-A54 PolarHBondContact O-N 2.9Å
51	A	42.7	Very low	39.8	Very low	48 Å²	48	100.8 Å²	100.8	40%	0.397	62%	0.621	S	S	.	*	H	α-helix	trans	-63.5	-44.1	-177.7	0	0	0	0	0	112.4	S48 S53 A54 I55	S48-A51 PolarHBondContact O-N 3.49Å; A51-S53 VanDerWaalsContact C-N 3.34Å; A51-S53 PolarHBondContact O-N 2.99Å; A51-A54 PolarHBondContact O-N 3.19Å; A51-I55 WeakPolarHBondContact O-CG1 3.45Å; A51-I55 PolarHBondContact O-N 2.78Å
52	I	45.1	Very low	40.4	Very low	106 Å²	106	102.3 Å²	102.3	54%	0.544	62%	0.616	S	S	.	*	H	α-helix	trans	-66.1	-39.4	177.2	-60.1	172.7	0	0	0	110.5	H49 M50 S56	H49-I52 PolarHBondContact O-N 3.23Å; M50-I52 PolarHBondContact O-N 2.95Å; I52-S56 PolarHBondContact O-N 3.29Å
53	S	42	Very low	40.2	Very low	47 Å²	47	97.8 Å²	97.8	33%	0.329	60%	0.603	S	S	.	*	H	α-helix	trans	-69.9	-32.3	176.4	72.3	0	0	0	0	113.3	H49 M50 A51 S56 A57	H49-S53 VanDerWaalsContact O-CB 3.31Å; H49-S53 WeakPolarHBondContact O-CB 3.35Å; H49-S53 PolarHBondContact O-N 2.89Å; H49-S53 PolarHBondContact O-OG 3.1Å; M50-S53 WeakPolarHBondContact CA-OG 3.49Å; M50-S53 PolarHBondContact O-N 3.5Å; M50-S53 PolarHBondContact O-OG 3.47Å; A51-S53 VanDerWaalsContact C-N 3.34Å; A51-S53 PolarHBondContact O-N 2.99Å; S53-S56 PolarHBondContact O-N 3.1Å; S53-A57 VanDerWaalsContact O-CB 3.24Å; S53-A57 WeakPolarHBondContact O-CB 3.3Å; S53-A57 PolarHBondContact O-N 3.33Å
54	A	46.1	Very low	40.6	Very low	58 Å²	58	98.6 Å²	98.6	48%	0.479	59%	0.594	S	S	.	*	H	α-helix	trans	-65.2	-42.9	176.9	0	0	0	0	0	111.5	M50 A51 S56 A57 N58	M50-A54 WeakPolarHBondContact O-CB 3.46Å; M50-A54 PolarHBondContact O-N 2.9Å; A51-A54 PolarHBondContact O-N 3.19Å; A54-S56 PolarHBondContact O-N 2.94Å; A54-A57 PolarHBondContact O-N 3.33Å; A54-N58 WeakPolarHBondContact O-CB 3.48Å; A54-N58 PolarHBondContact O-N 3.42Å
55	I	43.9	Very low	40.7	Very low	109 Å²	109	97.9 Å²	97.9	56%	0.559	60%	0.595	S	S	*	*	H	α-helix	trans	-59.2	-46	175.9	-65.5	164.8	0	0	0	110.6	A51 M59	A51-I55 WeakPolarHBondContact O-CG1 3.45Å; A51-I55 PolarHBondContact O-N 2.78Å; I55-M59 WeakPolarHBondContact O-CG 3.34Å; I55-M59 PolarHBondContact O-N 3.41Å
56	S	42.1	Very low	40.7	Very low	75 Å²	75	103.9 Å²	103.9	52%	0.524	59%	0.594	S	S	.	*	H	α-helix	trans	-69.3	-40.1	176.4	-68.1	0	0	0	0	113.8	I52 S53 A54 N58 M59 D60	I52-S56 PolarHBondContact O-N 3.29Å; S53-S56 PolarHBondContact O-N 3.1Å; A54-S56 PolarHBondContact O-N 2.94Å; S56-N58 VanDerWaalsContact C-N 3.28Å; S56-N58 PolarHBondContact O-N 3.03Å; S56-M59 WeakPolarHBondContact O-CB 3.42Å; S56-M59 PolarHBondContact O-N 3.36Å; S56-D60 PolarHBondContact O-N 2.98Å
57	A	41.8	Very low	40.6	Very low	56 Å²	56	107.9 Å²	107.9	46%	0.463	61%	0.608	S	S	.	*	H	α-helix	trans	-66.4	-31.9	180	0	0	0	0	0	112.2	S53 A54 S61	S53-A57 VanDerWaalsContact O-CB 3.24Å; S53-A57 WeakPolarHBondContact O-CB 3.3Å; S53-A57 PolarHBondContact O-N 3.33Å; A54-A57 PolarHBondContact O-N 3.33Å; A57-S61 WeakPolarHBondContact O-CB 3.41Å; A57-S61 PolarHBondContact O-N 3.3Å; A57-S61 PolarHBondContact O-OG 3.44Å
58	N	39	Very low	40.1	Very low	95 Å²	95	106.9 Å²	106.9	51%	0.508	61%	0.609	S	S	.	*	H	α-helix	trans	-69.5	-42.3	174.8	-149.7	4.4	0	0	0	111.2	A54 S56 D60 S61 F62	A54-N58 WeakPolarHBondContact O-CB 3.48Å; A54-N58 PolarHBondContact O-N 3.42Å; S56-N58 VanDerWaalsContact C-N 3.28Å; S56-N58 PolarHBondContact O-N 3.03Å; N58-D60 PolarHBondContact O-N 3.12Å; N58-S61 PolarHBondContact O-N 3.43Å; N58-F62 WeakPolarHBondContact O-CD2 3.19Å; N58-F62 PolarHBondContact O-N 2.9Å; N58-F62 WeakPolarHBondContact OD1-CE2 3.29Å
59	M	47.2	Very low	39.6	Very low	137 Å²	137	111 Å²	111	68%	0.675	62%	0.624	S	S	*	*	H	α-helix	trans	-56.5	-44.8	174.2	-71.6	-108.6	64.2	0	0	113	I55 S56 S61	I55-M59 WeakPolarHBondContact O-CG 3.34Å; I55-M59 PolarHBondContact O-N 3.41Å; S56-M59 WeakPolarHBondContact O-CB 3.42Å; S56-M59 PolarHBondContact O-N 3.36Å; M59-S61 VanDerWaalsContact C-N 3.32Å; M59-S61 PolarHBondContact O-N 2.93Å
60	D	38.3	Very low	39.2	Very low	82 Å²	82	112.1 Å²	112.1	44%	0.439	63%	0.634	S	S	.	*	H	α-helix	trans	-70.9	-27.3	-178.9	-125.8	-46.1	0	0	0	113	S56 N58 R64	S56-D60 PolarHBondContact O-N 2.98Å; N58-D60 PolarHBondContact O-N 3.12Å; D60-R64 IonicContact OD1-CZ 2.75Å; D60-R64 VanDerWaalsContact OD1-CZ 3.23Å; D60-R64 IonicContact OD1-NE 3.36Å; D60-R64 PolarHBondContact OD1-NE 2.81Å; D60-R64 IonicContact OD1-NH2 3.23Å; D60-R64 PolarHBondContact OD1-NH2 3.27Å; D60-R64 IonicContact OD2-NH2 2.68Å
61	S	36.1	Very low	39.1	Very low	87 Å²	87	114.6 Å²	114.6	61%	0.608	64%	0.641	S	S	*	*	H	α-helix	trans	-74	-42.6	-175.9	-63.8	0	0	0	0	112.7	A57 N58 M59 A63	A57-S61 WeakPolarHBondContact O-CB 3.41Å; A57-S61 PolarHBondContact O-N 3.3Å; A57-S61 PolarHBondContact O-OG 3.44Å; N58-S61 PolarHBondContact O-N 3.43Å; M59-S61 VanDerWaalsContact C-N 3.32Å; M59-S61 PolarHBondContact O-N 2.93Å; S61-A63 VanDerWaalsContact C-N 3.34Å
62	F	42	Very low	38.7	Very low	174 Å²	174	122.2 Å²	122.2	76%	0.763	67%	0.665	S	S	*	*	H	α-helix	trans	-72.2	-26.3	175.4	-76.3	-79.6	0	0	0	113.1	N58 R64	N58-F62 WeakPolarHBondContact O-CD2 3.19Å; N58-F62 PolarHBondContact O-N 2.9Å; N58-F62 WeakPolarHBondContact OD1-CE2 3.29Å; F62-R64 VanDerWaalsContact C-N 3.29Å; F62-R64 PolarHBondContact O-N 3.42Å
63	A	36.9	Very low	37.9	Very low	76 Å²	76	125.5 Å²	125.5	63%	0.628	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-9	-174.6	0	0	0	0	0	115.6	S61	S61-A63 VanDerWaalsContact C-N 3.34Å
64	R	36.3	Very low	37.3	Very low	180 Å²	180	129.4 Å²	129.4	68%	0.679	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	4.9	-170.2	-62.1	-177.4	-170.1	-154.6	3.2	115.4	D60 F62 R66	D60-R64 IonicContact OD1-CZ 2.75Å; D60-R64 VanDerWaalsContact OD1-CZ 3.23Å; D60-R64 IonicContact OD1-NE 3.36Å; D60-R64 PolarHBondContact OD1-NE 2.81Å; D60-R64 IonicContact OD1-NH2 3.23Å; D60-R64 PolarHBondContact OD1-NH2 3.27Å; D60-R64 IonicContact OD2-NH2 2.68Å; F62-R64 VanDerWaalsContact C-N 3.29Å; F62-R64 PolarHBondContact O-N 3.42Å; R64-R66 PolarHBondContact O-N 2.93Å
65	G	32.8	Very low	36.6	Very low	71 Å²	71	131.5 Å²	131.5	73%	0.732	71%	0.713	S	S	*	*	S	Bend	trans	-67.9	114.1	166.3	0	0	0	0	0	111.1	T67	G65-T67 PolarHBondContact O-N 2.83Å
66	R	35.5	Very low	36.1	Very low	237 Å²	237	134.2 Å²	134.2	89%	0.894	72%	0.723	S	S	*	*			trans	-78.1	126.8	-162.5	-61.9	-178.9	-167.3	151.1	5.2	114.6	R64	R64-R66 PolarHBondContact O-N 2.93Å
67	T	37.9	Very low	35.7	Very low	140 Å²	140	137.8 Å²	137.8	86%	0.859	73%	0.734	S	S	*	*			trans	-17.8	126.9	155	54.1	0	0	0	0	117.5	G65	G65-T67 PolarHBondContact O-N 2.83Å
68	A	30.1	Very low	35	Very low	93 Å²	93	141.8 Å²	141.8	77%	0.769	74%	0.743	S	S	*	*			trans	-146.5	109.3	155.9	0	0	0	0	0	111.9
69	I	30.5	Very low	34.9	Very low	159 Å²	159	140 Å²	140	82%	0.815	74%	0.742	S	S	*	*			trans	57.6	104.2	159.5	-52.8	172.7	0	0	0	117.4	K71	I69-K71 PolarHBondContact O-N 3.47Å; I69-K71 VanDerWaalsContact O-N 3.14Å
70	L	36.3	Very low	34.2	Very low	180 Å²	180	137.3 Å²	137.3	94%	0.942	74%	0.741	S	S	*	*			trans	-67.6	100.4	161.3	-107.8	76.1	0	0	0	110.9
71	K	39.4	Very low	34	Very low	197 Å²	197	141.9 Å²	141.9	86%	0.857	76%	0.759	S	S	*	*			trans	-159.9	56.4	154.1	-134.8	176.5	-175.5	-179.9	0	118.4	I69	I69-K71 PolarHBondContact O-N 3.47Å; I69-K71 VanDerWaalsContact O-N 3.14Å
72	K	34.4	Very low	34.3	Very low	207 Å²	207	144.7 Å²	144.7	90%	0.9	76%	0.761	S	S	*	*	S	Bend	trans	-152.3	153.4	145.7	-116.3	-178.2	179.3	-173.6	0	109
73	Q	26.9	Very low	34.1	Very low	176 Å²	176	139.3 Å²	139.3	82%	0.822	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-63.5	149.8	163.2	-75.3	176	-46.3	0	0	108.6	S75	Q73-S75 PolarHBondContact O-N 2.84Å; Q73-S75 VanDerWaalsContact O-N 3.1Å
74	P	30.8	Very low	34.4	Very low	129 Å²	129	141 Å²	141	84%	0.838	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-58.6	117.7	161.5	27.3	-32.2	0	0	0	107	H76	P74-H76 PolarHBondContact O-N 3.49Å
75	S	30	Very low	35.2	Very low	101 Å²	101	133.6 Å²	133.6	71%	0.706	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-64.3	121	173.4	44.9	0	0	0	0	108.1	Q73 M77	Q73-S75 PolarHBondContact O-N 2.84Å; Q73-S75 VanDerWaalsContact O-N 3.1Å; S75-M77 PolarHBondContact O-N 3.22Å
76	H	33.1	Very low	35.6	Very low	166 Å²	166	131 Å²	131	77%	0.769	70%	0.7	S	S	*	*			trans	-49.8	106.3	162.1	-179.4	-85.7	0	0	0	108	P74 E78	P74-H76 PolarHBondContact O-N 3.49Å; H76-E78 PolarHBondContact O-N 2.91Å
77	M	33.5	Very low	35.9	Very low	150 Å²	150	127.7 Å²	127.7	74%	0.739	69%	0.694	S	S	*	*			trans	-75.7	88.5	174.1	-84.8	-179.8	55.4	0	0	107.2	S75 A79 F82	S75-M77 PolarHBondContact O-N 3.22Å; M77-A79 PolarHBondContact O-N 3.45Å; M77-F82 HydrophobicContact CE-CE2 3.91Å; M77-F82 HydrophobicContact CE-CZ 4.06Å
78	E	28	Very low	35.9	Very low	140 Å²	140	124.5 Å²	124.5	65%	0.654	68%	0.677	S	S	*	*			trans	-56.8	125.7	179	-169.9	170.8	-173.3	0	0	110.3	H76 A80	H76-E78 PolarHBondContact O-N 2.91Å; E78-A80 HydrophobicContact CG-CB 4.17Å; E78-A80 PolarHBondContact O-N 2.71Å
79	A	37.7	Very low	36.3	Very low	59 Å²	59	125.7 Å²	125.7	49%	0.488	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-62.2	-10.4	-172.5	0	0	0	0	0	114.3	M77 H81 F82	M77-A79 PolarHBondContact O-N 3.45Å; A79-H81 PolarHBondContact O-N 3.06Å; A79-F82 PolarHBondContact O-N 3.47Å
80	A	31.4	Very low	36.5	Very low	79 Å²	79	122.7 Å²	122.7	65%	0.653	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-60.8	-2.9	-179.3	0	0	0	0	0	116.1	E78	E78-A80 HydrophobicContact CG-CB 4.17Å; E78-A80 PolarHBondContact O-N 2.71Å
81	H	35	Very low	36.3	Very low	178 Å²	178	121.9 Å²	121.9	82%	0.824	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-123.7	14	-177.5	-89.8	-56.7	0	0	0	116.6	A79	A79-H81 PolarHBondContact O-N 3.06Å
82	F	42.4	Very low	36.3	Very low	147 Å²	147	117.2 Å²	117.2	65%	0.645	64%	0.643	S	S	*	*			trans	-100.2	56	166.2	-75.4	-76.7	0	0	0	112.3	M77 A79	M77-F82 HydrophobicContact CE-CE2 3.91Å; M77-F82 HydrophobicContact CE-CZ 4.06Å; A79-F82 PolarHBondContact O-N 3.47Å
83	G	37.7	Very low	36	Very low	60 Å²	60	113.3 Å²	113.3	62%	0.619	63%	0.628	S	S	*	*			trans	-96.8	11.2	178.3	0	0	0	0	0	115.4	G396	G83-G396 WeakPolarHBondContact O-CA 3.37Å
84	D	42.3	Very low	36.6	Very low	113 Å²	113	110.3 Å²	110.3	60%	0.604	62%	0.624	S	S	*	*			trans	-137.9	103.9	-178.4	-173.6	18	0	0	0	111.5	G86 G396	D84-G86 VanDerWaalsContact C-N 3.25Å; D84-G86 WeakPolarHBondContact OD1-CA 3.45Å; D84-G86 PolarHBondContact OD1-N 2.84Å; D84-G396 WeakPolarHBondContact CA-O 3.22Å
85	L	54.2	Low	36.9	Very low	23 Å²	23	109.1 Å²	109.1	12%	0.12	61%	0.607	C	S	.	*			trans	-83.7	0.6	167.5	-69.4	177.3	0	0	0	112.4	L395 G396 F397 Q426 T430	L85-L395 HydrophobicContact CD1-CB 4.26Å; L85-L395 WeakPolarHBondContact CD1-O 3.23Å; L85-L395 VanDerWaalsContact CG-O 3.26Å; L85-L395 WeakPolarHBondContact CG-O 3.42Å; L85-G396 PolarHBondContact N-O 2.68Å; L85-F397 HydrophobicContact CB-CD1 4.38Å; L85-F397 HydrophobicContact CD1-CD1 3.79Å; L85-F397 HydrophobicContact CD1-CD2 4.41Å; L85-F397 HydrophobicContact CD1-CE1 3.52Å; L85-F397 HydrophobicContact CD1-CE2 4.21Å; L85-F397 HydrophobicContact CD1-CG 4.23Å; L85-F397 HydrophobicContact CD1-CZ 3.76Å; L85-Q426 HydrophobicContact CB-CG 3.99Å; L85-Q426 WeakPolarHBondContact O-CG 3.5Å; L85-Q426 PolarHBondContact O-NE2 3.22Å; L85-T430 HydrophobicContact CD2-CG2 3.95Å; L85-T430 WeakPolarHBondContact CD2-OG1 3.39Å
86	G	40.5	Very low	37.3	Very low	17 Å²	17	112.5 Å²	112.5	18%	0.175	61%	0.612	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	167.5	-155.7	0	0	0	0	0	117.7	D84 S88	D84-G86 VanDerWaalsContact C-N 3.25Å; D84-G86 WeakPolarHBondContact OD1-CA 3.45Å; D84-G86 PolarHBondContact OD1-N 2.84Å; G86-S88 PolarHBondContact O-N 3.05Å
87	H	40.7	Very low	37.8	Very low	168 Å²	168	108 Å²	108	78%	0.778	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.8	5.5	164.1	-58.2	-68.4	0	0	0	119.2	S89	H87-S89 PolarHBondContact O-N 3.33Å
88	S	39.3	Very low	38.6	Very low	72 Å²	72	107.6 Å²	107.6	50%	0.503	59%	0.586	S	S	.	*			trans	-73.4	68.8	174.7	-71	0	0	0	0	113.5	G86 V90	G86-S88 PolarHBondContact O-N 3.05Å; S88-V90 PolarHBondContact O-N 3.02Å
89	S	37.1	Very low	39.9	Very low	118 Å²	118	101 Å²	101	83%	0.825	56%	0.556	S	S	*	*			trans	-75.8	52.5	177.1	51.6	0	0	0	0	113.5	H87	H87-S89 PolarHBondContact O-N 3.33Å
90	V	36	Very low	40.9	Very low	97 Å²	97	101.2 Å²	101.2	59%	0.588	54%	0.544	S	S	*	.			trans	-78	135.8	173.6	-169.3	0	0	0	0	109.8	S88 Y92 R425	S88-V90 PolarHBondContact O-N 3.02Å; V90-Y92 PolarHBondContact O-N 3.42Å; V90-R425 PolarHBondContact O-NH1 3.22Å
91	N	30.9	Very low	42	Very low	163 Å²	163	97.7 Å²	97.7	87%	0.872	51%	0.514	S	S	*	.			trans	-65.5	95.4	175.9	-90.5	-25.7	0	0	0	110.9
92	Y	39.3	Very low	42.8	Very low	99 Å²	99	91.2 Å²	91.2	39%	0.388	49%	0.489	S	S	.	.			trans	-78.3	116.2	164.3	173.9	-102.2	0	0	0	109	V90 P94 R425	V90-Y92 PolarHBondContact O-N 3.42Å; Y92-P94 HydrophobicContact CE1-CB 3.99Å; Y92-R425 HydrophobicContact CG-CG 4.3Å
93	Q	29.8	Very low	43.6	Very low	125 Å²	125	85.3 Å²	85.3	58%	0.584	46%	0.463	S	S	*	.			trans	-84.1	130.3	163.3	-164.3	168.5	-21.3	0	0	107.4	Q95	Q93-Q95 HydrophobicContact CG-CG 4.01Å; Q93-Q95 VanDerWaalsContact NE2-CD 3.34Å; Q93-Q95 PolarHBondContact O-N 3.25Å
94	P	38.5	Very low	44.5	Very low	112 Å²	112	85.1 Å²	85.1	73%	0.727	45%	0.45	S	S	*	.			trans	-73.1	74.9	176.1	30.6	-34.7	0	0	0	109.8	Y92	Y92-P94 HydrophobicContact CE1-CB 3.99Å
95	Q	38.3	Very low	45.2	Very low	104 Å²	104	80.6 Å²	80.6	49%	0.486	43%	0.426	S	S	.	.			trans	-117.5	116.8	-177.3	-96.7	-178	-44.5	0	0	110.8	Q93 T97	Q93-Q95 HydrophobicContact CG-CG 4.01Å; Q93-Q95 VanDerWaalsContact NE2-CD 3.34Å; Q93-Q95 PolarHBondContact O-N 3.25Å; Q95-T97 PolarHBondContact O-N 3.37Å; Q95-T97 VanDerWaalsContact O-N 3.13Å
96	E	37.7	Very low	45.3	Very low	172 Å²	172	82.3 Å²	82.3	80%	0.804	44%	0.435	S	S	*	.			trans	55.2	45	145.4	-61.2	173.8	-163.6	0	0	115	R98	E96-R98 PolarHBondContact O-N 3.44Å
97	T	42.4	Very low	46.4	Very low	71 Å²	71	83.9 Å²	83.9	44%	0.436	44%	0.438	S	S	.	.			trans	-67.6	47	168	46	0	0	0	0	113.1	Q95	Q95-T97 PolarHBondContact O-N 3.37Å; Q95-T97 VanDerWaalsContact O-N 3.13Å
98	R	51.8	Low	47.5	Very low	143 Å²	143	76 Å²	76	54%	0.54	40%	0.402	S	S	.	.			trans	-106.9	103.1	166.1	-68.7	-100.4	-173.6	76.1	7.9	107	E96	E96-R98 PolarHBondContact O-N 3.44Å
99	S	54.8	Low	48.6	Very low	2 Å²	2	72.8 Å²	72.8	1%	0.014	38%	0.379	C	S	.	.			trans	-37.9	139.5	167.2	164.4	0	0	0	0	112.3	M101 S102 A325 D326	S99-M101 PolarHBondContact O-N 3Å; S99-M101 WeakPolarHBondContact OG-CB 3.37Å; S99-M101 PolarHBondContact OG-N 2.86Å; S99-S102 WeakPolarHBondContact CB-OG 3.32Å; S99-S102 CarbonylContact O-C 3.54Å; S99-S102 PolarHBondContact O-N 2.85Å; S99-S102 PolarHBondContact OG-N 2.95Å; S99-S102 PolarHBondContact OG-OG 2.77Å; S99-A325 VanDerWaalsContact CB-O 3.24Å; S99-A325 WeakPolarHBondContact CB-O 3.33Å; S99-A325 PolarHBondContact OG-O 2.72Å; S99-D326 WeakPolarHBondContact OG-CA 3.43Å
100	R	58.3	Low	49.9	Very low	62 Å²	62	73.6 Å²	73.6	23%	0.234	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.5	174.4	-58	174.9	-65.2	175.9	2.2	110.6	K103 Y312 V316 S321 D326	R100-K103 WeakPolarHBondContact O-CD 3.34Å; R100-K103 WeakPolarHBondContact O-CE 3.44Å; R100-K103 WeakPolarHBondContact O-CG 3.29Å; R100-Y312 WeakPolarHBondContact O-CE1 3.34Å; R100-Y312 PolarHBondContact O-OH 3.26Å; R100-V316 HydrophobicContact CB-CG1 4.3Å; R100-S321 PolarHBondContact NH1-O 3.47Å; R100-S321 PolarHBondContact NH2-O 3.3Å; R100-D326 VanDerWaalsContact CB-OD1 3.26Å; R100-D326 WeakPolarHBondContact CB-OD1 3.48Å; R100-D326 WeakPolarHBondContact CG-OD1 3.48Å; R100-D326 IonicContact CZ-OD2 3.19Å; R100-D326 VanDerWaalsContact CZ-OD2 3.31Å; R100-D326 PolarHBondContact N-OD1 3.23Å; R100-D326 IonicContact NE-OD1 2.73Å; R100-D326 PolarHBondContact NE-OD1 2.85Å; R100-D326 IonicContact NE-OD2 3.16Å; R100-D326 PolarHBondContact NE-OD2 3.43Å; R100-D326 VanDerWaalsContact NE-OD2 3.15Å; R100-D326 IonicContact NH2-OD1 2.82Å; R100-D326 IonicContact NH2-OD2 3.14Å; R100-D326 PolarHBondContact NH2-OD2 3.39Å
101	M	54.3	Low	51.4	Low	5 Å²	5	71 Å²	71	3%	0.025	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-20.4	174.4	-58.7	170.7	73.9	0	0	112.3	S99 F309 Q313 V316 L317 D326 C330	S99-M101 PolarHBondContact O-N 3Å; S99-M101 WeakPolarHBondContact OG-CB 3.37Å; S99-M101 PolarHBondContact OG-N 2.86Å; M101-F309 VanDerWaalsContact O-CZ 3.26Å; M101-F309 WeakPolarHBondContact O-CZ 3.39Å; M101-Q313 HydrophobicContact CE-CB 3.88Å; M101-Q313 HydrophobicContact CE-CG 3.63Å; M101-Q313 HydrophobicContact CG-CG 4.5Å; M101-V316 HydrophobicContact CG-CG1 4.05Å; M101-V316 HydrophobicContact SD-CG1 4.45Å; M101-L317 HydrophobicContact CE-CD1 3.79Å; M101-L317 HydrophobicContact CE-CD2 4.25Å; M101-L317 HydrophobicContact CE-CG 4.07Å; M101-L317 HydrophobicContact SD-CD1 4.46Å; M101-L317 HydrophobicContact SD-CD2 3.91Å; M101-L317 HydrophobicContact SD-CG 4.1Å; M101-D326 HydrophobicContact CG-CB 4.35Å; M101-D326 HydrophobicContact SD-CB 3.88Å; M101-C330 HydrophobicContact CB-CB 4.24Å; M101-C330 HydrophobicContact CE-CB 3.93Å; M101-C330 WeakPolarHBondContact CE-SG 3.32Å; M101-C330 HydrophobicContact SD-CB 4.19Å
102	S	52	Low	53	Low	43 Å²	43	70.3 Å²	70.3	30%	0.301	34%	0.343	S	S	.	.	S	Bend	trans	-113.5	47.9	-174.9	-37.7	0	0	0	0	112.3	S99 F329	S99-S102 WeakPolarHBondContact CB-OG 3.32Å; S99-S102 CarbonylContact O-C 3.54Å; S99-S102 PolarHBondContact O-N 2.85Å; S99-S102 PolarHBondContact OG-N 2.95Å; S99-S102 PolarHBondContact OG-OG 2.77Å; S102-F329 VanDerWaalsContact OG-C 3.3Å; S102-F329 WeakPolarHBondContact OG-CB 3.49Å; S102-F329 PolarHBondContact OG-O 2.89Å
103	K	59	Low	54.4	Low	23 Å²	23	68.4 Å²	68.4	10%	0.1	34%	0.342	C	S	.	.			trans	-73.5	146.4	-178	-73.8	172.1	172.4	166.8	0	112.7	R100 Q107 V108 D111 A114 F300 Y312	R100-K103 WeakPolarHBondContact O-CD 3.34Å; R100-K103 WeakPolarHBondContact O-CE 3.44Å; R100-K103 WeakPolarHBondContact O-CG 3.29Å; K103-Q107 HydrophobicContact CB-CB 3.9Å; K103-Q107 HydrophobicContact CG-CB 4Å; K103-V108 HydrophobicContact CB-CG2 3.57Å; K103-V108 HydrophobicContact CD-CG2 3.8Å; K103-V108 HydrophobicContact CG-CG2 4.32Å; K103-D111 WeakPolarHBondContact CE-OD2 3.42Å; K103-D111 IonicContact NZ-OD1 3.21Å; K103-D111 PolarHBondContact NZ-OD1 2.98Å; K103-D111 IonicContact NZ-OD2 3.15Å; K103-D111 PolarHBondContact NZ-OD2 3.38Å; K103-A114 HydrophobicContact CD-CB 4.12Å; K103-F300 WeakPolarHBondContact O-CE1 3.43Å; K103-F300 VanDerWaalsContact O-CZ 3.25Å; K103-F300 WeakPolarHBondContact O-CZ 3.27Å; K103-Y312 WeakPolarHBondContact CE-OH 3.45Å; K103-Y312 PolarHBondContact NZ-OH 2.84Å
104	T	58.1	Low	56.3	Low	56 Å²	56	62.5 Å²	62.5	34%	0.344	31%	0.314	S	S	.	.			trans	-79.1	169.9	161	68.9	0	0	0	0	111.3	D106 Q107 V108	T104-D106 VanDerWaalsContact C-N 3.34Å; T104-D106 PolarHBondContact O-N 3.39Å; T104-Q107 CarbonylContact O-C 3.6Å; T104-Q107 WeakPolarHBondContact O-CA 3.25Å; T104-Q107 WeakPolarHBondContact O-CB 3.24Å; T104-Q107 PolarHBondContact O-N 2.78Å; T104-Q107 WeakPolarHBondContact OG1-CG 3.34Å; T104-Q107 PolarHBondContact OG1-N 3.27Å; T104-Q107 PolarHBondContact OG1-OE1 2.9Å; T104-V108 PolarHBondContact O-N 3.01Å
105	V	56.5	Low	58	Low	17 Å²	17	58.3 Å²	58.3	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-50.8	-51	174	176	0	0	0	0	112	Q107 V108 L109 I296 F300	V105-Q107 PolarHBondContact O-N 3.48Å; V105-V108 PolarHBondContact O-N 2.69Å; V105-L109 HydrophobicContact CG1-CD1 3.68Å; V105-L109 HydrophobicContact CG1-CG 4.36Å; V105-L109 WeakPolarHBondContact O-CB 3.48Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.48Å; V105-L109 PolarHBondContact O-N 3.34Å; V105-I296 HydrophobicContact CG1-CB 4.22Å; V105-I296 HydrophobicContact CG1-CG2 3.74Å; V105-F300 HydrophobicContact CG2-CB 3.59Å; V105-F300 HydrophobicContact CG2-CD1 3.57Å; V105-F300 HydrophobicContact CG2-CD2 4.08Å; V105-F300 HydrophobicContact CG2-CE1 4.28Å; V105-F300 HydrophobicContact CG2-CG 3.45Å; V105-F300 VanDerWaalsContact CG2-CG 3.45Å
106	D	56.7	Low	59.7	Low	59 Å²	59	56.9 Å²	56.9	32%	0.316	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-31.2	178.2	-175.6	67.3	0	0	0	112.6	T104 R110	T104-D106 VanDerWaalsContact C-N 3.34Å; T104-D106 PolarHBondContact O-N 3.39Å; D106-R110 VanDerWaalsContact CG-NH2 3.34Å; D106-R110 WeakPolarHBondContact O-CB 3.16Å; D106-R110 WeakPolarHBondContact O-CD 3.16Å; D106-R110 WeakPolarHBondContact O-CG 3.45Å; D106-R110 PolarHBondContact O-N 3.08Å; D106-R110 IonicContact OD1-CZ 2.71Å; D106-R110 IonicContact OD1-NE 3.21Å; D106-R110 PolarHBondContact OD1-NE 3.15Å; D106-R110 IonicContact OD1-NH2 3.95Å; D106-R110 PolarHBondContact OD1-NH2 2.72Å; D106-R110 IonicContact OD2-CZ 2.68Å; D106-R110 IonicContact OD2-NE 2.88Å; D106-R110 PolarHBondContact OD2-NE 3.18Å; D106-R110 VanDerWaalsContact OD2-NE 3.14Å; D106-R110 IonicContact OD2-NH2 3.79Å; D106-R110 PolarHBondContact OD2-NH2 2.82Å; D106-R110 VanDerWaalsContact OD2-NH2 3.16Å
107	Q	63	Low	61.3	Low	50 Å²	50	50.8 Å²	50.8	23%	0.234	26%	0.256	C	S	.	.	H	α-helix	trans	-80.2	-28.8	176.8	-69	176.8	-54.6	0	0	113.4	K103 T104 V105 D111	K103-Q107 HydrophobicContact CB-CB 3.9Å; K103-Q107 HydrophobicContact CG-CB 4Å; T104-Q107 CarbonylContact O-C 3.6Å; T104-Q107 WeakPolarHBondContact O-CA 3.25Å; T104-Q107 WeakPolarHBondContact O-CB 3.24Å; T104-Q107 PolarHBondContact O-N 2.78Å; T104-Q107 WeakPolarHBondContact OG1-CG 3.34Å; T104-Q107 PolarHBondContact OG1-N 3.27Å; T104-Q107 PolarHBondContact OG1-OE1 2.9Å; V105-Q107 PolarHBondContact O-N 3.48Å; Q107-D111 WeakPolarHBondContact O-CB 3.48Å; Q107-D111 PolarHBondContact O-N 3.42Å
108	V	63.9	Low	62.9	Low	2 Å²	2	47.4 Å²	47.4	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-74.2	-42.6	171.3	166.8	0	0	0	0	111.1	K103 T104 V105 R110 D111 A114 F118 F300	K103-V108 HydrophobicContact CB-CG2 3.57Å; K103-V108 HydrophobicContact CD-CG2 3.8Å; K103-V108 HydrophobicContact CG-CG2 4.32Å; T104-V108 PolarHBondContact O-N 3.01Å; V105-V108 PolarHBondContact O-N 2.69Å; V108-R110 PolarHBondContact O-N 3.01Å; V108-D111 PolarHBondContact O-N 3.03Å; V108-A114 HydrophobicContact CB-CB 4.34Å; V108-A114 HydrophobicContact CG1-CB 4Å; V108-A114 HydrophobicContact CG2-CB 4.05Å; V108-F118 HydrophobicContact CG1-CB 3.54Å; V108-F118 HydrophobicContact CG1-CD1 4.1Å; V108-F118 HydrophobicContact CG1-CD2 4.27Å; V108-F118 HydrophobicContact CG1-CG 3.7Å; V108-F300 HydrophobicContact CB-CE2 4.02Å; V108-F300 HydrophobicContact CG1-CE2 4.43Å; V108-F300 HydrophobicContact CG2-CE2 3.6Å; V108-F300 HydrophobicContact CG2-CZ 3.99Å
109	L	63.1	Low	64	Low	5 Å²	5	42.7 Å²	42.7	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-21.8	179.9	-68.5	170.1	0	0	0	113.8	V105 M115 F118 V131 W134 I296	V105-L109 HydrophobicContact CG1-CD1 3.68Å; V105-L109 HydrophobicContact CG1-CG 4.36Å; V105-L109 WeakPolarHBondContact O-CB 3.48Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.48Å; V105-L109 PolarHBondContact O-N 3.34Å; L109-M115 HydrophobicContact CB-CE 4.5Å; L109-M115 HydrophobicContact CD2-CE 3.84Å; L109-M115 HydrophobicContact CD2-SD 3.96Å; L109-F118 HydrophobicContact CD2-CD1 4.09Å; L109-F118 HydrophobicContact CD2-CE1 3.92Å; L109-V131 HydrophobicContact CD2-CG1 4.04Å; L109-W134 HydrophobicContact CB-CD2 4.28Å; L109-W134 HydrophobicContact CB-CE3 3.95Å; L109-W134 HydrophobicContact CB-CH2 3.66Å; L109-W134 HydrophobicContact CB-CZ2 3.96Å; L109-W134 HydrophobicContact CB-CZ3 3.65Å; L109-W134 HydrophobicContact CD1-CD2 3.83Å; L109-W134 HydrophobicContact CD1-CE3 4.3Å; L109-W134 HydrophobicContact CD1-CG 4.15Å; L109-W134 HydrophobicContact CD1-CZ2 4.09Å; L109-W134 HydrophobicContact CD2-CD2 4.44Å; L109-W134 HydrophobicContact CD2-CE3 4.27Å; L109-W134 HydrophobicContact CG-CD2 4.42Å; L109-W134 HydrophobicContact CG-CE3 4.41Å; L109-W134 WeakPolarHBondContact O-CZ3 3.28Å; L109-I296 HydrophobicContact CD1-CD1 4.07Å; L109-I296 HydrophobicContact CD1-CG2 4.29Å; L109-I296 HydrophobicContact CD2-CD1 4.31Å; L109-I296 HydrophobicContact CD2-CG2 4.44Å
110	R	64.3	Low	64.9	Low	136 Å²	136	46.7 Å²	46.7	51%	0.513	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-3.3	178.8	-65.7	175.2	-166.1	-140.3	17	114.6	D106 V108 W134	D106-R110 VanDerWaalsContact CG-NH2 3.34Å; D106-R110 WeakPolarHBondContact O-CB 3.16Å; D106-R110 WeakPolarHBondContact O-CD 3.16Å; D106-R110 WeakPolarHBondContact O-CG 3.45Å; D106-R110 PolarHBondContact O-N 3.08Å; D106-R110 IonicContact OD1-CZ 2.71Å; D106-R110 IonicContact OD1-NE 3.21Å; D106-R110 PolarHBondContact OD1-NE 3.15Å; D106-R110 IonicContact OD1-NH2 3.95Å; D106-R110 PolarHBondContact OD1-NH2 2.72Å; D106-R110 IonicContact OD2-CZ 2.68Å; D106-R110 IonicContact OD2-NE 2.88Å; D106-R110 PolarHBondContact OD2-NE 3.18Å; D106-R110 VanDerWaalsContact OD2-NE 3.14Å; D106-R110 IonicContact OD2-NH2 3.79Å; D106-R110 PolarHBondContact OD2-NH2 2.82Å; D106-R110 VanDerWaalsContact OD2-NH2 3.16Å; V108-R110 PolarHBondContact O-N 3.01Å; R110-W134 HydrophobicContact CG-CH2 3.97Å
111	D	66.8	Low	65.7	Low	42 Å²	42	43.8 Å²	43.8	23%	0.225	23%	0.228	C	C	.	.			trans	-108.4	123	-173	177.3	-79.4	0	0	0	112.2	K103 Q107 V108 V113 A114 M115	K103-D111 WeakPolarHBondContact CE-OD2 3.42Å; K103-D111 IonicContact NZ-OD1 3.21Å; K103-D111 PolarHBondContact NZ-OD1 2.98Å; K103-D111 IonicContact NZ-OD2 3.15Å; K103-D111 PolarHBondContact NZ-OD2 3.38Å; Q107-D111 WeakPolarHBondContact O-CB 3.48Å; Q107-D111 PolarHBondContact O-N 3.42Å; V108-D111 PolarHBondContact O-N 3.03Å; D111-V113 PolarHBondContact O-N 2.97Å; D111-V113 VanDerWaalsContact O-N 3.09Å; D111-V113 WeakPolarHBondContact OD1-CA 3.35Å; D111-V113 WeakPolarHBondContact OD1-CB 3.28Å; D111-V113 PolarHBondContact OD1-N 3.49Å; D111-A114 HydrophobicContact CB-CB 4.38Å; D111-A114 PolarHBondContact O-N 3.12Å; D111-A114 PolarHBondContact OD1-N 3.45Å; D111-M115 WeakPolarHBondContact O-CB 3.37Å; D111-M115 PolarHBondContact O-N 3.1Å
112	N	65.1	Low	66.4	Low	148 Å²	148	43.6 Å²	43.6	79%	0.791	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.1	-171.5	-57.3	-59.9	0	0	0	114.9	P116	N112-P116 VanDerWaalsContact O-CD 3.3Å; N112-P116 WeakPolarHBondContact O-CD 3.44Å; N112-P116 WeakPolarHBondContact O-CG 3.36Å
113	V	69.1	Low	67.6	Low	60 Å²	60	45.5 Å²	45.5	36%	0.364	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-38.6	-179.1	-170.2	0	0	0	0	110.8	D111 H117 Y312 E315	D111-V113 PolarHBondContact O-N 2.97Å; D111-V113 VanDerWaalsContact O-N 3.09Å; D111-V113 WeakPolarHBondContact OD1-CA 3.35Å; D111-V113 WeakPolarHBondContact OD1-CB 3.28Å; D111-V113 PolarHBondContact OD1-N 3.49Å; V113-H117 PolarHBondContact O-ND1 2.89Å; V113-Y312 HydrophobicContact CB-CE2 4.13Å; V113-Y312 HydrophobicContact CG1-CD2 4.09Å; V113-Y312 HydrophobicContact CG1-CE2 3.89Å; V113-E315 HydrophobicContact CG1-CG 4.31Å; V113-E315 VanDerWaalsContact CG1-OE2 3.25Å; V113-E315 WeakPolarHBondContact CG1-OE2 3.41Å
114	A	68.4	Low	68.2	Low	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-79.2	-35.2	175.9	0	0	0	0	0	112.9	K103 V108 D111 H117 F118 Y312	K103-A114 HydrophobicContact CD-CB 4.12Å; V108-A114 HydrophobicContact CB-CB 4.34Å; V108-A114 HydrophobicContact CG1-CB 4Å; V108-A114 HydrophobicContact CG2-CB 4.05Å; D111-A114 HydrophobicContact CB-CB 4.38Å; D111-A114 PolarHBondContact O-N 3.12Å; D111-A114 PolarHBondContact OD1-N 3.45Å; A114-H117 PolarHBondContact O-N 3.44Å; A114-F118 WeakPolarHBondContact O-CB 3.29Å; A114-F118 PolarHBondContact O-N 2.89Å; A114-Y312 HydrophobicContact CB-CD2 4.06Å; A114-Y312 HydrophobicContact CB-CE1 4.48Å; A114-Y312 HydrophobicContact CB-CE2 3.73Å
115	M	75.1	Confident	68.6	Low	25 Å²	25	51.9 Å²	51.9	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-41.2	-175.8	-175.8	60.7	144.1	0	0	114.1	L109 D111 H117 F118 L119 V131 L135	L109-M115 HydrophobicContact CB-CE 4.5Å; L109-M115 HydrophobicContact CD2-CE 3.84Å; L109-M115 HydrophobicContact CD2-SD 3.96Å; D111-M115 WeakPolarHBondContact O-CB 3.37Å; D111-M115 PolarHBondContact O-N 3.1Å; M115-H117 PolarHBondContact O-N 2.86Å; M115-F118 PolarHBondContact O-N 3.35Å; M115-F118 HydrophobicContact SD-CD1 4.42Å; M115-L119 WeakPolarHBondContact O-CB 3.3Å; M115-L119 PolarHBondContact O-N 2.96Å; M115-V131 HydrophobicContact CE-CG1 3.46Å; M115-V131 VanDerWaalsContact CE-CG1 3.46Å; M115-V131 HydrophobicContact SD-CG1 3.75Å; M115-L135 HydrophobicContact CE-CD1 4.45Å
116	P	73.6	Confident	68.9	Low	74 Å²	74	53 Å²	53	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-62.6	-42.1	174.8	-23.5	35	0	0	0	113	N112 F118 L119 H120	N112-P116 VanDerWaalsContact O-CD 3.3Å; N112-P116 WeakPolarHBondContact O-CD 3.44Å; N112-P116 WeakPolarHBondContact O-CG 3.36Å; P116-F118 VanDerWaalsContact C-N 3.35Å; P116-L119 PolarHBondContact O-N 2.87Å; P116-H120 WeakPolarHBondContact O-CB 3.42Å; P116-H120 PolarHBondContact O-N 3.19Å
117	H	71.5	Confident	69.3	Low	43 Å²	43	50.5 Å²	50.5	20%	0.199	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-38.9	176.3	-70.5	94.9	0	0	0	111.9	V113 A114 M115 C121 F303 E315	V113-H117 PolarHBondContact O-ND1 2.89Å; A114-H117 PolarHBondContact O-N 3.44Å; M115-H117 PolarHBondContact O-N 2.86Å; H117-C121 WeakPolarHBondContact O-CB 3.48Å; H117-C121 PolarHBondContact O-N 3.01Å; H117-C121 VanDerWaalsContact O-N 3.14Å; H117-F303 HydrophobicContact CB-CE2 4.22Å; H117-F303 HydrophobicContact CB-CZ 4.39Å; H117-E315 IonicContact CE1-OE2 2.7Å; H117-E315 PolarHBondContact CE1-OE2 3.07Å; H117-E315 IonicContact ND1-OE2 3.69Å
118	F	74.9	Confident	69.7	Low	1 Å²	1	49.7 Å²	49.7	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-46	175.9	-174.4	-116.2	0	0	0	112.2	V108 L109 A114 M115 P116 H120 C121 M122 V131 I296 F300 F303	V108-F118 HydrophobicContact CG1-CB 3.54Å; V108-F118 HydrophobicContact CG1-CD1 4.1Å; V108-F118 HydrophobicContact CG1-CD2 4.27Å; V108-F118 HydrophobicContact CG1-CG 3.7Å; L109-F118 HydrophobicContact CD2-CD1 4.09Å; L109-F118 HydrophobicContact CD2-CE1 3.92Å; A114-F118 WeakPolarHBondContact O-CB 3.29Å; A114-F118 PolarHBondContact O-N 2.89Å; M115-F118 PolarHBondContact O-N 3.35Å; M115-F118 HydrophobicContact SD-CD1 4.42Å; P116-F118 VanDerWaalsContact C-N 3.35Å; F118-H120 VanDerWaalsContact C-N 3.35Å; F118-H120 PolarHBondContact O-N 2.84Å; F118-C121 WeakPolarHBondContact O-CB 3.3Å; F118-C121 PolarHBondContact O-N 3.41Å; F118-M122 HydrophobicContact CD1-CG 4.44Å; F118-M122 HydrophobicContact CD2-CG 4.49Å; F118-M122 HydrophobicContact CE1-CG 4.07Å; F118-M122 HydrophobicContact CE2-CG 4.13Å; F118-M122 HydrophobicContact CE2-SD 4.33Å; F118-M122 HydrophobicContact CZ-CE 4.26Å; F118-M122 HydrophobicContact CZ-CG 3.9Å; F118-M122 HydrophobicContact CZ-SD 4.02Å; F118-M122 VanDerWaalsContact O-CG 3.25Å; F118-M122 WeakPolarHBondContact O-CG 3.46Å; F118-M122 PolarHBondContact O-N 2.85Å; F118-V131 HydrophobicContact CD1-CG1 4.42Å; F118-V131 HydrophobicContact CD1-CG2 4.18Å; F118-V131 HydrophobicContact CE1-CG2 3.74Å; F118-I296 HydrophobicContact CE1-CG2 3.62Å; F118-I296 HydrophobicContact CZ-CG2 3.52Å; F118-F300 HydrophobicContact CD2-CD2 4.46Å; F118-F300 HydrophobicContact CE2-CD2 4.04Å; F118-F303 HydrophobicContact CB-CE2 4.25Å; F118-F303 HydrophobicContact CB-CZ 4.27Å; F118-F303 HydrophobicContact CD2-CB 3.76Å; F118-F303 AromaticContact CD2-CD1 3.74Å; F118-F303 HydrophobicContact CD2-CD1 3.74Å; F118-F303 AromaticContact CD2-CD2 3.85Å; F118-F303 HydrophobicContact CD2-CD2 3.85Å; F118-F303 HydrophobicContact CD2-CE1 4.24Å; F118-F303 HydrophobicContact CD2-CE2 4.33Å; F118-F303 AromaticContact CD2-CG 3.51Å; F118-F303 HydrophobicContact CD2-CG 3.51Å; F118-F303 HydrophobicContact CE2-CB 3.78Å; F118-F303 HydrophobicContact CE2-CD1 4.34Å; F118-F303 HydrophobicContact CE2-CG 4.06Å
119	L	75.6	Confident	69.7	Low	43 Å²	43	51.7 Å²	51.7	23%	0.225	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-45	176.8	-178.7	63.3	0	0	0	111.1	M115 P116 C121 M122 E123 D128 V131 R132	M115-L119 WeakPolarHBondContact O-CB 3.3Å; M115-L119 PolarHBondContact O-N 2.96Å; P116-L119 PolarHBondContact O-N 2.87Å; L119-C121 VanDerWaalsContact C-N 3.35Å; L119-C121 PolarHBondContact O-N 3.34Å; L119-M122 CarbonylContact O-C 3.37Å; L119-M122 WeakPolarHBondContact O-CA 3.4Å; L119-M122 WeakPolarHBondContact O-CB 3.43Å; L119-M122 PolarHBondContact O-N 3.48Å; L119-E123 HydrophobicContact CG-CG 4.46Å; L119-E123 WeakPolarHBondContact O-CG 3.24Å; L119-E123 PolarHBondContact O-N 3.45Å; L119-D128 HydrophobicContact CD1-CB 4.19Å; L119-V131 HydrophobicContact CD1-CB 4.01Å; L119-V131 HydrophobicContact CD1-CG1 4.05Å; L119-R132 HydrophobicContact CD1-CG 4.27Å
120	H	74.5	Confident	69.8	Low	87 Å²	87	51.9 Å²	51.9	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-64.9	-37	178.3	-169.3	49.9	0	0	0	112.8	P116 F118 M122 E123 Q124 H308	P116-H120 WeakPolarHBondContact O-CB 3.42Å; P116-H120 PolarHBondContact O-N 3.19Å; F118-H120 VanDerWaalsContact C-N 3.35Å; F118-H120 PolarHBondContact O-N 2.84Å; H120-M122 VanDerWaalsContact C-N 3.26Å; H120-M122 PolarHBondContact O-N 3.41Å; H120-E123 IonicContact ND1-OE2 3.66Å; H120-E123 PolarHBondContact O-N 2.96Å; H120-Q124 PolarHBondContact NE2-NE2 2.97Å; H120-Q124 VanDerWaalsContact NE2-NE2 3.11Å; H120-Q124 WeakPolarHBondContact O-CG 3.44Å; H120-Q124 PolarHBondContact O-N 3.29Å; H120-Q124 VanDerWaalsContact O-N 3.09Å; H120-H308 AromaticContact CD2-CE1 3.3Å; H120-H308 PolarHBondContact CD2-CE1 3.38Å; H120-H308 AromaticContact CD2-ND1 3.62Å; H120-H308 AromaticContact NE2-CE1 3.86Å
121	C	73.3	Confident	70	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-33	170.6	-175.8	0	0	0	0	112.7	H117 F118 L119 R125 F303 H308	H117-C121 WeakPolarHBondContact O-CB 3.48Å; H117-C121 PolarHBondContact O-N 3.01Å; H117-C121 VanDerWaalsContact O-N 3.14Å; F118-C121 WeakPolarHBondContact O-CB 3.3Å; F118-C121 PolarHBondContact O-N 3.41Å; L119-C121 VanDerWaalsContact C-N 3.35Å; L119-C121 PolarHBondContact O-N 3.34Å; C121-R125 WeakPolarHBondContact O-CD 3.48Å; C121-R125 VanDerWaalsContact O-CG 3.29Å; C121-R125 WeakPolarHBondContact O-CG 3.44Å; C121-F303 HydrophobicContact CB-CD2 3.79Å; C121-F303 HydrophobicContact CB-CE2 4.49Å; C121-H308 HydrophobicContact CB-CB 4.13Å; C121-H308 VanDerWaalsContact CB-CD2 3.44Å; C121-H308 WeakPolarHBondContact CB-CD2 3.35Å
122	M	71	Confident	70	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-79.9	-34.5	178.6	-67	-73.7	-84.3	0	0	112	F118 L119 H120 R125 G126 A127 D128 L130 V131 H299	F118-M122 HydrophobicContact CD1-CG 4.44Å; F118-M122 HydrophobicContact CD2-CG 4.49Å; F118-M122 HydrophobicContact CE1-CG 4.07Å; F118-M122 HydrophobicContact CE2-CG 4.13Å; F118-M122 HydrophobicContact CE2-SD 4.33Å; F118-M122 HydrophobicContact CZ-CE 4.26Å; F118-M122 HydrophobicContact CZ-CG 3.9Å; F118-M122 HydrophobicContact CZ-SD 4.02Å; F118-M122 VanDerWaalsContact O-CG 3.25Å; F118-M122 WeakPolarHBondContact O-CG 3.46Å; F118-M122 PolarHBondContact O-N 2.85Å; L119-M122 CarbonylContact O-C 3.37Å; L119-M122 WeakPolarHBondContact O-CA 3.4Å; L119-M122 WeakPolarHBondContact O-CB 3.43Å; L119-M122 PolarHBondContact O-N 3.48Å; H120-M122 VanDerWaalsContact C-N 3.26Å; H120-M122 PolarHBondContact O-N 3.41Å; M122-R125 CarbonylContact O-C 3.54Å; M122-R125 PolarHBondContact O-N 2.9Å; M122-R125 VanDerWaalsContact O-N 3.11Å; M122-G126 PolarHBondContact O-N 2.92Å; M122-A127 HydrophobicContact CE-CB 3.6Å; M122-A127 WeakPolarHBondContact CE-O 3.3Å; M122-A127 PolarHBondContact O-N 2.93Å; M122-A127 HydrophobicContact SD-CB 3.92Å; M122-D128 PolarHBondContact O-N 2.97Å; M122-L130 HydrophobicContact CE-CD1 4.49Å; M122-V131 HydrophobicContact CB-CG2 4.03Å; M122-V131 HydrophobicContact CE-CG2 3.73Å; M122-V131 HydrophobicContact CG-CG2 3.77Å; M122-H299 HydrophobicContact CE-CB 3.87Å; M122-H299 HydrophobicContact SD-CB 3.39Å; M122-H299 WeakPolarHBondContact SD-CB 3.43Å
123	E	76.7	Confident	70	Confident	82 Å²	82	45 Å²	45	38%	0.383	23%	0.225	S	C	.	.	H	α-helix	trans	-61.9	-46.6	172	-73.9	174.1	167.3	0	0	111.6	L119 H120 R125 G126 D128 R132	L119-E123 HydrophobicContact CG-CG 4.46Å; L119-E123 WeakPolarHBondContact O-CG 3.24Å; L119-E123 PolarHBondContact O-N 3.45Å; H120-E123 IonicContact ND1-OE2 3.66Å; H120-E123 PolarHBondContact O-N 2.96Å; E123-R125 PolarHBondContact O-N 3.46Å; E123-G126 PolarHBondContact O-N 3.28Å; E123-G126 VanDerWaalsContact O-N 3.11Å; E123-D128 HydrophobicContact CB-CB 4.28Å; E123-D128 HydrophobicContact CG-CB 3.48Å; E123-D128 VanDerWaalsContact CG-CB 3.48Å; E123-R132 IonicContact OE1-CZ 2.67Å; E123-R132 IonicContact OE1-NH2 3.99Å; E123-R132 PolarHBondContact OE1-NH2 3.07Å
124	Q	72	Confident	70	Confident	109 Å²	109	42.6 Å²	42.6	51%	0.509	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-15.4	174	-69.9	-175.1	1.3	0	0	113.7	H120 H308	H120-Q124 PolarHBondContact NE2-NE2 2.97Å; H120-Q124 VanDerWaalsContact NE2-NE2 3.11Å; H120-Q124 WeakPolarHBondContact O-CG 3.44Å; H120-Q124 PolarHBondContact O-N 3.29Å; H120-Q124 VanDerWaalsContact O-N 3.09Å; Q124-H308 VanDerWaalsContact CD-NE2 3.29Å; Q124-H308 PolarHBondContact NE2-CE1 3.46Å; Q124-H308 VanDerWaalsContact NE2-CE1 3.28Å; Q124-H308 PolarHBondContact NE2-NE2 3.33Å; Q124-H308 PolarHBondContact OE1-NE2 2.77Å
125	R	66.4	Low	70	Confident	105 Å²	105	46.2 Å²	46.2	40%	0.396	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	3	-179.8	-63.9	174	-171.1	-99.7	9.9	113.4	C121 M122 E123 A127 E302	C121-R125 WeakPolarHBondContact O-CD 3.48Å; C121-R125 VanDerWaalsContact O-CG 3.29Å; C121-R125 WeakPolarHBondContact O-CG 3.44Å; M122-R125 CarbonylContact O-C 3.54Å; M122-R125 PolarHBondContact O-N 2.9Å; M122-R125 VanDerWaalsContact O-N 3.11Å; E123-R125 PolarHBondContact O-N 3.46Å; R125-A127 PolarHBondContact O-N 3.46Å; R125-E302 VanDerWaalsContact CZ-CG 3.44Å; R125-E302 IonicContact CZ-OE1 3.93Å; R125-E302 IonicContact NH1-OE1 3.77Å; R125-E302 PolarHBondContact NH1-OE1 2.84Å; R125-E302 IonicContact NH2-OE1 2.68Å; R125-E302 PolarHBondContact NH2-OE1 3.23Å
126	G	62.4	Low	69.3	Low	41 Å²	41	49.6 Å²	49.6	42%	0.423	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	15.7	-177.2	0	0	0	0	0	115.2	M122 E123 H129	M122-G126 PolarHBondContact O-N 2.92Å; E123-G126 PolarHBondContact O-N 3.28Å; E123-G126 VanDerWaalsContact O-N 3.11Å; G126-H129 PolarHBondContact O-CE1 2.75Å; G126-H129 PolarHBondContact O-ND1 2.95Å
127	A	64.4	Low	68.7	Low	5 Å²	5	46.7 Å²	46.7	4%	0.041	23%	0.226	C	C	.	.			trans	-105.7	2.7	-175.9	0	0	0	0	0	113.4	M122 R125 H129 L130	M122-A127 HydrophobicContact CE-CB 3.6Å; M122-A127 WeakPolarHBondContact CE-O 3.3Å; M122-A127 PolarHBondContact O-N 2.93Å; M122-A127 HydrophobicContact SD-CB 3.92Å; R125-A127 PolarHBondContact O-N 3.46Å; A127-H129 PolarHBondContact O-N 3.39Å; A127-L130 WeakPolarHBondContact O-CB 3.31Å; A127-L130 PolarHBondContact O-N 3.29Å
128	D	71.8	Confident	68.4	Low	33 Å²	33	46 Å²	46	18%	0.176	22%	0.223	C	C	.	.	H	α-helix	trans	-50.2	-38	177.5	61.1	-23	0	0	0	114.5	L119 M122 E123 L130 V131 R132	L119-D128 HydrophobicContact CD1-CB 4.19Å; M122-D128 PolarHBondContact O-N 2.97Å; E123-D128 HydrophobicContact CB-CB 4.28Å; E123-D128 HydrophobicContact CG-CB 3.48Å; E123-D128 VanDerWaalsContact CG-CB 3.48Å; D128-L130 PolarHBondContact O-N 3.49Å; D128-V131 WeakPolarHBondContact O-CB 3.46Å; D128-V131 PolarHBondContact O-N 3.07Å; D128-R132 VanDerWaalsContact CG-NH1 3.31Å; D128-R132 PolarHBondContact O-N 2.73Å; D128-R132 IonicContact OD2-CZ 3Å; D128-R132 IonicContact OD2-NH1 3.14Å; D128-R132 PolarHBondContact OD2-NH1 2.84Å; D128-R132 IonicContact OD2-NH2 2.84Å; D128-R132 PolarHBondContact OD2-NH2 3.39Å
129	H	64.8	Low	67.9	Low	45 Å²	45	49.8 Å²	49.8	21%	0.208	24%	0.243	C	C	.	.	H	α-helix	trans	-55.7	-33.4	175.7	62.9	-89.5	0	0	0	112.9	G126 A127 F133 T267	G126-H129 PolarHBondContact O-CE1 2.75Å; G126-H129 PolarHBondContact O-ND1 2.95Å; A127-H129 PolarHBondContact O-N 3.39Å; H129-F133 VanDerWaalsContact O-CB 3.24Å; H129-F133 WeakPolarHBondContact O-CB 3.31Å; H129-F133 PolarHBondContact O-N 2.98Å; H129-T267 WeakPolarHBondContact CE1-CG2 3.27Å; H129-T267 WeakPolarHBondContact NE2-CG2 3.49Å
130	L	63.4	Low	67.3	Low	8 Å²	8	52.9 Å²	52.9	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-40	174.7	-60.2	178.4	0	0	0	111.6	M122 A127 D128 W134 M271 L295 I296	M122-L130 HydrophobicContact CE-CD1 4.49Å; A127-L130 WeakPolarHBondContact O-CB 3.31Å; A127-L130 PolarHBondContact O-N 3.29Å; D128-L130 PolarHBondContact O-N 3.49Å; L130-W134 WeakPolarHBondContact O-CB 3.42Å; L130-W134 PolarHBondContact O-N 3.45Å; L130-M271 HydrophobicContact CD2-CE 3.74Å; L130-L295 HydrophobicContact CD1-CB 4.47Å; L130-I296 HydrophobicContact CB-CG1 4.23Å
131	V	68.8	Low	66.7	Low	2 Å²	2	53 Å²	53	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-71.8	-42.5	-179.9	-174.1	0	0	0	0	110.5	L109 M115 F118 L119 M122 D128 W134 L135	L109-V131 HydrophobicContact CD2-CG1 4.04Å; M115-V131 HydrophobicContact CE-CG1 3.46Å; M115-V131 VanDerWaalsContact CE-CG1 3.46Å; M115-V131 HydrophobicContact SD-CG1 3.75Å; F118-V131 HydrophobicContact CD1-CG1 4.42Å; F118-V131 HydrophobicContact CD1-CG2 4.18Å; F118-V131 HydrophobicContact CE1-CG2 3.74Å; L119-V131 HydrophobicContact CD1-CB 4.01Å; L119-V131 HydrophobicContact CD1-CG1 4.05Å; M122-V131 HydrophobicContact CB-CG2 4.03Å; M122-V131 HydrophobicContact CE-CG2 3.73Å; M122-V131 HydrophobicContact CG-CG2 3.77Å; D128-V131 WeakPolarHBondContact O-CB 3.46Å; D128-V131 PolarHBondContact O-N 3.07Å; V131-W134 PolarHBondContact O-N 2.81Å; V131-L135 WeakPolarHBondContact O-CB 3.35Å; V131-L135 PolarHBondContact O-N 3.01Å
132	R	66.6	Low	66.2	Low	111 Å²	111	55.8 Å²	55.8	42%	0.419	27%	0.271	S	S	.	.	H	α-helix	trans	-67.8	-37.9	176.1	-59.1	-163.8	-158.8	97.5	5.7	111.9	L119 E123 D128 L135 E136	L119-R132 HydrophobicContact CD1-CG 4.27Å; E123-R132 IonicContact OE1-CZ 2.67Å; E123-R132 IonicContact OE1-NH2 3.99Å; E123-R132 PolarHBondContact OE1-NH2 3.07Å; D128-R132 VanDerWaalsContact CG-NH1 3.31Å; D128-R132 PolarHBondContact O-N 2.73Å; D128-R132 IonicContact OD2-CZ 3Å; D128-R132 IonicContact OD2-NH1 3.14Å; D128-R132 PolarHBondContact OD2-NH1 2.84Å; D128-R132 IonicContact OD2-NH2 2.84Å; D128-R132 PolarHBondContact OD2-NH2 3.39Å; R132-L135 PolarHBondContact O-N 3Å; R132-E136 PolarHBondContact O-N 2.75Å
133	F	65.2	Low	65.7	Low	70 Å²	70	57.9 Å²	57.9	31%	0.307	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-46.1	172.1	179.1	-88.6	0	0	0	112	H129 L135 E136 A137 I274 V292	H129-F133 VanDerWaalsContact O-CB 3.24Å; H129-F133 WeakPolarHBondContact O-CB 3.31Å; H129-F133 PolarHBondContact O-N 2.98Å; F133-L135 VanDerWaalsContact C-N 3.33Å; F133-L135 PolarHBondContact O-N 3.24Å; F133-E136 PolarHBondContact O-N 2.68Å; F133-A137 WeakPolarHBondContact O-CB 3.31Å; F133-A137 PolarHBondContact O-N 2.99Å; F133-I274 HydrophobicContact CE1-CG2 4.49Å; F133-I274 HydrophobicContact CZ-CG2 4.21Å; F133-V292 HydrophobicContact CD1-CG1 4.48Å; F133-V292 HydrophobicContact CD1-CG2 3.93Å; F133-V292 HydrophobicContact CE1-CG2 3.79Å
134	W	69.5	Low	64.7	Low	9 Å²	9	55.9 Å²	55.9	3%	0.034	28%	0.283	C	S	.	.	H	α-helix	trans	-59.5	-45.2	176.6	-176.9	96	0	0	0	111.5	L109 R110 L130 V131 E136 A137 E138 V292 C293 I296	L109-W134 HydrophobicContact CB-CD2 4.28Å; L109-W134 HydrophobicContact CB-CE3 3.95Å; L109-W134 HydrophobicContact CB-CH2 3.66Å; L109-W134 HydrophobicContact CB-CZ2 3.96Å; L109-W134 HydrophobicContact CB-CZ3 3.65Å; L109-W134 HydrophobicContact CD1-CD2 3.83Å; L109-W134 HydrophobicContact CD1-CE3 4.3Å; L109-W134 HydrophobicContact CD1-CG 4.15Å; L109-W134 HydrophobicContact CD1-CZ2 4.09Å; L109-W134 HydrophobicContact CD2-CD2 4.44Å; L109-W134 HydrophobicContact CD2-CE3 4.27Å; L109-W134 HydrophobicContact CG-CD2 4.42Å; L109-W134 HydrophobicContact CG-CE3 4.41Å; L109-W134 WeakPolarHBondContact O-CZ3 3.28Å; R110-W134 HydrophobicContact CG-CH2 3.97Å; L130-W134 WeakPolarHBondContact O-CB 3.42Å; L130-W134 PolarHBondContact O-N 3.45Å; V131-W134 PolarHBondContact O-N 2.81Å; W134-E136 PolarHBondContact O-N 3.24Å; W134-A137 PolarHBondContact O-N 3.4Å; W134-E138 HydrophobicContact CE3-CB 4.49Å; W134-E138 HydrophobicContact CH2-CB 4.41Å; W134-E138 HydrophobicContact CH2-CG 4.22Å; W134-E138 HydrophobicContact CZ3-CB 4.24Å; W134-E138 HydrophobicContact CZ3-CG 4.4Å; W134-E138 WeakPolarHBondContact O-CB 3.24Å; W134-E138 PolarHBondContact O-N 2.88Å; W134-V292 HydrophobicContact CB-CG1 4.15Å; W134-C293 PolarHBondContact NE1-SG 2.95Å; W134-I296 HydrophobicContact CB-CD1 3.89Å; W134-I296 HydrophobicContact CG-CD1 4.14Å
135	L	68.4	Low	64	Low	75 Å²	75	58.3 Å²	58.3	39%	0.393	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-41.2	179.5	-173.4	64.2	0	0	0	111.7	M115 V131 R132 F133 E138 N139	M115-L135 HydrophobicContact CE-CD1 4.45Å; V131-L135 WeakPolarHBondContact O-CB 3.35Å; V131-L135 PolarHBondContact O-N 3.01Å; R132-L135 PolarHBondContact O-N 3Å; F133-L135 VanDerWaalsContact C-N 3.33Å; F133-L135 PolarHBondContact O-N 3.24Å; L135-E138 PolarHBondContact O-N 3.03Å; L135-N139 PolarHBondContact O-N 3.49Å; L135-N139 PolarHBondContact O-ND2 3.38Å
136	E	61.4	Low	63.8	Low	97 Å²	97	56.6 Å²	56.6	45%	0.453	29%	0.292	S	S	.	.	H	α-helix	trans	-74.1	-33.6	179	-168.4	54.5	-157.2	0	0	112.8	R132 F133 W134 E138 N139 F140	R132-E136 PolarHBondContact O-N 2.75Å; F133-E136 PolarHBondContact O-N 2.68Å; W134-E136 PolarHBondContact O-N 3.24Å; E136-E138 VanDerWaalsContact C-N 3.29Å; E136-E138 PolarHBondContact O-N 3.12Å; E136-N139 PolarHBondContact O-N 3Å; E136-N139 PolarHBondContact OE2-ND2 3.48Å; E136-F140 VanDerWaalsContact O-CB 3.29Å; E136-F140 WeakPolarHBondContact O-CB 3.29Å; E136-F140 PolarHBondContact O-N 3.22Å
137	A	60.5	Low	64.1	Low	12 Å²	12	63.2 Å²	63.2	10%	0.099	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-36.2	169.1	0	0	0	0	0	111.9	F133 W134 R141	F133-A137 WeakPolarHBondContact O-CB 3.31Å; F133-A137 PolarHBondContact O-N 2.99Å; W134-A137 PolarHBondContact O-N 3.4Å; A137-R141 WeakPolarHBondContact O-CB 3.45Å; A137-R141 PolarHBondContact O-N 2.95Å
138	E	64	Low	64.1	Low	30 Å²	30	66 Å²	66	14%	0.14	32%	0.321	C	S	.	.	H	α-helix	trans	-73.8	-38.4	176	-171.8	55.5	-137.7	0	0	112.8	W134 L135 E136 R141 S142	W134-E138 HydrophobicContact CE3-CB 4.49Å; W134-E138 HydrophobicContact CH2-CB 4.41Å; W134-E138 HydrophobicContact CH2-CG 4.22Å; W134-E138 HydrophobicContact CZ3-CB 4.24Å; W134-E138 HydrophobicContact CZ3-CG 4.4Å; W134-E138 WeakPolarHBondContact O-CB 3.24Å; W134-E138 PolarHBondContact O-N 2.88Å; L135-E138 PolarHBondContact O-N 3.03Å; E136-E138 VanDerWaalsContact C-N 3.29Å; E136-E138 PolarHBondContact O-N 3.12Å; E138-R141 VanDerWaalsContact CD-NE 3.31Å; E138-R141 PolarHBondContact O-N 2.83Å; E138-R141 IonicContact OE1-CZ 2.75Å; E138-R141 IonicContact OE1-NE 3.84Å; E138-R141 PolarHBondContact OE1-NE 3.13Å; E138-R141 IonicContact OE1-NH2 3.17Å; E138-R141 PolarHBondContact OE1-NH2 3.27Å; E138-R141 IonicContact OE2-CZ 3.87Å; E138-R141 IonicContact OE2-NE 2.73Å; E138-R141 PolarHBondContact OE2-NE 3.09Å; E138-R141 IonicContact OE2-NH1 2.81Å; E138-R141 IonicContact OE2-NH2 2.98Å; E138-R141 PolarHBondContact OE2-NH2 3.4Å; E138-S142 WeakPolarHBondContact O-CB 3.31Å; E138-S142 PolarHBondContact O-N 2.85Å; E138-S142 PolarHBondContact O-OG 3.43Å
139	N	66.3	Low	63.8	Low	79 Å²	79	71.4 Å²	71.4	42%	0.422	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-48	169	-71.6	-24.7	0	0	0	110.4	L135 E136 R141 S142 A143	L135-N139 PolarHBondContact O-N 3.49Å; L135-N139 PolarHBondContact O-ND2 3.38Å; E136-N139 PolarHBondContact O-N 3Å; E136-N139 PolarHBondContact OE2-ND2 3.48Å; N139-R141 PolarHBondContact O-N 3.11Å; N139-S142 PolarHBondContact O-N 3.35Å; N139-A143 VanDerWaalsContact O-CB 3.28Å; N139-A143 WeakPolarHBondContact O-CB 3.43Å; N139-A143 PolarHBondContact O-N 2.9Å
140	F	61.6	Low	64	Low	109 Å²	109	71.4 Å²	71.4	48%	0.478	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-41.6	177.1	-178.6	-93.2	0	0	0	111.9	E136 S144 V284	E136-F140 VanDerWaalsContact O-CB 3.29Å; E136-F140 WeakPolarHBondContact O-CB 3.29Å; E136-F140 PolarHBondContact O-N 3.22Å; F140-S144 WeakPolarHBondContact CE1-OG 3.48Å; F140-S144 WeakPolarHBondContact O-CB 3.4Å; F140-S144 PolarHBondContact O-N 3.39Å; F140-S144 PolarHBondContact O-OG 2.81Å; F140-V284 HydrophobicContact CD1-CG2 4.12Å; F140-V284 HydrophobicContact CE1-CG2 3.82Å
141	R	62.1	Low	63.9	Low	90 Å²	90	77.3 Å²	77.3	34%	0.34	37%	0.374	S	S	.	.	H	α-helix	trans	-58.6	-50.4	172.9	-176.9	172.9	82.9	169.3	-3.3	111.1	A137 E138 N139 S144 W145 T285	A137-R141 WeakPolarHBondContact O-CB 3.45Å; A137-R141 PolarHBondContact O-N 2.95Å; E138-R141 VanDerWaalsContact CD-NE 3.31Å; E138-R141 PolarHBondContact O-N 2.83Å; E138-R141 IonicContact OE1-CZ 2.75Å; E138-R141 IonicContact OE1-NE 3.84Å; E138-R141 PolarHBondContact OE1-NE 3.13Å; E138-R141 IonicContact OE1-NH2 3.17Å; E138-R141 PolarHBondContact OE1-NH2 3.27Å; E138-R141 IonicContact OE2-CZ 3.87Å; E138-R141 IonicContact OE2-NE 2.73Å; E138-R141 PolarHBondContact OE2-NE 3.09Å; E138-R141 IonicContact OE2-NH1 2.81Å; E138-R141 IonicContact OE2-NH2 2.98Å; E138-R141 PolarHBondContact OE2-NH2 3.4Å; N139-R141 PolarHBondContact O-N 3.11Å; R141-S144 PolarHBondContact O-N 2.9Å; R141-W145 VanDerWaalsContact O-CB 3.28Å; R141-W145 WeakPolarHBondContact O-CB 3.16Å; R141-W145 PolarHBondContact O-N 3.48Å; R141-T285 HydrophobicContact CG-CG2 4Å
142	S	62.4	Low	63.3	Low	59 Å²	59	81.9 Å²	81.9	41%	0.413	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-41.9	-178.6	-66.1	0	0	0	0	112.4	E138 N139 S146	E138-S142 WeakPolarHBondContact O-CB 3.31Å; E138-S142 PolarHBondContact O-N 2.85Å; E138-S142 PolarHBondContact O-OG 3.43Å; N139-S142 PolarHBondContact O-N 3.35Å; S142-S146 VanDerWaalsContact O-CB 3.25Å; S142-S146 WeakPolarHBondContact O-CB 3.11Å; S142-S146 PolarHBondContact O-N 3.46Å; S142-S146 PolarHBondContact O-OG 2.68Å
143	A	60.9	Low	62.9	Low	45 Å²	45	81.4 Å²	81.4	37%	0.372	40%	0.404	S	S	.	.	H	α-helix	trans	-67.2	-44.3	175.6	0	0	0	0	0	111.9	N139 S146 R147	N139-A143 VanDerWaalsContact O-CB 3.28Å; N139-A143 WeakPolarHBondContact O-CB 3.43Å; N139-A143 PolarHBondContact O-N 2.9Å; A143-S146 PolarHBondContact O-N 2.87Å; A143-R147 WeakPolarHBondContact O-CB 3.45Å; A143-R147 VanDerWaalsContact O-CG 3.29Å; A143-R147 WeakPolarHBondContact O-CG 3.36Å; A143-R147 PolarHBondContact O-N 2.75Å
144	S	55.1	Low	62.4	Low	39 Å²	39	81.6 Å²	81.6	27%	0.273	41%	0.408	S	S	.	.	H	α-helix	trans	-64.9	-46.4	178.4	-63.2	0	0	0	0	111.6	F140 R141 S146 R147 V148	F140-S144 WeakPolarHBondContact CE1-OG 3.48Å; F140-S144 WeakPolarHBondContact O-CB 3.4Å; F140-S144 PolarHBondContact O-N 3.39Å; F140-S144 PolarHBondContact O-OG 2.81Å; R141-S144 PolarHBondContact O-N 2.9Å; S144-S146 VanDerWaalsContact C-N 3.33Å; S144-S146 PolarHBondContact O-N 3.38Å; S144-R147 PolarHBondContact O-N 2.82Å; S144-V148 WeakPolarHBondContact O-CB 3.25Å; S144-V148 WeakPolarHBondContact O-CG2 3.5Å; S144-V148 PolarHBondContact O-N 2.83Å
145	W	58.4	Low	61.6	Low	160 Å²	160	84.8 Å²	84.8	61%	0.606	43%	0.431	S	S	*	.	H	α-helix	trans	-62.8	-39.1	175.9	-172.5	-114.8	0	0	0	112.1	R141 V148 R149	R141-W145 VanDerWaalsContact O-CB 3.28Å; R141-W145 WeakPolarHBondContact O-CB 3.16Å; R141-W145 PolarHBondContact O-N 3.48Å; W145-V148 PolarHBondContact O-N 3.32Å; W145-R149 VanDerWaalsContact O-CB 3.24Å; W145-R149 WeakPolarHBondContact O-CB 3.18Å; W145-R149 PolarHBondContact O-N 3.17Å
146	S	61.5	Low	60.8	Low	69 Å²	69	86.3 Å²	86.3	48%	0.483	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-41	174.3	-61.7	0	0	0	0	112.2	S142 A143 S144 A150	S142-S146 VanDerWaalsContact O-CB 3.25Å; S142-S146 WeakPolarHBondContact O-CB 3.11Å; S142-S146 PolarHBondContact O-N 3.46Å; S142-S146 PolarHBondContact O-OG 2.68Å; A143-S146 PolarHBondContact O-N 2.87Å; S144-S146 VanDerWaalsContact C-N 3.33Å; S144-S146 PolarHBondContact O-N 3.38Å; S146-A150 WeakPolarHBondContact O-CB 3.44Å; S146-A150 PolarHBondContact O-N 3.25Å
147	R	68.6	Low	60.3	Low	181 Å²	181	88.9 Å²	88.9	68%	0.683	45%	0.454	S	S	*	.	H	α-helix	trans	-65.7	-46	174.7	-73.1	174.1	-173.9	-149	3.9	111.8	A143 S144 R149 A150 Q151	A143-R147 WeakPolarHBondContact O-CB 3.45Å; A143-R147 VanDerWaalsContact O-CG 3.29Å; A143-R147 WeakPolarHBondContact O-CG 3.36Å; A143-R147 PolarHBondContact O-N 2.75Å; S144-R147 PolarHBondContact O-N 2.82Å; R147-R149 PolarHBondContact O-N 3.4Å; R147-A150 PolarHBondContact O-N 2.9Å; R147-Q151 WeakPolarHBondContact O-CB 3.33Å; R147-Q151 WeakPolarHBondContact O-CG 3.46Å; R147-Q151 PolarHBondContact O-N 3.49Å
148	V	65.5	Low	59.6	Low	64 Å²	64	95.8 Å²	95.8	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-42.3	176.3	170	0	0	0	0	111	S144 W145 Q151 N152	S144-V148 WeakPolarHBondContact O-CB 3.25Å; S144-V148 WeakPolarHBondContact O-CG2 3.5Å; S144-V148 PolarHBondContact O-N 2.83Å; W145-V148 PolarHBondContact O-N 3.32Å; V148-Q151 PolarHBondContact O-N 3.48Å; V148-N152 WeakPolarHBondContact O-CB 3.48Å; V148-N152 PolarHBondContact O-N 3.46Å; V148-N152 PolarHBondContact O-ND2 2.81Å
149	R	64.9	Low	58.5	Low	145 Å²	145	98.3 Å²	98.3	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-45.2	174.3	-176.4	-177.8	-72.9	175.2	-8.1	111.6	W145 R147 N152 L153	W145-R149 VanDerWaalsContact O-CB 3.24Å; W145-R149 WeakPolarHBondContact O-CB 3.18Å; W145-R149 PolarHBondContact O-N 3.17Å; R147-R149 PolarHBondContact O-N 3.4Å; R149-N152 PolarHBondContact O-N 2.97Å; R149-L153 HydrophobicContact CG-CD1 4.09Å; R149-L153 WeakPolarHBondContact O-CB 3.43Å; R149-L153 VanDerWaalsContact O-CG 3.29Å; R149-L153 WeakPolarHBondContact O-CG 3.42Å; R149-L153 PolarHBondContact O-N 3.02Å
150	A	68.6	Low	57.5	Low	46 Å²	46	100 Å²	100	38%	0.38	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-40	177.1	0	0	0	0	0	112.7	S146 R147 L153 N154	S146-A150 WeakPolarHBondContact O-CB 3.44Å; S146-A150 PolarHBondContact O-N 3.25Å; R147-A150 PolarHBondContact O-N 2.9Å; A150-L153 PolarHBondContact O-N 3.36Å; A150-N154 WeakPolarHBondContact O-CB 3.47Å; A150-N154 VanDerWaalsContact O-CG 3.29Å; A150-N154 PolarHBondContact O-N 3.46Å; A150-N154 PolarHBondContact O-ND2 3.09Å
151	Q	62.1	Low	56.8	Low	132 Å²	132	102.8 Å²	102.8	62%	0.617	54%	0.542	S	S	*	.	H	α-helix	trans	-65.8	-41.7	175.3	-76.9	174.8	-24.6	0	0	111.8	R147 V148 N154 S155	R147-Q151 WeakPolarHBondContact O-CB 3.33Å; R147-Q151 WeakPolarHBondContact O-CG 3.46Å; R147-Q151 PolarHBondContact O-N 3.49Å; V148-Q151 PolarHBondContact O-N 3.48Å; Q151-N154 PolarHBondContact O-N 2.71Å; Q151-S155 VanDerWaalsContact O-CB 3.3Å; Q151-S155 WeakPolarHBondContact O-CB 3.48Å; Q151-S155 PolarHBondContact O-N 2.86Å
152	N	55.9	Low	55.7	Low	98 Å²	98	103 Å²	103	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-63.8	-45.5	173	-82.3	-78.8	0	0	0	111.8	V148 R149 N154 S155 V156	V148-N152 WeakPolarHBondContact O-CB 3.48Å; V148-N152 PolarHBondContact O-N 3.46Å; V148-N152 PolarHBondContact O-ND2 2.81Å; R149-N152 PolarHBondContact O-N 2.97Å; N152-N154 PolarHBondContact O-N 2.92Å; N152-S155 WeakPolarHBondContact O-CB 3.25Å; N152-S155 PolarHBondContact O-N 2.88Å; N152-V156 WeakPolarHBondContact O-CG2 3.46Å; N152-V156 PolarHBondContact O-N 3.21Å
153	L	57.1	Low	54.3	Low	100 Å²	100	108.7 Å²	108.7	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-62.9	-28.4	176.4	-74.1	169.1	0	0	0	113.4	R149 A150 K157	R149-L153 HydrophobicContact CG-CD1 4.09Å; R149-L153 WeakPolarHBondContact O-CB 3.43Å; R149-L153 VanDerWaalsContact O-CG 3.29Å; R149-L153 WeakPolarHBondContact O-CG 3.42Å; R149-L153 PolarHBondContact O-N 3.02Å; A150-L153 PolarHBondContact O-N 3.36Å; L153-K157 WeakPolarHBondContact O-CE 3.46Å; L153-K157 WeakPolarHBondContact O-CG 3.38Å
154	N	56.1	Low	53.1	Low	74 Å²	74	111.9 Å²	111.9	40%	0.396	60%	0.599	S	S	.	*	H	α-helix	trans	-84.8	-33.9	173.6	-69.3	-18.5	0	0	0	112.2	A150 Q151 N152 V156 K157 H158	A150-N154 WeakPolarHBondContact O-CB 3.47Å; A150-N154 VanDerWaalsContact O-CG 3.29Å; A150-N154 PolarHBondContact O-N 3.46Å; A150-N154 PolarHBondContact O-ND2 3.09Å; Q151-N154 PolarHBondContact O-N 2.71Å; N152-N154 PolarHBondContact O-N 2.92Å; N154-V156 VanDerWaalsContact C-N 3.32Å; N154-V156 PolarHBondContact O-N 2.95Å; N154-K157 WeakPolarHBondContact O-CB 3.48Å; N154-K157 PolarHBondContact O-N 3.25Å; N154-K157 VanDerWaalsContact O-N 3.1Å; N154-K157 PolarHBondContact OD1-NZ 3.4Å; N154-H158 PolarHBondContact O-CD2 3.5Å; N154-H158 PolarHBondContact O-N 3.33Å; N154-H158 VanDerWaalsContact O-N 3.1Å
155	S	53.1	Low	52	Low	76 Å²	76	116.2 Å²	116.2	53%	0.531	62%	0.624	S	S	.	*	H	α-helix	trans	-59.7	-43.3	171	-169.6	0	0	0	0	111	Q151 N152 K157 H158 S159	Q151-S155 VanDerWaalsContact O-CB 3.3Å; Q151-S155 WeakPolarHBondContact O-CB 3.48Å; Q151-S155 PolarHBondContact O-N 2.86Å; N152-S155 WeakPolarHBondContact O-CB 3.25Å; N152-S155 PolarHBondContact O-N 2.88Å; S155-K157 VanDerWaalsContact C-N 3.29Å; S155-K157 PolarHBondContact O-N 2.88Å; S155-H158 CarbonylContact O-C 3.59Å; S155-H158 WeakPolarHBondContact O-CA 3.35Å; S155-H158 PolarHBondContact O-N 2.9Å; S155-S159 PolarHBondContact O-N 3.25Å
156	V	51.6	Low	50.9	Low	108 Å²	108	113.9 Å²	113.9	66%	0.655	63%	0.629	S	S	*	*	H	α-helix	trans	-61.3	-33.3	173.5	171.6	0	0	0	0	112.4	N152 N154 H158 S159	N152-V156 WeakPolarHBondContact O-CG2 3.46Å; N152-V156 PolarHBondContact O-N 3.21Å; N154-V156 VanDerWaalsContact C-N 3.32Å; N154-V156 PolarHBondContact O-N 2.95Å; V156-H158 VanDerWaalsContact C-N 3.3Å; V156-H158 PolarHBondContact O-N 3.46Å; V156-S159 PolarHBondContact O-N 3.47Å
157	K	51.1	Low	49.5	Very low	151 Å²	151	117.2 Å²	117.2	66%	0.657	65%	0.646	S	S	*	*	H	α-helix	trans	-74.7	-16.9	173.3	-66.6	167	-164.4	162.9	0	114	L153 N154 S155	L153-K157 WeakPolarHBondContact O-CE 3.46Å; L153-K157 WeakPolarHBondContact O-CG 3.38Å; N154-K157 WeakPolarHBondContact O-CB 3.48Å; N154-K157 PolarHBondContact O-N 3.25Å; N154-K157 VanDerWaalsContact O-N 3.1Å; N154-K157 PolarHBondContact OD1-NZ 3.4Å; S155-K157 VanDerWaalsContact C-N 3.29Å; S155-K157 PolarHBondContact O-N 2.88Å
158	H	45.8	Very low	47.7	Very low	156 Å²	156	114 Å²	114	72%	0.722	65%	0.652	S	S	*	*	H	α-helix	trans	-107.2	4	176.2	-65.3	-56.4	0	0	0	112.7	N154 S155 V156 S160	N154-H158 PolarHBondContact O-CD2 3.5Å; N154-H158 PolarHBondContact O-N 3.33Å; N154-H158 VanDerWaalsContact O-N 3.1Å; S155-H158 CarbonylContact O-C 3.59Å; S155-H158 WeakPolarHBondContact O-CA 3.35Å; S155-H158 PolarHBondContact O-N 2.9Å; V156-H158 VanDerWaalsContact C-N 3.3Å; V156-H158 PolarHBondContact O-N 3.46Å; H158-S160 PolarHBondContact O-N 2.98Å
159	S	39.5	Very low	46.6	Very low	83 Å²	83	116.2 Å²	116.2	58%	0.58	67%	0.667	S	S	*	*			trans	-81.1	96.4	174.1	-169.8	0	0	0	0	109.3	S155 V156 L161	S155-S159 PolarHBondContact O-N 3.25Å; V156-S159 PolarHBondContact O-N 3.47Å; S159-L161 PolarHBondContact O-N 2.83Å
160	S	44.7	Very low	44.9	Very low	115 Å²	115	117.4 Å²	117.4	80%	0.804	69%	0.685	S	S	*	*			trans	-67.3	91.1	-179.4	-63.8	0	0	0	0	112.1	H158	H158-S160 PolarHBondContact O-N 2.98Å
161	L	47	Very low	43	Very low	168 Å²	168	118.6 Å²	118.6	88%	0.88	70%	0.701	S	S	*	*			trans	-129.5	37.4	165.2	-121.5	173	0	0	0	111.7	S159	S159-L161 PolarHBondContact O-N 2.83Å
162	A	39.6	Very low	42	Very low	93 Å²	93	117.8 Å²	117.8	77%	0.769	71%	0.707	S	S	*	*			trans	-151.9	63.6	172.5	0	0	0	0	0	109.4	P164	A162-P164 WeakPolarHBondContact O-CD 3.33Å
163	E	33.8	Very low	40.6	Very low	180 Å²	180	121.5 Å²	121.5	84%	0.841	72%	0.721	S	S	*	*			trans	-89.3	113.6	177.6	-172.9	167.2	-125.5	0	0	110.3
164	P	35.9	Very low	39.2	Very low	112 Å²	112	124.5 Å²	124.5	73%	0.727	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-77.9	132.4	172.6	31.6	-32.4	0	0	0	110	A162	A162-P164 WeakPolarHBondContact O-CD 3.33Å
165	V	31.7	Very low	37.7	Very low	130 Å²	130	127.1 Å²	127.1	79%	0.788	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-58.8	126.7	-180	179.7	0	0	0	0	110.4
166	P	35.6	Very low	36.6	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-72.1	136.2	-178.5	28.6	-34.5	0	0	0	111.8
167	V	31.5	Very low	35.3	Very low	140 Å²	140	132.1 Å²	132.1	85%	0.848	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-94.7	119.8	172.6	-179.9	0	0	0	0	109
168	S	31.6	Very low	34.1	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.1	132.1	176.3	-57.8	0	0	0	0	111.9
169	P	40.8	Very low	33.2	Very low	111 Å²	111	130.3 Å²	130.3	72%	0.721	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-100.2	120.9	166.7	34.3	-26.6	0	0	0	111.7
170	D	29	Very low	32.6	Very low	170 Å²	170	133.7 Å²	133.7	91%	0.909	78%	0.781	S	S	*	*				176.8	149.6	127.6	-89.8	-21.7	0	0	0	110.3
171	G	29	Very low	31.6	Very low	70 Å²	70	134.7 Å²	134.7	72%	0.722	78%	0.778	S	S	*	*			trans	-91.9	-162.2	-173.3	0	0	0	0	0	114.7
172	P	40.7	Very low	31.2	Very low	115 Å²	115	132.3 Å²	132.3	75%	0.747	77%	0.772	S	S	*	*			cis	-133.2	178.9	25.4	40.9	-23.5	0	0	0	116.7
173	E	26.7	Very low	30.7	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	77%	0.765	S	S	*	*			trans	29.1	124.3	150.3	-60	172.1	132	0	0	119.4
174	L	28.4	Very low	30.5	Very low	162 Å²	162	130.1 Å²	130.1	85%	0.848	76%	0.763	S	S	*	*				-169	146.7	75.1	-89.7	171.6	0	0	0	114.4
175	D	25.6	Very low	30.1	Very low	129 Å²	129	132.5 Å²	132.5	69%	0.69	76%	0.764	S	S	*	*			trans	12	138.2	151.8	-98.9	5.3	0	0	0	125.6
176	Q	28.1	Very low	29.9	Very low	147 Å²	147	132.7 Å²	132.7	69%	0.687	76%	0.76	S	S	*	*			trans	79.3	118.5	134.8	-71.5	-178	61.1	0	0	123.8
177	N	25.1	Very low	29.6	Very low	142 Å²	142	132.3 Å²	132.3	76%	0.759	76%	0.76	S	S	*	*			trans	79.4	128.8	131.4	-70.4	-35.2	0	0	0	123.7
178	A	26.6	Very low	29.4	Very low	84 Å²	84	137.4 Å²	137.4	69%	0.694	76%	0.764	S	S	*	*			trans	83.7	119.5	136.5	0	0	0	0	0	122.8
179	F	26.8	Very low	29.1	Very low	186 Å²	186	135.6 Å²	135.6	82%	0.816	76%	0.763	S	S	*	*			trans	34.4	119.7	132	-67.8	-87.5	0	0	0	120.8
180	N	27.4	Very low	28.5	Very low	154 Å²	154	138 Å²	138	82%	0.824	77%	0.771	S	S	*	*				179.7	150.3	91.1	-92.8	-49.4	0	0	0	114.8
181	D	23.2	Very low	28.8	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	76%	0.762	S	S	*	*			trans	-90.7	153.7	156.4	-158.8	5.2	0	0	0	106.8	A183	D181-A183 PolarHBondContact OD1-N 3.11Å
182	P	39.2	Very low	29	Very low	118 Å²	118	137.4 Å²	137.4	77%	0.766	77%	0.766	S	S	*	*				-147.7	137	76.8	35.3	-15	0	0	0	116.9
183	A	28.8	Very low	29.2	Very low	74 Å²	74	137.6 Å²	137.6	61%	0.612	77%	0.767	S	S	*	*				24.7	149.9	128.7	0	0	0	0	0	122.5	D181	D181-A183 PolarHBondContact OD1-N 3.11Å
184	L	28.4	Very low	29.2	Very low	153 Å²	153	136.6 Å²	136.6	80%	0.801	77%	0.767	S	S	*	*				-173.9	115.7	114.8	-96.6	177.2	0	0	0	113.9
185	H	28.6	Very low	29	Very low	161 Å²	161	133 Å²	133	75%	0.745	75%	0.754	S	S	*	*			trans	62.8	155.5	153.1	-80.4	-115.2	0	0	0	120.4
186	N	27.3	Very low	29.1	Very low	135 Å²	135	133.1 Å²	133.1	72%	0.722	76%	0.76	S	S	*	*			cis	-141.3	164.3	9.1	-147.4	-7.5	0	0	0	113.7
187	S	28.9	Very low	29	Very low	102 Å²	102	135 Å²	135	71%	0.713	76%	0.761	S	S	*	*			trans	-62.5	169.1	176.7	-53.1	0	0	0	0	113.1
188	R	26.6	Very low	29.2	Very low	246 Å²	246	136.8 Å²	136.8	93%	0.928	76%	0.757	S	S	*	*			cis	-169.9	154.8	37.1	-144	174.5	-168.5	177.3	2.2	107
189	G	26.6	Very low	29.1	Very low	75 Å²	75	138.4 Å²	138.4	77%	0.773	75%	0.754	S	S	*	*			cis	137.7	100.7	4	0	0	0	0	0	109.8
190	N	27.8	Very low	29.1	Very low	163 Å²	163	134.8 Å²	134.8	87%	0.872	75%	0.752	S	S	*	*			trans	-128.3	138.3	-175.4	-154.3	28.2	0	0	0	110.1
191	P	35.4	Very low	29.1	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	75%	0.75	S	S	*	*			trans	-95.9	162.3	-164.3	36.3	-35.6	0	0	0	116.1
192	S	33.6	Very low	29.3	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	75%	0.754	S	S	*	*			trans	-143	151.3	158.8	-55.9	0	0	0	0	107.3
193	P	43.7	Very low	28.7	Very low	119 Å²	119	130.1 Å²	130.1	77%	0.773	76%	0.757	S	S	*	*				-151.7	-158.4	95.4	41	-19.6	0	0	0	111.6
194	L	27.1	Very low	28.6	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	77%	0.773	S	S	*	*			cis	-154.3	157.6	4.6	-165.6	54	0	0	0	112.6
195	S	25.3	Very low	28.5	Very low	85 Å²	85	133.7 Å²	133.7	59%	0.594	78%	0.775	S	S	*	*			trans	-11.8	140.3	157.2	-169.3	0	0	0	0	121.1
196	T	26.6	Very low	28.6	Very low	132 Å²	132	135.7 Å²	135.7	81%	0.81	78%	0.781	S	S	*	*				176.1	162.3	109.5	30.5	0	0	0	0	111.1
197	R	26.1	Very low	29	Very low	188 Å²	188	134.8 Å²	134.8	71%	0.709	78%	0.783	S	S	*	*			cis	179.5	148.5	-34.8	157.4	167.4	-170.4	-155.8	5.3	108.4
198	R	29	Very low	28.8	Very low	179 Å²	179	134.7 Å²	134.7	68%	0.675	78%	0.782	S	S	*	*			trans	70.6	163.2	175.3	-69.7	172.4	-178.1	-85	11.8	115.1
199	D	24.3	Very low	28.8	Very low	118 Å²	118	135 Å²	135	63%	0.631	78%	0.783	S	S	*	*			cis	-164.8	155.9	-21.7	-88.5	-15.8	0	0	0	103.7
200	S	27.5	Very low	28.7	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	78%	0.778	S	S	*	*			cis	-161	-169.2	2.2	-113.3	0	0	0	0	110.7
201	S	27.2	Very low	28.7	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	78%	0.775	S	S	*	*			trans	-81.5	-171.7	178.8	61.7	0	0	0	0	114.1
202	S	28	Very low	28.3	Very low	115 Å²	115	135 Å²	135	80%	0.804	78%	0.775	S	S	*	*			cis	-166.7	161.8	17.8	43.5	0	0	0	0	112.6
203	G	25.2	Very low	28.3	Very low	81 Å²	81	135.2 Å²	135.2	84%	0.835	77%	0.774	S	S	*	*			trans	178.9	93.7	165.1	0	0	0	0	0	114.1
204	E	27.7	Very low	27.4	Very low	200 Å²	200	134.8 Å²	134.8	94%	0.935	77%	0.774	S	S	*	*			trans	-99.7	149.1	-177.5	-64.9	179.8	92.7	0	0	113.9
205	A	25.8	Very low	27.3	Very low	102 Å²	102	137 Å²	137	84%	0.843	77%	0.771	S	S	*	*			trans	-167.5	128.3	139.3	0	0	0	0	0	111.3
206	K	30.4	Very low	27.4	Very low	203 Å²	203	140.6 Å²	140.6	88%	0.883	78%	0.778	S	S	*	*			trans	-161.4	132.9	169.3	-159	177.1	-169.5	175.5	0	111.8
207	P	35.6	Very low	27.4	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	78%	0.776	S	S	*	*			trans	-144.9	-179.9	134.4	28.7	-9.2	0	0	0	113
208	S	26.1	Very low	27.5	Very low	99 Å²	99	136 Å²	136	69%	0.692	78%	0.783	S	S	*	*				179.8	125.8	-63.6	52.3	0	0	0	0	110.1
209	R	26.7	Very low	27.4	Very low	252 Å²	252	133 Å²	133	95%	0.951	79%	0.789	S	S	*	*			trans	62.7	158.7	168.8	-82	175	173.4	158.8	-3.2	115.5
210	A	24.5	Very low	27.7	Very low	80 Å²	80	138.6 Å²	138.6	66%	0.661	80%	0.802	S	S	*	*			cis	-137.6	-148.9	-10.6	0	0	0	0	0	107.8
211	D	26.1	Very low	27.7	Very low	151 Å²	151	139.8 Å²	139.8	81%	0.807	80%	0.804	S	S	*	*			cis	-158.9	179.2	-1	-139.1	-47.7	0	0	0	111.1
212	T	28.9	Very low	27.6	Very low	119 Å²	119	138.2 Å²	138.2	73%	0.73	81%	0.806	S	S	*	*			trans	-137.3	141.1	-176.6	-39.6	0	0	0	0	113.3
213	P	32.6	Very low	27.7	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	81%	0.809	S	S	*	*			trans	-132.5	127.7	138.7	33.8	-21.1	0	0	0	111.1
214	S	24	Very low	28.4	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	80%	0.803	S	S	*	*				64.1	116.7	61.9	-169.4	0	0	0	0	114
215	R	25.1	Very low	28.3	Very low	204 Å²	204	136.3 Å²	136.3	77%	0.77	79%	0.794	S	S	*	*				174.7	124.3	108	-172.8	168.6	-179.1	176.6	5.2	114.9
216	Q	27.4	Very low	28.3	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	80%	0.798	S	S	*	*			trans	62.1	140.2	153.4	-72.6	173	-40.8	0	0	122.9
217	A	26.8	Very low	28.5	Very low	91 Å²	91	135.5 Å²	135.5	75%	0.752	79%	0.793	S	S	*	*			trans	-117.4	165.7	153.9	0	0	0	0	0	109.4
218	P	29.3	Very low	28	Very low	132 Å²	132	137.2 Å²	137.2	86%	0.857	79%	0.79	S	S	*	*			trans	-102.3	136.6	160.9	34.8	-27.2	0	0	0	111.5
219	S	26.5	Very low	28.6	Very low	116 Å²	116	137 Å²	137	81%	0.811	79%	0.787	S	S	*	*			trans	-115.7	144.5	177.2	54.6	0	0	0	0	111.5
220	R	30.6	Very low	29	Very low	237 Å²	237	130.8 Å²	130.8	89%	0.894	77%	0.772	S	S	*	*			trans	-165.1	99.9	156.7	-118.6	177.2	159.1	174.5	-7.2	115.2
221	T	27.4	Very low	29.3	Very low	134 Å²	134	131 Å²	131	82%	0.822	76%	0.762	S	S	*	*			trans	34.5	120.3	136	57.7	0	0	0	0	121
222	G	24.7	Very low	29.9	Very low	81 Å²	81	128.4 Å²	128.4	84%	0.835	75%	0.752	S	S	*	*			trans	175.9	108.1	159	0	0	0	0	0	113.9
223	T	30.1	Very low	30.1	Very low	139 Å²	139	128.7 Å²	128.7	85%	0.853	75%	0.749	S	S	*	*			trans	-127.9	167.2	175.2	55.6	0	0	0	0	109.3
224	P	39.5	Very low	30.2	Very low	110 Å²	110	128.5 Å²	128.5	71%	0.714	74%	0.737	S	S	*	*			cis	-135.8	-172.4	6.8	43.8	-26.7	0	0	0	116
225	S	26.4	Very low	30.7	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	73%	0.727	S	S	*	*			trans	70.2	98.4	147.4	-60.2	0	0	0	0	121.8
226	K	26.1	Very low	31.3	Very low	213 Å²	213	124.6 Å²	124.6	93%	0.926	72%	0.717	S	S	*	*				-173.8	155.1	106.9	-100.5	171.4	-178.8	179.6	0	111.5
227	G	33.5	Very low	31.8	Very low	76 Å²	76	119.6 Å²	119.6	78%	0.784	70%	0.7	S	S	*	*			trans	-83.6	156.1	179.7	0	0	0	0	0	113.2
228	H	26.1	Very low	32.2	Very low	153 Å²	153	119.2 Å²	119.2	71%	0.708	69%	0.685	S	S	*	*			trans	-142.5	103.9	-175.5	-157	9.6	0	0	0	111.3	N231	H228-N231 PolarHBondContact CE1-OD1 3.23Å; H228-N231 PolarHBondContact NE2-ND2 3.37Å; H228-N231 VanDerWaalsContact NE2-ND2 3.15Å
229	P	38.2	Very low	32.7	Very low	95 Å²	95	117.4 Å²	117.4	62%	0.617	67%	0.672	S	S	*	*			trans	-95.8	164.7	169.6	36.6	-32.4	0	0	0	112.4	N231	P229-N231 PolarHBondContact O-N 3.3Å
230	N	34.5	Very low	33.2	Very low	121 Å²	121	116.2 Å²	116.2	65%	0.647	66%	0.656	S	S	*	*			trans	69.2	17.2	152.7	-64.6	7.6	0	0	0	122.1	T232 L233 Q234	N230-T232 PolarHBondContact O-N 2.96Å; N230-L233 PolarHBondContact O-N 3.24Å; N230-Q234 PolarHBondContact O-N 3.4Å
231	N	31.9	Very low	33.4	Very low	83 Å²	83	110.1 Å²	110.1	44%	0.444	64%	0.639	S	S	.	*	H	α-helix	trans	-61.5	-38.8	174.8	-64.3	7.2	0	0	0	113.4	H228 P229 L233 Q234 D235	H228-N231 PolarHBondContact CE1-OD1 3.23Å; H228-N231 PolarHBondContact NE2-ND2 3.37Å; H228-N231 VanDerWaalsContact NE2-ND2 3.15Å; P229-N231 PolarHBondContact O-N 3.3Å; N231-L233 VanDerWaalsContact C-N 3.33Å; N231-L233 PolarHBondContact O-N 3.14Å; N231-Q234 WeakPolarHBondContact O-CA 3.16Å; N231-Q234 WeakPolarHBondContact O-CB 3.39Å; N231-Q234 PolarHBondContact O-N 2.82Å; N231-Q234 VanDerWaalsContact O-N 3.12Å; N231-D235 PolarHBondContact O-N 3.16Å
232	T	37.5	Very low	33.8	Very low	98 Å²	98	110.7 Å²	110.7	60%	0.601	63%	0.63	S	S	*	*	H	α-helix	trans	-65.1	-32	-176.1	-43.5	0	0	0	0	113.8	N230 F236	N230-T232 PolarHBondContact O-N 2.96Å; T232-F236 HydrophobicContact CG2-CD2 4.28Å; T232-F236 HydrophobicContact CG2-CE2 4.02Å; T232-F236 WeakPolarHBondContact O-CD2 3.46Å; T232-F236 PolarHBondContact O-N 2.99Å
233	L	34.3	Very low	34.4	Very low	125 Å²	125	109.5 Å²	109.5	65%	0.654	61%	0.609	S	S	*	*	H	α-helix	trans	-76.3	-31.4	177.5	-144	164.4	0	0	0	110.4	N230 N231 S237	N230-L233 PolarHBondContact O-N 3.24Å; N231-L233 VanDerWaalsContact C-N 3.33Å; N231-L233 PolarHBondContact O-N 3.14Å; L233-S237 PolarHBondContact O-N 3.45Å
234	Q	35.3	Very low	34.5	Very low	115 Å²	115	107.4 Å²	107.4	54%	0.537	59%	0.589	S	S	.	*	H	α-helix	trans	-61.4	-50.3	169.5	-152.2	77.9	45	0	0	110.9	N230 N231 F236 S237 D238	N230-Q234 PolarHBondContact O-N 3.4Å; N231-Q234 WeakPolarHBondContact O-CA 3.16Å; N231-Q234 WeakPolarHBondContact O-CB 3.39Å; N231-Q234 PolarHBondContact O-N 2.82Å; N231-Q234 VanDerWaalsContact O-N 3.12Å; Q234-F236 VanDerWaalsContact C-N 3.32Å; Q234-F236 PolarHBondContact O-N 3.43Å; Q234-S237 WeakPolarHBondContact O-CB 3.44Å; Q234-S237 PolarHBondContact O-N 3.09Å; Q234-D238 PolarHBondContact O-N 2.73Å
235	D	33.2	Very low	34.4	Very low	102 Å²	102	104.8 Å²	104.8	55%	0.545	57%	0.573	S	S	.	*	H	α-helix	trans	-57.7	-40.7	178.1	-70.8	-48.8	0	0	0	112.5	N231 T239	N231-D235 PolarHBondContact O-N 3.16Å; D235-T239 WeakPolarHBondContact O-CB 3.38Å; D235-T239 PolarHBondContact O-N 3.02Å; D235-T239 PolarHBondContact O-OG1 2.87Å
236	F	37.2	Very low	34.6	Very low	129 Å²	129	104.4 Å²	104.4	57%	0.566	57%	0.567	S	S	*	*	H	α-helix	trans	-64.5	-42.6	173.9	-81.9	-61.9	0	0	0	112.2	T232 Q234 T239 L240	T232-F236 HydrophobicContact CG2-CD2 4.28Å; T232-F236 HydrophobicContact CG2-CE2 4.02Å; T232-F236 WeakPolarHBondContact O-CD2 3.46Å; T232-F236 PolarHBondContact O-N 2.99Å; Q234-F236 VanDerWaalsContact C-N 3.32Å; Q234-F236 PolarHBondContact O-N 3.43Å; F236-T239 PolarHBondContact O-N 3.47Å; F236-L240 WeakPolarHBondContact O-CB 3.5Å; F236-L240 PolarHBondContact O-N 3.41Å
237	S	38.3	Very low	35	Very low	55 Å²	55	100.5 Å²	100.5	39%	0.385	55%	0.552	S	S	.	*	H	α-helix	trans	-64.5	-45.9	176.9	-164.2	0	0	0	0	111.9	L233 Q234 T239 L240 M241	L233-S237 PolarHBondContact O-N 3.45Å; Q234-S237 WeakPolarHBondContact O-CB 3.44Å; Q234-S237 PolarHBondContact O-N 3.09Å; S237-T239 VanDerWaalsContact C-N 3.26Å; S237-T239 PolarHBondContact O-N 3.04Å; S237-L240 PolarHBondContact O-N 3.11Å; S237-L240 VanDerWaalsContact O-N 3.15Å; S237-M241 VanDerWaalsContact O-CG 3.27Å; S237-M241 WeakPolarHBondContact O-CG 3.27Å; S237-M241 PolarHBondContact O-N 2.82Å
238	D	35.5	Very low	35.2	Very low	84 Å²	84	103.1 Å²	103.1	45%	0.449	54%	0.544	S	S	.	.	H	α-helix	trans	-69.8	-24.8	-179.4	-69.4	-24.9	0	0	0	112.4	Q234 K242	Q234-D238 PolarHBondContact O-N 2.73Å; D238-K242 WeakPolarHBondContact O-CG 3.31Å; D238-K242 PolarHBondContact O-N 3.04Å
239	T	39.6	Very low	35.4	Very low	94 Å²	94	101.8 Å²	101.8	58%	0.577	54%	0.542	S	S	*	.	H	α-helix	trans	-74.1	-41.3	170	-55.8	0	0	0	0	111.1	D235 F236 S237 K242 S243	D235-T239 WeakPolarHBondContact O-CB 3.38Å; D235-T239 PolarHBondContact O-N 3.02Å; D235-T239 PolarHBondContact O-OG1 2.87Å; F236-T239 PolarHBondContact O-N 3.47Å; S237-T239 VanDerWaalsContact C-N 3.26Å; S237-T239 PolarHBondContact O-N 3.04Å; T239-K242 WeakPolarHBondContact O-CB 3.45Å; T239-K242 PolarHBondContact O-N 3.31Å; T239-S243 PolarHBondContact O-N 3.33Å; T239-S243 PolarHBondContact O-OG 3.31Å
240	L	36.9	Very low	35.2	Very low	91 Å²	91	103 Å²	103	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-65.4	-46.5	178.6	-168.8	70.3	0	0	0	112.1	F236 S237 K242 S243 E244	F236-L240 WeakPolarHBondContact O-CB 3.5Å; F236-L240 PolarHBondContact O-N 3.41Å; S237-L240 PolarHBondContact O-N 3.11Å; S237-L240 VanDerWaalsContact O-N 3.15Å; L240-K242 PolarHBondContact O-N 3.02Å; L240-S243 WeakPolarHBondContact CA-OG 3.4Å; L240-S243 PolarHBondContact O-N 3.01Å; L240-S243 PolarHBondContact O-OG 2.76Å; L240-E244 PolarHBondContact O-N 3.11Å; L240-E244 VanDerWaalsContact O-N 3.08Å
241	M	35.9	Very low	35.2	Very low	108 Å²	108	105.7 Å²	105.7	53%	0.532	55%	0.549	S	S	.	.	H	α-helix	trans	-60.6	-27.9	175	-63.7	-69.5	-58	0	0	112.2	S237 S245	S237-M241 VanDerWaalsContact O-CG 3.27Å; S237-M241 WeakPolarHBondContact O-CG 3.27Å; S237-M241 PolarHBondContact O-N 2.82Å; M241-S245 WeakPolarHBondContact O-CB 3.3Å; M241-S245 PolarHBondContact O-N 3Å; M241-S245 VanDerWaalsContact O-N 3.1Å; M241-S245 PolarHBondContact O-OG 2.9Å
242	K	35	Very low	35.5	Very low	147 Å²	147	108.5 Å²	108.5	64%	0.639	56%	0.564	S	S	*	*	H	α-helix	trans	-74.2	-32.6	173.2	-89.7	175.7	179.2	164.2	0	113.4	D238 T239 L240 S245 T246	D238-K242 WeakPolarHBondContact O-CG 3.31Å; D238-K242 PolarHBondContact O-N 3.04Å; T239-K242 WeakPolarHBondContact O-CB 3.45Å; T239-K242 PolarHBondContact O-N 3.31Å; L240-K242 PolarHBondContact O-N 3.02Å; K242-S245 PolarHBondContact O-OG 3.47Å; K242-T246 PolarHBondContact O-N 3.3Å; K242-T246 PolarHBondContact O-OG1 3.21Å
243	S	36.5	Very low	35.3	Very low	56 Å²	56	112.9 Å²	112.9	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-65.7	-49.2	168.2	20.5	0	0	0	0	111.1	T239 L240 S245 T246 E247	T239-S243 PolarHBondContact O-N 3.33Å; T239-S243 PolarHBondContact O-OG 3.31Å; L240-S243 WeakPolarHBondContact CA-OG 3.4Å; L240-S243 PolarHBondContact O-N 3.01Å; L240-S243 PolarHBondContact O-OG 2.76Å; S243-S245 PolarHBondContact O-N 2.95Å; S243-T246 WeakPolarHBondContact O-CA 3.29Å; S243-T246 WeakPolarHBondContact O-CB 3.34Å; S243-T246 PolarHBondContact O-N 3.09Å; S243-E247 PolarHBondContact O-N 3.07Å
244	E	33.4	Very low	35.2	Very low	95 Å²	95	110.9 Å²	110.9	44%	0.444	57%	0.571	S	S	.	*	H	α-helix	trans	-58	-49.7	-178.5	-67.2	178.3	144.8	0	0	112.2	L240 T246 E247 E248	L240-E244 PolarHBondContact O-N 3.11Å; L240-E244 VanDerWaalsContact O-N 3.08Å; E244-T246 PolarHBondContact O-N 3.46Å; E244-T246 VanDerWaalsContact O-N 3.12Å; E244-E247 PolarHBondContact O-N 3.38Å; E244-E248 PolarHBondContact O-N 3.13Å
245	S	36	Very low	35.3	Very low	54 Å²	54	114.4 Å²	114.4	38%	0.378	59%	0.588	S	S	.	*	H	α-helix	trans	-65.5	-14.2	176.7	52.7	0	0	0	0	114.4	M241 K242 S243 N249	M241-S245 WeakPolarHBondContact O-CB 3.3Å; M241-S245 PolarHBondContact O-N 3Å; M241-S245 VanDerWaalsContact O-N 3.1Å; M241-S245 PolarHBondContact O-OG 2.9Å; K242-S245 PolarHBondContact O-OG 3.47Å; S243-S245 PolarHBondContact O-N 2.95Å; S245-N249 PolarHBondContact O-ND2 3.28Å
246	T	32.1	Very low	35.7	Very low	99 Å²	99	115.8 Å²	115.8	61%	0.607	60%	0.602	S	S	*	*	H	α-helix	trans	-85.2	-34.2	169.5	-53.2	0	0	0	0	111.6	K242 S243 E244 N249	K242-T246 PolarHBondContact O-N 3.3Å; K242-T246 PolarHBondContact O-OG1 3.21Å; S243-T246 WeakPolarHBondContact O-CA 3.29Å; S243-T246 WeakPolarHBondContact O-CB 3.34Å; S243-T246 PolarHBondContact O-N 3.09Å; E244-T246 PolarHBondContact O-N 3.46Å; E244-T246 VanDerWaalsContact O-N 3.12Å; T246-N249 PolarHBondContact O-N 2.82Å
247	E	34.9	Very low	35.2	Very low	130 Å²	130	113 Å²	113	61%	0.607	61%	0.61	S	S	*	*	H	α-helix	trans	-72.8	-36	175.2	-66.8	-167.3	136.6	0	0	112.8	S243 E244 N249 L250 F251	S243-E247 PolarHBondContact O-N 3.07Å; E244-E247 PolarHBondContact O-N 3.38Å; E247-N249 PolarHBondContact O-N 3.26Å; E247-L250 WeakPolarHBondContact O-CA 3.48Å; E247-L250 WeakPolarHBondContact O-CB 3.34Å; E247-L250 PolarHBondContact O-N 2.68Å; E247-F251 PolarHBondContact O-N 2.93Å
248	E	35.9	Very low	35.4	Very low	132 Å²	132	119.9 Å²	119.9	62%	0.617	64%	0.636	S	S	*	*	H	α-helix	trans	-56.8	-32.6	173.3	-71.3	-172.1	148.2	0	0	112.7	E244 L250 N252	E244-E248 PolarHBondContact O-N 3.13Å; E248-L250 VanDerWaalsContact C-N 3.34Å; E248-N252 PolarHBondContact O-N 2.82Å; E248-N252 PolarHBondContact O-ND2 3.43Å
249	N	31.8	Very low	35.4	Very low	125 Å²	125	119.7 Å²	119.7	67%	0.668	65%	0.646	S	S	*	*	H	α-helix	trans	-77.7	-17.3	176.3	-81.2	-80.5	0	0	0	113.6	S245 T246 E247	S245-N249 PolarHBondContact O-ND2 3.28Å; T246-N249 PolarHBondContact O-N 2.82Å; E247-N249 PolarHBondContact O-N 3.26Å
250	L	34	Very low	35.2	Very low	121 Å²	121	123.5 Å²	123.5	63%	0.634	66%	0.655	S	S	*	*	H	α-helix	trans	-87.6	-34.8	172.4	-169.2	65.3	0	0	0	111.7	E247 E248 N252 K253 S254	E247-L250 WeakPolarHBondContact O-CA 3.48Å; E247-L250 WeakPolarHBondContact O-CB 3.34Å; E247-L250 PolarHBondContact O-N 2.68Å; E248-L250 VanDerWaalsContact C-N 3.34Å; L250-N252 PolarHBondContact O-N 3Å; L250-K253 PolarHBondContact O-N 3.34Å; L250-S254 PolarHBondContact O-OG 3.41Å
251	F	34.4	Very low	35	Very low	176 Å²	176	122.7 Å²	122.7	77%	0.772	66%	0.661	S	S	*	*	H	α-helix	trans	-61.6	-42.2	178.2	-155.6	-93.9	0	0	0	112	E247 K253	E247-F251 PolarHBondContact O-N 2.93Å; F251-K253 PolarHBondContact O-N 2.93Å; F251-K253 VanDerWaalsContact O-N 3.07Å
252	N	36.9	Very low	35.1	Very low	143 Å²	143	123.1 Å²	123.1	77%	0.765	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	9.2	-178.6	-76.7	-67.7	0	0	0	115.6	E248 L250	E248-N252 PolarHBondContact O-N 2.82Å; E248-N252 PolarHBondContact O-ND2 3.43Å; L250-N252 PolarHBondContact O-N 3Å
253	K	35.1	Very low	35.1	Very low	190 Å²	190	119.8 Å²	119.8	83%	0.826	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.8	16.4	-175.6	-147.5	175.9	-177.3	176.5	0	115.5	L250 F251	L250-K253 PolarHBondContact O-N 3.34Å; F251-K253 PolarHBondContact O-N 2.93Å; F251-K253 VanDerWaalsContact O-N 3.07Å
254	S	32.3	Very low	35.2	Very low	83 Å²	83	123.4 Å²	123.4	58%	0.58	67%	0.668	S	S	*	*			trans	-123.2	110.8	-176.3	-59.9	0	0	0	0	110.6	L250	L250-S254 PolarHBondContact O-OG 3.41Å
255	E	37.3	Very low	35.4	Very low	189 Å²	189	124.2 Å²	124.2	88%	0.883	68%	0.675	S	S	*	*			trans	-67.6	154.3	171.1	-83.7	-166.3	157.2	0	0	111.6	G257	E255-G257 PolarHBondContact O-N 2.92Å
256	P	39.8	Very low	35.8	Very low	130 Å²	130	126.1 Å²	126.1	84%	0.844	68%	0.68	S	S	*	*			trans	-73.3	111.7	-161.7	27.4	-35.3	0	0	0	113.6
257	G	28	Very low	36.5	Very low	71 Å²	71	123.1 Å²	123.1	73%	0.732	66%	0.661	S	S	*	*			trans	-111.6	100.9	167.3	0	0	0	0	0	111.6	E255 A259	E255-G257 PolarHBondContact O-N 2.92Å; G257-A259 PolarHBondContact O-N 3.32Å
258	E	41.4	Very low	36.9	Very low	200 Å²	200	119.4 Å²	119.4	94%	0.935	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	114.1	-177.7	-64.7	-175.3	123.7	0	0	112.5
259	A	36.6	Very low	37.4	Very low	80 Å²	80	118.9 Å²	118.9	66%	0.661	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.8	-40.8	155.2	0	0	0	0	0	110.4	G257	G257-A259 PolarHBondContact O-N 3.32Å
260	K	34.5	Very low	38.3	Very low	174 Å²	174	114.9 Å²	114.9	76%	0.757	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-14.2	-163.1	-137.4	178	-174.6	-177.1	0	115.2
261	A	34	Very low	39	Very low	74 Å²	74	112.1 Å²	112.1	61%	0.612	62%	0.615	S	S	*	*	H	α-helix	trans	-76.9	-28.7	-176.3	0	0	0	0	0	114.2	H264 L265	A261-H264 PolarHBondContact O-N 3.35Å; A261-L265 PolarHBondContact O-N 3.43Å
262	I	37.3	Very low	39.5	Very low	117 Å²	117	108.8 Å²	108.8	60%	0.6	60%	0.604	S	S	*	*	H	α-helix	trans	-64	-44.6	-171.2	-57.8	169.7	0	0	0	112.5	H264 L265 I266	I262-H264 VanDerWaalsContact C-N 3.34Å; I262-H264 PolarHBondContact O-N 2.99Å; I262-L265 PolarHBondContact O-N 2.96Å; I262-I266 HydrophobicContact CG2-CD1 3.96Å; I262-I266 WeakPolarHBondContact O-CG1 3.5Å; I262-I266 PolarHBondContact O-N 3.18Å; I262-I266 VanDerWaalsContact O-N 3.08Å
263	P	35.1	Very low	39.9	Very low	76 Å²	76	106.5 Å²	106.5	49%	0.494	59%	0.589	S	S	.	*	H	α-helix	trans	-63	-37.5	175.7	-23.1	35.1	0	0	0	113.4	T267	P263-T267 VanDerWaalsContact O-CB 3.29Å; P263-T267 WeakPolarHBondContact O-CB 3.41Å; P263-T267 PolarHBondContact O-N 3.47Å; P263-T267 PolarHBondContact O-OG1 3.28Å
264	H	38.5	Very low	40.7	Very low	132 Å²	132	97.8 Å²	97.8	61%	0.611	55%	0.552	S	S	*	*	H	α-helix	trans	-67.7	-38.7	176.8	-78.7	-90.8	0	0	0	111.9	A261 I262 T267 A268	A261-H264 PolarHBondContact O-N 3.35Å; I262-H264 VanDerWaalsContact C-N 3.34Å; I262-H264 PolarHBondContact O-N 2.99Å; H264-T267 WeakPolarHBondContact O-CB 3.43Å; H264-T267 PolarHBondContact O-N 3.23Å; H264-A268 WeakPolarHBondContact O-CB 3.4Å; H264-A268 PolarHBondContact O-N 3.26Å
265	L	37.2	Very low	41.4	Very low	113 Å²	113	99.5 Å²	99.5	59%	0.592	55%	0.549	S	S	*	.	H	α-helix	trans	-66.8	-42.5	176.6	-169.5	67.1	0	0	0	111.9	A261 I262 T267 A268 M269	A261-L265 PolarHBondContact O-N 3.43Å; I262-L265 PolarHBondContact O-N 2.96Å; L265-T267 VanDerWaalsContact C-N 3.34Å; L265-A268 PolarHBondContact O-N 3.33Å; L265-M269 HydrophobicContact CG-SD 4.47Å; L265-M269 VanDerWaalsContact O-CG 3.3Å; L265-M269 WeakPolarHBondContact O-CG 3.45Å; L265-M269 PolarHBondContact O-N 3.4Å
266	I	44.8	Very low	41.7	Very low	93 Å²	93	95.8 Å²	95.8	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-62.7	-43.2	174.6	-66.2	166.9	0	0	0	110.5	I262 M269 I270	I262-I266 HydrophobicContact CG2-CD1 3.96Å; I262-I266 WeakPolarHBondContact O-CG1 3.5Å; I262-I266 PolarHBondContact O-N 3.18Å; I262-I266 VanDerWaalsContact O-N 3.08Å; I266-M269 PolarHBondContact O-N 3.34Å; I266-I270 HydrophobicContact CG2-CD1 3.87Å; I266-I270 WeakPolarHBondContact O-CB 3.45Å; I266-I270 VanDerWaalsContact O-CG1 3.31Å; I266-I270 WeakPolarHBondContact O-CG1 3.37Å; I266-I270 PolarHBondContact O-N 3.37Å
267	T	46.9	Very low	41.9	Very low	36 Å²	36	95.3 Å²	95.3	22%	0.221	52%	0.516	C	S	.	.	H	α-helix	trans	-58.2	-49.1	173.4	-69	0	0	0	0	111.7	H129 P263 H264 L265 M269 I270 M271	H129-T267 WeakPolarHBondContact CE1-CG2 3.27Å; H129-T267 WeakPolarHBondContact NE2-CG2 3.49Å; P263-T267 VanDerWaalsContact O-CB 3.29Å; P263-T267 WeakPolarHBondContact O-CB 3.41Å; P263-T267 PolarHBondContact O-N 3.47Å; P263-T267 PolarHBondContact O-OG1 3.28Å; H264-T267 WeakPolarHBondContact O-CB 3.43Å; H264-T267 PolarHBondContact O-N 3.23Å; L265-T267 VanDerWaalsContact C-N 3.34Å; T267-M269 PolarHBondContact O-N 3.27Å; T267-I270 PolarHBondContact O-N 3.4Å; T267-M271 HydrophobicContact CG2-CG 4.27Å; T267-M271 WeakPolarHBondContact O-CB 3.37Å; T267-M271 VanDerWaalsContact O-CG 3.27Å; T267-M271 WeakPolarHBondContact O-CG 3.34Å; T267-M271 PolarHBondContact O-N 3.18Å
268	A	43.7	Very low	42.9	Very low	52 Å²	52	94.5 Å²	94.5	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-63.1	-40.3	179.5	0	0	0	0	0	112.2	H264 L265 M271 L272	H264-A268 WeakPolarHBondContact O-CB 3.4Å; H264-A268 PolarHBondContact O-N 3.26Å; L265-A268 PolarHBondContact O-N 3.33Å; A268-M271 PolarHBondContact O-N 3Å; A268-L272 VanDerWaalsContact O-CB 3.29Å; A268-L272 WeakPolarHBondContact O-CB 3.5Å; A268-L272 PolarHBondContact O-N 3.46Å
269	M	45.1	Very low	43.2	Very low	122 Å²	122	89.4 Å²	89.4	60%	0.601	48%	0.482	S	S	*	.	H	α-helix	trans	-63.6	-40.1	174.3	-70.7	177.5	69.8	0	0	112.1	L265 I266 T267 L272 E273	L265-M269 HydrophobicContact CG-SD 4.47Å; L265-M269 VanDerWaalsContact O-CG 3.3Å; L265-M269 WeakPolarHBondContact O-CG 3.45Å; L265-M269 PolarHBondContact O-N 3.4Å; I266-M269 PolarHBondContact O-N 3.34Å; T267-M269 PolarHBondContact O-N 3.27Å; M269-L272 PolarHBondContact O-N 3.24Å; M269-E273 WeakPolarHBondContact O-CB 3.44Å; M269-E273 PolarHBondContact O-N 3.26Å
270	I	51.8	Low	43.5	Very low	41 Å²	41	91.4 Å²	91.4	21%	0.21	49%	0.485	C	S	.	.	H	α-helix	trans	-67.9	-42.8	175.3	-71.6	167.8	0	0	0	111.3	I266 T267 L272 E273 I274 L295	I266-I270 HydrophobicContact CG2-CD1 3.87Å; I266-I270 WeakPolarHBondContact O-CB 3.45Å; I266-I270 VanDerWaalsContact O-CG1 3.31Å; I266-I270 WeakPolarHBondContact O-CG1 3.37Å; I266-I270 PolarHBondContact O-N 3.37Å; T267-I270 PolarHBondContact O-N 3.4Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 3.18Å; I270-E273 PolarHBondContact O-N 3.44Å; I270-I274 HydrophobicContact CG2-CD1 3.77Å; I270-I274 WeakPolarHBondContact O-CB 3.4Å; I270-I274 WeakPolarHBondContact O-CD1 3.48Å; I270-I274 VanDerWaalsContact O-CG1 3.27Å; I270-I274 WeakPolarHBondContact O-CG1 3.41Å; I270-I274 PolarHBondContact O-N 3.16Å; I270-L295 HydrophobicContact CD1-CD2 4.41Å; I270-L295 HydrophobicContact CG2-CD1 3.63Å
271	M	47.8	Very low	43.8	Very low	63 Å²	63	85.6 Å²	85.6	31%	0.31	46%	0.464	S	S	.	.	H	α-helix	trans	-60.1	-43.1	174	-69.9	-77.6	96.7	0	0	111.3	L130 T267 A268 I274 F275	L130-M271 HydrophobicContact CD2-CE 3.74Å; T267-M271 HydrophobicContact CG2-CG 4.27Å; T267-M271 WeakPolarHBondContact O-CB 3.37Å; T267-M271 VanDerWaalsContact O-CG 3.27Å; T267-M271 WeakPolarHBondContact O-CG 3.34Å; T267-M271 PolarHBondContact O-N 3.18Å; A268-M271 PolarHBondContact O-N 3Å; M271-I274 HydrophobicContact CE-CD1 3.84Å; M271-I274 PolarHBondContact O-N 2.95Å; M271-F275 VanDerWaalsContact O-CB 3.31Å; M271-F275 WeakPolarHBondContact O-CB 3.44Å; M271-F275 PolarHBondContact O-N 3.42Å
272	L	45.8	Very low	44.4	Very low	105 Å²	105	88.5 Å²	88.5	55%	0.55	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-40	177.4	-168.3	70.8	0	0	0	112	A268 M269 I270 F275 L276	A268-L272 VanDerWaalsContact O-CB 3.29Å; A268-L272 WeakPolarHBondContact O-CB 3.5Å; A268-L272 PolarHBondContact O-N 3.46Å; M269-L272 PolarHBondContact O-N 3.24Å; I270-L272 VanDerWaalsContact C-N 3.34Å; I270-L272 PolarHBondContact O-N 3.18Å; L272-F275 PolarHBondContact O-N 2.89Å; L272-L276 HydrophobicContact CG-CD1 4.18Å; L272-L276 WeakPolarHBondContact O-CB 3.26Å; L272-L276 WeakPolarHBondContact O-CG 3.35Å; L272-L276 PolarHBondContact O-N 2.69Å
273	E	45.4	Very low	45.1	Very low	96 Å²	96	85.4 Å²	85.4	45%	0.449	47%	0.469	S	S	.	.	H	α-helix	trans	-66.9	-37.8	175.2	-176.1	173.7	-160.7	0	0	112.4	M269 I270 R277	M269-E273 WeakPolarHBondContact O-CB 3.44Å; M269-E273 PolarHBondContact O-N 3.26Å; I270-E273 PolarHBondContact O-N 3.44Å; E273-R277 VanDerWaalsContact CD-NH1 3.3Å; E273-R277 PolarHBondContact O-N 3.21Å; E273-R277 IonicContact OE1-CZ 2.76Å; E273-R277 IonicContact OE1-NH1 3.62Å; E273-R277 PolarHBondContact OE1-NH1 3.42Å; E273-R277 IonicContact OE1-NH2 3.2Å
274	I	50.9	Low	45.8	Very low	7 Å²	7	84.6 Å²	84.6	4%	0.036	46%	0.463	C	S	.	.	H	α-helix	trans	-63.8	-51.2	171.2	-70.8	161.4	0	0	0	109.8	F133 I270 M271 L276 R277 V278 V287 L291 V292 L295	F133-I274 HydrophobicContact CE1-CG2 4.49Å; F133-I274 HydrophobicContact CZ-CG2 4.21Å; I270-I274 HydrophobicContact CG2-CD1 3.77Å; I270-I274 WeakPolarHBondContact O-CB 3.4Å; I270-I274 WeakPolarHBondContact O-CD1 3.48Å; I270-I274 VanDerWaalsContact O-CG1 3.27Å; I270-I274 WeakPolarHBondContact O-CG1 3.41Å; I270-I274 PolarHBondContact O-N 3.16Å; M271-I274 HydrophobicContact CE-CD1 3.84Å; M271-I274 PolarHBondContact O-N 2.95Å; I274-L276 PolarHBondContact O-N 2.65Å; I274-R277 PolarHBondContact O-N 3.29Å; I274-R277 VanDerWaalsContact O-N 3.09Å; I274-V278 HydrophobicContact CG2-CG2 4.04Å; I274-V278 VanDerWaalsContact O-CG2 3.31Å; I274-V278 WeakPolarHBondContact O-CG2 3.3Å; I274-V278 PolarHBondContact O-N 3.43Å; I274-V287 HydrophobicContact CG2-CG1 4.3Å; I274-L291 HydrophobicContact CB-CD2 4.28Å; I274-L291 HydrophobicContact CG1-CD2 3.66Å; I274-L291 HydrophobicContact CG1-CG 4.15Å; I274-V292 HydrophobicContact CD1-CG2 4.39Å; I274-L295 HydrophobicContact CD1-CD1 4.08Å
275	F	47.6	Very low	46.2	Very low	119 Å²	119	81.5 Å²	81.5	52%	0.522	45%	0.453	S	S	.	.	H	α-helix	trans	-57.6	-47.5	-179.5	-176.7	-97.9	0	0	0	112.2	M271 L272 R277 V278 C279	M271-F275 VanDerWaalsContact O-CB 3.31Å; M271-F275 WeakPolarHBondContact O-CB 3.44Å; M271-F275 PolarHBondContact O-N 3.42Å; L272-F275 PolarHBondContact O-N 2.89Å; F275-R277 VanDerWaalsContact C-N 3.26Å; F275-R277 PolarHBondContact O-N 2.67Å; F275-V278 PolarHBondContact O-N 2.67Å; F275-C279 PolarHBondContact O-N 3.04Å; F275-C279 PolarHBondContact O-SG 3.15Å
276	L	44.6	Very low	46.9	Very low	110 Å²	110	80.2 Å²	80.2	58%	0.576	45%	0.447	S	S	*	.	H	α-helix	trans	-59.8	-32.1	176.2	-82.3	162.5	0	0	0	113.2	L272 I274 V280	L272-L276 HydrophobicContact CG-CD1 4.18Å; L272-L276 WeakPolarHBondContact O-CB 3.26Å; L272-L276 WeakPolarHBondContact O-CG 3.35Å; L272-L276 PolarHBondContact O-N 2.69Å; I274-L276 PolarHBondContact O-N 2.65Å; L276-V280 VanDerWaalsContact O-CG2 3.31Å; L276-V280 WeakPolarHBondContact O-CG2 3.47Å
277	R	43.4	Very low	47.2	Very low	121 Å²	121	76.1 Å²	76.1	46%	0.457	43%	0.426	S	S	.	.	H	α-helix	trans	-85.8	-32.3	175.6	-75.9	-166.7	174	94.9	-7.5	114.1	E273 I274 F275 C279 V280 T281 L291	E273-R277 VanDerWaalsContact CD-NH1 3.3Å; E273-R277 PolarHBondContact O-N 3.21Å; E273-R277 IonicContact OE1-CZ 2.76Å; E273-R277 IonicContact OE1-NH1 3.62Å; E273-R277 PolarHBondContact OE1-NH1 3.42Å; E273-R277 IonicContact OE1-NH2 3.2Å; I274-R277 PolarHBondContact O-N 3.29Å; I274-R277 VanDerWaalsContact O-N 3.09Å; F275-R277 VanDerWaalsContact C-N 3.26Å; F275-R277 PolarHBondContact O-N 2.67Å; R277-C279 VanDerWaalsContact C-N 3.28Å; R277-C279 PolarHBondContact O-N 2.58Å; R277-V280 PolarHBondContact O-N 2.98Å; R277-V280 VanDerWaalsContact O-N 3.13Å; R277-T281 PolarHBondContact O-N 2.76Å; R277-T281 PolarHBondContact O-OG1 3.5Å; R277-L291 HydrophobicContact CB-CD2 4.4Å
278	V	49.4	Very low	47.5	Very low	54 Å²	54	74.8 Å²	74.8	33%	0.327	42%	0.418	S	S	.	.	H	α-helix	trans	-60.2	-40.6	172	170.1	0	0	0	0	110.6	I274 F275 V280 V287	I274-V278 HydrophobicContact CG2-CG2 4.04Å; I274-V278 VanDerWaalsContact O-CG2 3.31Å; I274-V278 WeakPolarHBondContact O-CG2 3.3Å; I274-V278 PolarHBondContact O-N 3.43Å; F275-V278 PolarHBondContact O-N 2.67Å; V278-V280 PolarHBondContact O-N 3.23Å; V278-V287 HydrophobicContact CG2-CB 4.29Å; V278-V287 HydrophobicContact CG2-CG1 3.81Å; V278-V287 HydrophobicContact CG2-CG2 4.02Å
279	C	45.9	Very low	48	Very low	92 Å²	92	75.3 Å²	75.3	62%	0.622	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.6	177.1	-70.2	0	0	0	0	114.6	F275 R277	F275-C279 PolarHBondContact O-N 3.04Å; F275-C279 PolarHBondContact O-SG 3.15Å; R277-C279 VanDerWaalsContact C-N 3.28Å; R277-C279 PolarHBondContact O-N 2.58Å
280	V	43.1	Very low	48.4	Very low	122 Å²	122	73.3 Å²	73.3	74%	0.739	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-30.6	-176.6	173	0	0	0	0	112.7	L276 R277 V278	L276-V280 VanDerWaalsContact O-CG2 3.31Å; L276-V280 WeakPolarHBondContact O-CG2 3.47Å; R277-V280 PolarHBondContact O-N 2.98Å; R277-V280 VanDerWaalsContact O-N 3.13Å; V278-V280 PolarHBondContact O-N 3.23Å
281	T	42.3	Very low	48.5	Very low	52 Å²	52	73.1 Å²	73.1	32%	0.319	42%	0.42	S	S	.	.	S	Bend	trans	-97.7	118.6	-178.6	50.9	0	0	0	0	111.1	R277 S283 V287	R277-T281 PolarHBondContact O-N 2.76Å; R277-T281 PolarHBondContact O-OG1 3.5Å; T281-S283 PolarHBondContact O-N 3.38Å; T281-V287 VanDerWaalsContact OG1-CG2 3.3Å; T281-V287 WeakPolarHBondContact OG1-CG2 3.44Å
282	S	46.5	Very low	49	Very low	136 Å²	136	70.1 Å²	70.1	95%	0.951	41%	0.405	S	S	*	.	S	Bend	trans	-74	15.3	-169.4	54.2	0	0	0	0	115.6
283	S	50.3	Low	49.8	Very low	51 Å²	51	66.3 Å²	66.3	36%	0.357	39%	0.387	S	S	.	.			trans	-145.3	122.7	170.4	82.6	0	0	0	0	112.4	T281 T285 D286	T281-S283 PolarHBondContact O-N 3.38Å; S283-T285 VanDerWaalsContact CB-OG1 3.3Å; S283-T285 WeakPolarHBondContact CB-OG1 3.49Å; S283-T285 PolarHBondContact O-N 2.97Å; S283-T285 VanDerWaalsContact O-N 3.11Å; S283-T285 PolarHBondContact OG-OG1 2.7Å; S283-D286 PolarHBondContact O-N 2.86Å; S283-D286 VanDerWaalsContact O-N 3.12Å
284	V	50.9	Low	50.6	Low	60 Å²	60	64.9 Å²	64.9	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-20.6	177.3	-140.6	0	0	0	0	112.4	F140 D286 S288	F140-V284 HydrophobicContact CD1-CG2 4.12Å; F140-V284 HydrophobicContact CE1-CG2 3.82Å; V284-D286 VanDerWaalsContact C-N 3.31Å; V284-D286 PolarHBondContact O-N 3.42Å; V284-S288 PolarHBondContact O-N 3.28Å; V284-S288 PolarHBondContact O-OG 3.19Å
285	T	47.8	Very low	51	Low	67 Å²	67	65.8 Å²	65.8	41%	0.411	39%	0.391	S	S	.	.	H	α-helix	trans	-65.9	-27.7	176	40.8	0	0	0	0	114.3	R141 S283	R141-T285 HydrophobicContact CG-CG2 4Å; S283-T285 VanDerWaalsContact CB-OG1 3.3Å; S283-T285 WeakPolarHBondContact CB-OG1 3.49Å; S283-T285 PolarHBondContact O-N 2.97Å; S283-T285 VanDerWaalsContact O-N 3.11Å; S283-T285 PolarHBondContact OG-OG1 2.7Å
286	D	49.9	Very low	51.8	Low	86 Å²	86	60.1 Å²	60.1	46%	0.46	37%	0.366	S	S	.	.	H	α-helix	trans	-79.4	-44.9	177.9	-164.4	9.1	0	0	0	110.2	S283 V284 S288 A289 S290	S283-D286 PolarHBondContact O-N 2.86Å; S283-D286 VanDerWaalsContact O-N 3.12Å; V284-D286 VanDerWaalsContact C-N 3.31Å; V284-D286 PolarHBondContact O-N 3.42Å; D286-S288 PolarHBondContact O-N 3.4Å; D286-A289 PolarHBondContact O-N 2.93Å; D286-S290 WeakPolarHBondContact O-CB 3.49Å; D286-S290 PolarHBondContact O-N 3.14Å
287	V	51.9	Low	52.6	Low	7 Å²	7	57.3 Å²	57.3	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-61.8	-42.6	-178.4	-173.3	0	0	0	0	112.9	I274 V278 T281 A289 L291 V292	I274-V287 HydrophobicContact CG2-CG1 4.3Å; V278-V287 HydrophobicContact CG2-CB 4.29Å; V278-V287 HydrophobicContact CG2-CG1 3.81Å; V278-V287 HydrophobicContact CG2-CG2 4.02Å; T281-V287 VanDerWaalsContact OG1-CG2 3.3Å; T281-V287 WeakPolarHBondContact OG1-CG2 3.44Å; V287-A289 PolarHBondContact O-N 3.29Å; V287-L291 HydrophobicContact CG1-CB 4.19Å; V287-L291 HydrophobicContact CG1-CD2 4.21Å; V287-L291 WeakPolarHBondContact O-CB 3.46Å; V287-L291 PolarHBondContact O-N 3.43Å; V287-V292 PolarHBondContact O-N 3.01Å; V287-V292 VanDerWaalsContact O-N 3.13Å
288	S	53.7	Low	53.7	Low	8 Å²	8	60.9 Å²	60.9	6%	0.056	37%	0.369	C	S	.	.	I	π-helix	trans	-64.9	-39.6	-179.6	59.8	0	0	0	0	112.3	V284 D286 C293	V284-S288 PolarHBondContact O-N 3.28Å; V284-S288 PolarHBondContact O-OG 3.19Å; D286-S288 PolarHBondContact O-N 3.4Å; S288-C293 PolarHBondContact O-N 2.9Å; S288-C293 PolarHBondContact O-SG 3.08Å
289	A	54	Low	54.4	Low	62 Å²	62	61.2 Å²	61.2	51%	0.512	37%	0.367	S	S	.	.	I	π-helix	trans	-80	-43.1	178.9	0	0	0	0	0	113.5	D286 V287	D286-A289 PolarHBondContact O-N 2.93Å; V287-A289 PolarHBondContact O-N 3.29Å
290	S	53	Low	55.2	Low	80 Å²	80	57.7 Å²	57.7	56%	0.559	34%	0.341	S	S	*	.	I	π-helix	trans	-87.2	-27.3	-171.4	-172.6	0	0	0	0	114.1	D286	D286-S290 WeakPolarHBondContact O-CB 3.49Å; D286-S290 PolarHBondContact O-N 3.14Å
291	L	55.2	Low	56.2	Low	38 Å²	38	55.3 Å²	55.3	20%	0.199	33%	0.326	C	S	.	.	I	π-helix	trans	-118.1	-45.7	-173.8	-166.1	62.6	0	0	0	112.3	I274 R277 V287 L295	I274-L291 HydrophobicContact CB-CD2 4.28Å; I274-L291 HydrophobicContact CG1-CD2 3.66Å; I274-L291 HydrophobicContact CG1-CG 4.15Å; R277-L291 HydrophobicContact CB-CD2 4.4Å; V287-L291 HydrophobicContact CG1-CB 4.19Å; V287-L291 HydrophobicContact CG1-CD2 4.21Å; V287-L291 WeakPolarHBondContact O-CB 3.46Å; V287-L291 PolarHBondContact O-N 3.43Å; L291-L295 WeakPolarHBondContact O-CD1 3.29Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å
292	V	57.7	Low	57.2	Low	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.328	C	S	.	.	I	π-helix	trans	-79	-45.1	-176.3	-178.1	0	0	0	0	112.4	F133 W134 I274 V287 L295 I296	F133-V292 HydrophobicContact CD1-CG1 4.48Å; F133-V292 HydrophobicContact CD1-CG2 3.93Å; F133-V292 HydrophobicContact CE1-CG2 3.79Å; W134-V292 HydrophobicContact CB-CG1 4.15Å; I274-V292 HydrophobicContact CD1-CG2 4.39Å; V287-V292 PolarHBondContact O-N 3.01Å; V287-V292 VanDerWaalsContact O-N 3.13Å; V292-L295 PolarHBondContact O-N 3.37Å; V292-L295 VanDerWaalsContact O-N 3.09Å; V292-I296 HydrophobicContact CG1-CD1 3.73Å; V292-I296 HydrophobicContact CG1-CG1 4.11Å; V292-I296 WeakPolarHBondContact O-CG1 3.39Å; V292-I296 PolarHBondContact O-N 3.21Å
293	C	61.5	Low	58.1	Low	25 Å²	25	49.8 Å²	49.8	17%	0.169	28%	0.282	C	S	.	.	H	α-helix	trans	-55.7	-44.7	177.2	-75	0	0	0	0	113.4	W134 S288 L295 I296 S297	W134-C293 PolarHBondContact NE1-SG 2.95Å; S288-C293 PolarHBondContact O-N 2.9Å; S288-C293 PolarHBondContact O-SG 3.08Å; C293-L295 VanDerWaalsContact C-N 3.34Å; C293-L295 PolarHBondContact O-N 3.48Å; C293-I296 PolarHBondContact O-N 3.36Å; C293-S297 WeakPolarHBondContact O-CB 3.49Å; C293-S297 PolarHBondContact O-N 3.44Å; C293-S297 PolarHBondContact O-OG 2.95Å
294	P	62.3	Low	58.9	Low	65 Å²	65	50.5 Å²	50.5	42%	0.422	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-33.7	173.8	-27.5	37	0	0	0	115.1	S297 R298	P294-S297 WeakPolarHBondContact O-CB 3.27Å; P294-S297 PolarHBondContact O-N 3.13Å; P294-R298 PolarHBondContact O-N 2.88Å
295	L	60.6	Low	59.4	Low	27 Å²	27	56.1 Å²	56.1	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-69.2	-47	175.1	-70	167.7	0	0	0	110.8	L130 I270 I274 L291 V292 C293 S297 R298 H299	L130-L295 HydrophobicContact CD1-CB 4.47Å; I270-L295 HydrophobicContact CD1-CD2 4.41Å; I270-L295 HydrophobicContact CG2-CD1 3.63Å; I274-L295 HydrophobicContact CD1-CD1 4.08Å; L291-L295 WeakPolarHBondContact O-CD1 3.29Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; V292-L295 PolarHBondContact O-N 3.37Å; V292-L295 VanDerWaalsContact O-N 3.09Å; C293-L295 VanDerWaalsContact C-N 3.34Å; C293-L295 PolarHBondContact O-N 3.48Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 3.08Å; L295-R298 WeakPolarHBondContact O-CB 3.35Å; L295-R298 PolarHBondContact O-N 2.84Å; L295-R298 VanDerWaalsContact O-N 3.13Å; L295-H299 PolarHBondContact O-CD2 3.49Å
296	I	63.4	Low	60.4	Low	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-38.5	173.9	-61.9	178.7	0	0	0	110.7	V105 L109 F118 L130 W134 V292 C293 R298 H299 F300	V105-I296 HydrophobicContact CG1-CB 4.22Å; V105-I296 HydrophobicContact CG1-CG2 3.74Å; L109-I296 HydrophobicContact CD1-CD1 4.07Å; L109-I296 HydrophobicContact CD1-CG2 4.29Å; L109-I296 HydrophobicContact CD2-CD1 4.31Å; L109-I296 HydrophobicContact CD2-CG2 4.44Å; F118-I296 HydrophobicContact CE1-CG2 3.62Å; F118-I296 HydrophobicContact CZ-CG2 3.52Å; L130-I296 HydrophobicContact CB-CG1 4.23Å; W134-I296 HydrophobicContact CB-CD1 3.89Å; W134-I296 HydrophobicContact CG-CD1 4.14Å; V292-I296 HydrophobicContact CG1-CD1 3.73Å; V292-I296 HydrophobicContact CG1-CG1 4.11Å; V292-I296 WeakPolarHBondContact O-CG1 3.39Å; V292-I296 PolarHBondContact O-N 3.21Å; C293-I296 PolarHBondContact O-N 3.36Å; I296-R298 PolarHBondContact O-N 3.35Å; I296-H299 CarbonylContact O-C 3.41Å; I296-H299 PolarHBondContact O-N 3.4Å; I296-H299 VanDerWaalsContact O-N 3.08Å; I296-F300 PolarHBondContact O-N 3.38Å
297	S	61.8	Low	61.3	Low	50 Å²	50	51.4 Å²	51.4	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-31.9	175.3	-63.6	0	0	0	0	113.9	C293 P294 L295 F300 T301	C293-S297 WeakPolarHBondContact O-CB 3.49Å; C293-S297 PolarHBondContact O-N 3.44Å; C293-S297 PolarHBondContact O-OG 2.95Å; P294-S297 WeakPolarHBondContact O-CB 3.27Å; P294-S297 PolarHBondContact O-N 3.13Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 3.08Å; S297-F300 WeakPolarHBondContact O-CB 3.46Å; S297-F300 PolarHBondContact O-N 3.32Å; S297-T301 PolarHBondContact O-OG1 3.22Å
298	R	66.3	Low	62.1	Low	196 Å²	196	51.3 Å²	51.3	74%	0.74	27%	0.267	S	S	*	.	H	α-helix	trans	-67.1	-39.9	176.3	-69.9	176.6	171.3	-177.8	-2.6	111.9	P294 L295 I296 F300	P294-R298 PolarHBondContact O-N 2.88Å; L295-R298 WeakPolarHBondContact O-CB 3.35Å; L295-R298 PolarHBondContact O-N 2.84Å; L295-R298 VanDerWaalsContact O-N 3.13Å; I296-R298 PolarHBondContact O-N 3.35Å; R298-F300 VanDerWaalsContact C-N 3.34Å
299	H	63.7	Low	63	Low	62 Å²	62	51.9 Å²	51.9	29%	0.287	27%	0.268	S	S	.	.	H	α-helix	trans	-77.8	-20.9	174.4	-62.7	-86.4	0	0	0	112.6	M122 L295 I296 E302 F303	M122-H299 HydrophobicContact CE-CB 3.87Å; M122-H299 HydrophobicContact SD-CB 3.39Å; M122-H299 WeakPolarHBondContact SD-CB 3.43Å; L295-H299 PolarHBondContact O-CD2 3.49Å; I296-H299 CarbonylContact O-C 3.41Å; I296-H299 PolarHBondContact O-N 3.4Å; I296-H299 VanDerWaalsContact O-N 3.08Å; H299-E302 CarbonylContact O-C 3.54Å; H299-E302 WeakPolarHBondContact O-CB 3.45Å; H299-E302 PolarHBondContact O-N 2.92Å; H299-F303 PolarHBondContact O-N 2.9Å
300	F	64.1	Low	63.7	Low	17 Å²	17	50 Å²	50	8%	0.075	25%	0.251	C	S	.	.	H	α-helix	trans	-67.1	-46.6	-177.5	-173.6	-110.7	0	0	0	113.8	K103 V105 V108 F118 I296 S297 R298 E302 F303 L304	K103-F300 WeakPolarHBondContact O-CE1 3.43Å; K103-F300 VanDerWaalsContact O-CZ 3.25Å; K103-F300 WeakPolarHBondContact O-CZ 3.27Å; V105-F300 HydrophobicContact CG2-CB 3.59Å; V105-F300 HydrophobicContact CG2-CD1 3.57Å; V105-F300 HydrophobicContact CG2-CD2 4.08Å; V105-F300 HydrophobicContact CG2-CE1 4.28Å; V105-F300 HydrophobicContact CG2-CG 3.45Å; V105-F300 VanDerWaalsContact CG2-CG 3.45Å; V108-F300 HydrophobicContact CB-CE2 4.02Å; V108-F300 HydrophobicContact CG1-CE2 4.43Å; V108-F300 HydrophobicContact CG2-CE2 3.6Å; V108-F300 HydrophobicContact CG2-CZ 3.99Å; F118-F300 HydrophobicContact CD2-CD2 4.46Å; F118-F300 HydrophobicContact CE2-CD2 4.04Å; I296-F300 PolarHBondContact O-N 3.38Å; S297-F300 WeakPolarHBondContact O-CB 3.46Å; S297-F300 PolarHBondContact O-N 3.32Å; R298-F300 VanDerWaalsContact C-N 3.34Å; F300-E302 PolarHBondContact O-N 3.41Å; F300-F303 HydrophobicContact CD2-CD1 4.07Å; F300-F303 AromaticContact CE2-CD1 3.83Å; F300-F303 HydrophobicContact CE2-CD1 3.83Å; F300-F303 HydrophobicContact CE2-CE1 4.24Å; F300-F303 WeakPolarHBondContact O-CB 3.4Å; F300-F303 PolarHBondContact O-N 3.48Å; F300-F303 VanDerWaalsContact O-N 3.08Å; F300-L304 HydrophobicContact CD1-CD1 4.11Å; F300-L304 HydrophobicContact CD1-CG 4.37Å; F300-L304 HydrophobicContact CE1-CD1 3.74Å; F300-L304 HydrophobicContact CE1-CD2 4.17Å; F300-L304 HydrophobicContact CE1-CG 4.01Å; F300-L304 HydrophobicContact CE2-CD2 4.48Å; F300-L304 HydrophobicContact CZ-CD1 4.32Å; F300-L304 HydrophobicContact CZ-CD2 3.89Å; F300-L304 HydrophobicContact CZ-CG 4.14Å; F300-L304 WeakPolarHBondContact O-CG 3.34Å; F300-L304 PolarHBondContact O-N 3.4Å
301	T	63	Low	64.7	Low	72 Å²	72	49.3 Å²	49.3	44%	0.442	24%	0.238	S	C	.	.	H	α-helix	trans	-56.5	-22	174.4	-41.5	0	0	0	0	112.8	S297 R305	S297-T301 PolarHBondContact O-OG1 3.22Å; T301-R305 PolarHBondContact O-NH1 3.19Å
302	E	63	Low	65.6	Low	73 Å²	73	47.7 Å²	47.7	34%	0.341	23%	0.229	S	C	.	.	H	α-helix	trans	-98.8	-26.9	-177.2	176.8	58.3	-163.7	0	0	112.1	R125 H299 F300 R305 S306	R125-E302 VanDerWaalsContact CZ-CG 3.44Å; R125-E302 IonicContact CZ-OE1 3.93Å; R125-E302 IonicContact NH1-OE1 3.77Å; R125-E302 PolarHBondContact NH1-OE1 2.84Å; R125-E302 IonicContact NH2-OE1 2.68Å; R125-E302 PolarHBondContact NH2-OE1 3.23Å; H299-E302 CarbonylContact O-C 3.54Å; H299-E302 WeakPolarHBondContact O-CB 3.45Å; H299-E302 PolarHBondContact O-N 2.92Å; F300-E302 PolarHBondContact O-N 3.41Å; E302-R305 PolarHBondContact O-N 2.89Å; E302-S306 PolarHBondContact O-N 3.45Å
303	F	66.4	Low	66.4	Low	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.5	-43	160	164.9	-109.1	0	0	0	111.3	H117 F118 C121 H299 F300 R305 S306 H308 F309	H117-F303 HydrophobicContact CB-CE2 4.22Å; H117-F303 HydrophobicContact CB-CZ 4.39Å; F118-F303 HydrophobicContact CB-CE2 4.25Å; F118-F303 HydrophobicContact CB-CZ 4.27Å; F118-F303 HydrophobicContact CD2-CB 3.76Å; F118-F303 AromaticContact CD2-CD1 3.74Å; F118-F303 HydrophobicContact CD2-CD1 3.74Å; F118-F303 AromaticContact CD2-CD2 3.85Å; F118-F303 HydrophobicContact CD2-CD2 3.85Å; F118-F303 HydrophobicContact CD2-CE1 4.24Å; F118-F303 HydrophobicContact CD2-CE2 4.33Å; F118-F303 AromaticContact CD2-CG 3.51Å; F118-F303 HydrophobicContact CD2-CG 3.51Å; F118-F303 HydrophobicContact CE2-CB 3.78Å; F118-F303 HydrophobicContact CE2-CD1 4.34Å; F118-F303 HydrophobicContact CE2-CG 4.06Å; C121-F303 HydrophobicContact CB-CD2 3.79Å; C121-F303 HydrophobicContact CB-CE2 4.49Å; H299-F303 PolarHBondContact O-N 2.9Å; F300-F303 HydrophobicContact CD2-CD1 4.07Å; F300-F303 AromaticContact CE2-CD1 3.83Å; F300-F303 HydrophobicContact CE2-CD1 3.83Å; F300-F303 HydrophobicContact CE2-CE1 4.24Å; F300-F303 WeakPolarHBondContact O-CB 3.4Å; F300-F303 PolarHBondContact O-N 3.48Å; F300-F303 VanDerWaalsContact O-N 3.08Å; F303-R305 PolarHBondContact O-N 3.3Å; F303-R305 VanDerWaalsContact O-N 3.07Å; F303-S306 WeakPolarHBondContact O-CB 3.49Å; F303-S306 PolarHBondContact O-N 2.98Å; F303-S306 PolarHBondContact O-OG 3.02Å; F303-H308 HydrophobicContact CD2-CB 4.27Å; F303-H308 HydrophobicContact CE2-CB 3.97Å; F303-F309 HydrophobicContact CD1-CB 4.37Å; F303-F309 HydrophobicContact CD1-CD2 4.33Å; F303-F309 HydrophobicContact CD2-CB 4.27Å; F303-F309 HydrophobicContact CE1-CB 4.09Å; F303-F309 AromaticContact CE1-CD2 3.62Å; F303-F309 HydrophobicContact CE1-CD2 3.62Å; F303-F309 HydrophobicContact CE1-CE2 4.45Å; F303-F309 HydrophobicContact CE1-CG 4.19Å; F303-F309 HydrophobicContact CE2-CB 3.99Å; F303-F309 HydrophobicContact CG-CB 4.47Å; F303-F309 HydrophobicContact CZ-CB 3.91Å; F303-F309 AromaticContact CZ-CD2 3.89Å; F303-F309 HydrophobicContact CZ-CD2 3.89Å; F303-F309 HydrophobicContact CZ-CG 4.36Å; F303-F309 WeakPolarHBondContact O-CB 3.33Å
304	L	65.9	Low	67.1	Low	66 Å²	66	48.5 Å²	48.5	35%	0.346	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.7	176.1	-66.9	178	0	0	0	113.7	F300 F309	F300-L304 HydrophobicContact CD1-CD1 4.11Å; F300-L304 HydrophobicContact CD1-CG 4.37Å; F300-L304 HydrophobicContact CE1-CD1 3.74Å; F300-L304 HydrophobicContact CE1-CD2 4.17Å; F300-L304 HydrophobicContact CE1-CG 4.01Å; F300-L304 HydrophobicContact CE2-CD2 4.48Å; F300-L304 HydrophobicContact CZ-CD1 4.32Å; F300-L304 HydrophobicContact CZ-CD2 3.89Å; F300-L304 HydrophobicContact CZ-CG 4.14Å; F300-L304 WeakPolarHBondContact O-CG 3.34Å; F300-L304 PolarHBondContact O-N 3.4Å; L304-F309 HydrophobicContact CB-CD1 4.37Å; L304-F309 HydrophobicContact CB-CE1 4.37Å; L304-F309 HydrophobicContact CD2-CD1 4.02Å; L304-F309 HydrophobicContact CD2-CD2 4.05Å; L304-F309 HydrophobicContact CD2-CE1 3.58Å; L304-F309 HydrophobicContact CD2-CE2 3.65Å; L304-F309 HydrophobicContact CD2-CG 4.22Å; L304-F309 HydrophobicContact CD2-CZ 3.38Å; L304-F309 VanDerWaalsContact O-CD1 3.26Å; L304-F309 WeakPolarHBondContact O-CD1 3.44Å
305	R	63	Low	67.8	Low	178 Å²	178	49.8 Å²	49.8	67%	0.672	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-3.7	173.1	-66.3	-172.3	179.7	103.9	4.4	114	T301 E302 F303	T301-R305 PolarHBondContact O-NH1 3.19Å; E302-R305 PolarHBondContact O-N 2.89Å; F303-R305 PolarHBondContact O-N 3.3Å; F303-R305 VanDerWaalsContact O-N 3.07Å
306	S	68	Low	68.6	Low	10 Å²	10	48.9 Å²	48.9	7%	0.07	23%	0.227	C	C	.	.	S	Bend	trans	-89.5	152	-174.4	76.3	0	0	0	0	112.7	E302 F303 H308 F309 C310	E302-S306 PolarHBondContact O-N 3.45Å; F303-S306 WeakPolarHBondContact O-CB 3.49Å; F303-S306 PolarHBondContact O-N 2.98Å; F303-S306 PolarHBondContact O-OG 3.02Å; S306-H308 PolarHBondContact O-N 2.94Å; S306-H308 PolarHBondContact OG-N 2.96Å; S306-F309 PolarHBondContact O-N 3.13Å; S306-C310 PolarHBondContact O-N 2.76Å
307	H	68.6	Low	69.3	Low	44 Å²	44	49.1 Å²	49.1	20%	0.204	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-18.9	173.2	64.5	-114.2	0	0	0	113.4	C310 K311 D459	H307-C310 PolarHBondContact O-N 2.92Å; H307-K311 WeakPolarHBondContact O-CB 3.45Å; H307-K311 VanDerWaalsContact O-CG 3.3Å; H307-K311 WeakPolarHBondContact O-CG 3.21Å; H307-K311 PolarHBondContact O-N 2.98Å; H307-D459 IonicContact ND1-OD2 2.77Å
308	H	69.7	Low	70.1	Confident	5 Å²	5	50 Å²	50	2%	0.023	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-38.6	174	-58.1	-62.6	0	0	0	112.3	H120 C121 Q124 F303 S306 K311 Y312	H120-H308 AromaticContact CD2-CE1 3.3Å; H120-H308 PolarHBondContact CD2-CE1 3.38Å; H120-H308 AromaticContact CD2-ND1 3.62Å; H120-H308 AromaticContact NE2-CE1 3.86Å; C121-H308 HydrophobicContact CB-CB 4.13Å; C121-H308 VanDerWaalsContact CB-CD2 3.44Å; C121-H308 WeakPolarHBondContact CB-CD2 3.35Å; Q124-H308 VanDerWaalsContact CD-NE2 3.29Å; Q124-H308 PolarHBondContact NE2-CE1 3.46Å; Q124-H308 VanDerWaalsContact NE2-CE1 3.28Å; Q124-H308 PolarHBondContact NE2-NE2 3.33Å; Q124-H308 PolarHBondContact OE1-NE2 2.77Å; F303-H308 HydrophobicContact CD2-CB 4.27Å; F303-H308 HydrophobicContact CE2-CB 3.97Å; S306-H308 PolarHBondContact O-N 2.94Å; S306-H308 PolarHBondContact OG-N 2.96Å; H308-K311 PolarHBondContact O-N 3.2Å; H308-Y312 WeakPolarHBondContact O-CB 3.36Å; H308-Y312 PolarHBondContact O-N 3.43Å
309	F	71.4	Confident	70.3	Confident	19 Å²	19	43.4 Å²	43.4	8%	0.083	22%	0.216	C	C	.	.	H	α-helix	trans	-71.4	-35.2	174.8	-179.9	-121.2	0	0	0	111.3	M101 F303 L304 S306 Y312 Q313	M101-F309 VanDerWaalsContact O-CZ 3.26Å; M101-F309 WeakPolarHBondContact O-CZ 3.39Å; F303-F309 HydrophobicContact CD1-CB 4.37Å; F303-F309 HydrophobicContact CD1-CD2 4.33Å; F303-F309 HydrophobicContact CD2-CB 4.27Å; F303-F309 HydrophobicContact CE1-CB 4.09Å; F303-F309 AromaticContact CE1-CD2 3.62Å; F303-F309 HydrophobicContact CE1-CD2 3.62Å; F303-F309 HydrophobicContact CE1-CE2 4.45Å; F303-F309 HydrophobicContact CE1-CG 4.19Å; F303-F309 HydrophobicContact CE2-CB 3.99Å; F303-F309 HydrophobicContact CG-CB 4.47Å; F303-F309 HydrophobicContact CZ-CB 3.91Å; F303-F309 AromaticContact CZ-CD2 3.89Å; F303-F309 HydrophobicContact CZ-CD2 3.89Å; F303-F309 HydrophobicContact CZ-CG 4.36Å; F303-F309 WeakPolarHBondContact O-CB 3.33Å; L304-F309 HydrophobicContact CB-CD1 4.37Å; L304-F309 HydrophobicContact CB-CE1 4.37Å; L304-F309 HydrophobicContact CD2-CD1 4.02Å; L304-F309 HydrophobicContact CD2-CD2 4.05Å; L304-F309 HydrophobicContact CD2-CE1 3.58Å; L304-F309 HydrophobicContact CD2-CE2 3.65Å; L304-F309 HydrophobicContact CD2-CG 4.22Å; L304-F309 HydrophobicContact CD2-CZ 3.38Å; L304-F309 VanDerWaalsContact O-CD1 3.26Å; L304-F309 WeakPolarHBondContact O-CD1 3.44Å; S306-F309 PolarHBondContact O-N 3.13Å; F309-Y312 AromaticContact CD2-CD1 3.87Å; F309-Y312 HydrophobicContact CD2-CD1 3.87Å; F309-Y312 HydrophobicContact CE2-CD1 4.02Å; F309-Y312 HydrophobicContact CE2-CE1 4.3Å; F309-Y312 WeakPolarHBondContact O-CB 3.16Å; F309-Y312 PolarHBondContact O-N 3.28Å; F309-Q313 VanDerWaalsContact CD1-NE2 3.28Å; F309-Q313 HydrophobicContact CZ-CG 4.46Å; F309-Q313 WeakPolarHBondContact O-CG 3.28Å; F309-Q313 PolarHBondContact O-N 2.87Å
310	C	69	Low	70.3	Confident	23 Å²	23	44.2 Å²	44.2	16%	0.155	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-40.6	171.1	-60.3	0	0	0	0	112.5	S306 H307 Y312 Q313 I314 L452 V456	S306-C310 PolarHBondContact O-N 2.76Å; H307-C310 PolarHBondContact O-N 2.92Å; C310-Y312 VanDerWaalsContact C-N 3.34Å; C310-Y312 PolarHBondContact O-N 3.23Å; C310-Q313 PolarHBondContact O-N 3.43Å; C310-I314 WeakPolarHBondContact O-CD1 3.32Å; C310-I314 VanDerWaalsContact O-CG1 3.28Å; C310-I314 WeakPolarHBondContact O-CG1 3.4Å; C310-I314 PolarHBondContact O-N 3.16Å; C310-L452 HydrophobicContact CB-CD1 4.49Å; C310-V456 HydrophobicContact CB-CG2 3.4Å; C310-V456 VanDerWaalsContact CB-CG2 3.4Å
311	K	73.4	Confident	70.6	Confident	65 Å²	65	46.2 Å²	46.2	28%	0.283	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-44.5	172.3	-75.7	170.1	-178.5	174.6	0	111.2	H307 H308 I314 E315 V456 E460	H307-K311 WeakPolarHBondContact O-CB 3.45Å; H307-K311 VanDerWaalsContact O-CG 3.3Å; H307-K311 WeakPolarHBondContact O-CG 3.21Å; H307-K311 PolarHBondContact O-N 2.98Å; H308-K311 PolarHBondContact O-N 3.2Å; K311-I314 PolarHBondContact O-N 3.11Å; K311-E315 PolarHBondContact O-N 3Å; K311-V456 HydrophobicContact CD-CG1 4.3Å; K311-V456 VanDerWaalsContact CE-CG1 3.43Å; K311-V456 HydrophobicContact CG-CG1 3.89Å; K311-V456 HydrophobicContact CG-CG2 4.49Å; K311-E460 WeakPolarHBondContact CE-OE1 3.49Å; K311-E460 IonicContact NZ-OE1 3.63Å; K311-E460 PolarHBondContact NZ-OE1 3.23Å
312	Y	75.4	Confident	71.5	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-43.9	172.6	166.6	-101.6	0	0	0	113.2	R100 K103 V113 A114 H308 F309 C310 I314 E315 V316	R100-Y312 WeakPolarHBondContact O-CE1 3.34Å; R100-Y312 PolarHBondContact O-OH 3.26Å; K103-Y312 WeakPolarHBondContact CE-OH 3.45Å; K103-Y312 PolarHBondContact NZ-OH 2.84Å; V113-Y312 HydrophobicContact CB-CE2 4.13Å; V113-Y312 HydrophobicContact CG1-CD2 4.09Å; V113-Y312 HydrophobicContact CG1-CE2 3.89Å; A114-Y312 HydrophobicContact CB-CD2 4.06Å; A114-Y312 HydrophobicContact CB-CE1 4.48Å; A114-Y312 HydrophobicContact CB-CE2 3.73Å; H308-Y312 WeakPolarHBondContact O-CB 3.36Å; H308-Y312 PolarHBondContact O-N 3.43Å; F309-Y312 AromaticContact CD2-CD1 3.87Å; F309-Y312 HydrophobicContact CD2-CD1 3.87Å; F309-Y312 HydrophobicContact CE2-CD1 4.02Å; F309-Y312 HydrophobicContact CE2-CE1 4.3Å; F309-Y312 WeakPolarHBondContact O-CB 3.16Å; F309-Y312 PolarHBondContact O-N 3.28Å; C310-Y312 VanDerWaalsContact C-N 3.34Å; C310-Y312 PolarHBondContact O-N 3.23Å; Y312-I314 PolarHBondContact O-N 3.47Å; Y312-E315 PolarHBondContact O-N 3.41Å; Y312-V316 HydrophobicContact CD2-CG2 4.23Å; Y312-V316 HydrophobicContact CE1-CG2 3.98Å; Y312-V316 HydrophobicContact CE2-CG2 3.54Å; Y312-V316 WeakPolarHBondContact O-CG2 3.36Å; Y312-V316 PolarHBondContact O-N 3.46Å; Y312-V316 WeakPolarHBondContact OH-CG2 3.44Å
313	Q	73.8	Confident	72.5	Confident	15 Å²	15	45.3 Å²	45.3	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-45.2	174.3	-76	178.8	34.7	0	0	111.7	M101 F309 C310 E315 V316 L317 L452	M101-Q313 HydrophobicContact CE-CB 3.88Å; M101-Q313 HydrophobicContact CE-CG 3.63Å; M101-Q313 HydrophobicContact CG-CG 4.5Å; F309-Q313 VanDerWaalsContact CD1-NE2 3.28Å; F309-Q313 HydrophobicContact CZ-CG 4.46Å; F309-Q313 WeakPolarHBondContact O-CG 3.28Å; F309-Q313 PolarHBondContact O-N 2.87Å; C310-Q313 PolarHBondContact O-N 3.43Å; Q313-E315 VanDerWaalsContact C-N 3.31Å; Q313-E315 PolarHBondContact O-N 3.39Å; Q313-V316 PolarHBondContact O-N 3.07Å; Q313-L317 WeakPolarHBondContact O-CB 3.46Å; Q313-L317 WeakPolarHBondContact O-CD1 3.38Å; Q313-L317 WeakPolarHBondContact O-CG 3.24Å; Q313-L317 PolarHBondContact O-N 3.43Å; Q313-L452 HydrophobicContact CB-CD2 4.19Å
314	I	77.2	Confident	73.2	Confident	28 Å²	28	45.3 Å²	45.3	14%	0.144	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-41.7	177	-66.2	159.4	0	0	0	110.6	C310 K311 Y312 L317 T318 L452 I453 V456	C310-I314 WeakPolarHBondContact O-CD1 3.32Å; C310-I314 VanDerWaalsContact O-CG1 3.28Å; C310-I314 WeakPolarHBondContact O-CG1 3.4Å; C310-I314 PolarHBondContact O-N 3.16Å; K311-I314 PolarHBondContact O-N 3.11Å; Y312-I314 PolarHBondContact O-N 3.47Å; I314-L317 PolarHBondContact O-N 3.17Å; I314-T318 HydrophobicContact CG2-CG2 4.32Å; I314-T318 WeakPolarHBondContact O-CB 3.36Å; I314-T318 WeakPolarHBondContact O-CG2 3.26Å; I314-T318 PolarHBondContact O-N 2.95Å; I314-T318 PolarHBondContact O-OG1 2.87Å; I314-L452 HydrophobicContact CD1-CG 4.21Å; I314-L452 HydrophobicContact CG1-CD2 3.65Å; I314-L452 HydrophobicContact CG1-CG 3.75Å; I314-I453 HydrophobicContact CD1-CG1 3.81Å; I314-I453 HydrophobicContact CG1-CG1 4.19Å; I314-I453 HydrophobicContact CG2-CG1 4.27Å; I314-V456 HydrophobicContact CD1-CG2 3.85Å
315	E	75.3	Confident	73.9	Confident	91 Å²	91	42.9 Å²	42.9	43%	0.425	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-46.9	176.1	-174.6	174.5	-151.7	0	0	111.9	V113 H117 K311 Y312 Q313 L317 T318 S319	V113-E315 HydrophobicContact CG1-CG 4.31Å; V113-E315 VanDerWaalsContact CG1-OE2 3.25Å; V113-E315 WeakPolarHBondContact CG1-OE2 3.41Å; H117-E315 IonicContact CE1-OE2 2.7Å; H117-E315 PolarHBondContact CE1-OE2 3.07Å; H117-E315 IonicContact ND1-OE2 3.69Å; K311-E315 PolarHBondContact O-N 3Å; Y312-E315 PolarHBondContact O-N 3.41Å; Q313-E315 VanDerWaalsContact C-N 3.31Å; Q313-E315 PolarHBondContact O-N 3.39Å; E315-L317 PolarHBondContact O-N 3.04Å; E315-T318 PolarHBondContact O-N 3.07Å; E315-S319 WeakPolarHBondContact O-CB 3.26Å; E315-S319 PolarHBondContact O-N 3.08Å
316	V	77.5	Confident	74.7	Confident	8 Å²	8	34.5 Å²	34.5	5%	0.048	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-47.9	175.7	171.5	0	0	0	0	111.4	R100 M101 Y312 Q313 T318 S319	R100-V316 HydrophobicContact CB-CG1 4.3Å; M101-V316 HydrophobicContact CG-CG1 4.05Å; M101-V316 HydrophobicContact SD-CG1 4.45Å; Y312-V316 HydrophobicContact CD2-CG2 4.23Å; Y312-V316 HydrophobicContact CE1-CG2 3.98Å; Y312-V316 HydrophobicContact CE2-CG2 3.54Å; Y312-V316 WeakPolarHBondContact O-CG2 3.36Å; Y312-V316 PolarHBondContact O-N 3.46Å; Y312-V316 WeakPolarHBondContact OH-CG2 3.44Å; Q313-V316 PolarHBondContact O-N 3.07Å; V316-T318 VanDerWaalsContact C-N 3.35Å; V316-T318 PolarHBondContact O-N 2.69Å; V316-S319 WeakPolarHBondContact O-CB 3.15Å; V316-S319 PolarHBondContact O-N 2.85Å; V316-S319 PolarHBondContact O-OG 3.01Å
317	L	78.6	Confident	75.5	Confident	6 Å²	6	34 Å²	34	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-25.4	-177.7	-68.2	167.8	0	0	0	113.5	M101 Q313 I314 E315 V322 I327 Y445 Y448 L449 L452	M101-L317 HydrophobicContact CE-CD1 3.79Å; M101-L317 HydrophobicContact CE-CD2 4.25Å; M101-L317 HydrophobicContact CE-CG 4.07Å; M101-L317 HydrophobicContact SD-CD1 4.46Å; M101-L317 HydrophobicContact SD-CD2 3.91Å; M101-L317 HydrophobicContact SD-CG 4.1Å; Q313-L317 WeakPolarHBondContact O-CB 3.46Å; Q313-L317 WeakPolarHBondContact O-CD1 3.38Å; Q313-L317 WeakPolarHBondContact O-CG 3.24Å; Q313-L317 PolarHBondContact O-N 3.43Å; I314-L317 PolarHBondContact O-N 3.17Å; E315-L317 PolarHBondContact O-N 3.04Å; L317-V322 HydrophobicContact CD2-CG1 4.25Å; L317-V322 WeakPolarHBondContact O-CG2 3.47Å; L317-I327 HydrophobicContact CD2-CD1 3.89Å; L317-Y445 WeakPolarHBondContact CB-OH 3.35Å; L317-Y445 HydrophobicContact CD2-CE2 4.28Å; L317-Y445 PolarHBondContact O-OH 2.67Å; L317-Y448 HydrophobicContact CD1-CD1 4.46Å; L317-Y448 HydrophobicContact CD1-CE1 3.5Å; L317-Y448 VanDerWaalsContact CD1-CE1 3.5Å; L317-Y448 HydrophobicContact CD2-CE1 4.25Å; L317-L449 HydrophobicContact CB-CD2 3.87Å; L317-L449 HydrophobicContact CD1-CD2 4.19Å; L317-L452 HydrophobicContact CD1-CD2 3.7Å
318	T	78.6	Confident	76.2	Confident	67 Å²	67	32.2 Å²	32.2	41%	0.411	19%	0.194	S	C	.	.	H	α-helix	trans	-98	-3.5	176.7	58.9	0	0	0	0	114	I314 E315 V316 G320	I314-T318 HydrophobicContact CG2-CG2 4.32Å; I314-T318 WeakPolarHBondContact O-CB 3.36Å; I314-T318 WeakPolarHBondContact O-CG2 3.26Å; I314-T318 PolarHBondContact O-N 2.95Å; I314-T318 PolarHBondContact O-OG1 2.87Å; E315-T318 PolarHBondContact O-N 3.07Å; V316-T318 VanDerWaalsContact C-N 3.35Å; V316-T318 PolarHBondContact O-N 2.69Å; T318-G320 PolarHBondContact O-N 3.34Å
319	S	71.6	Confident	76.6	Confident	59 Å²	59	35.5 Å²	35.5	41%	0.413	21%	0.209	S	C	.	.	S	Bend	trans	-62.2	-2.1	179	70.4	0	0	0	0	116.3	E315 V316 S321	E315-S319 WeakPolarHBondContact O-CB 3.26Å; E315-S319 PolarHBondContact O-N 3.08Å; V316-S319 WeakPolarHBondContact O-CB 3.15Å; V316-S319 PolarHBondContact O-N 2.85Å; V316-S319 PolarHBondContact O-OG 3.01Å; S319-S321 PolarHBondContact O-N 3.35Å; S319-S321 VanDerWaalsContact O-N 3.16Å; S319-S321 PolarHBondContact OG-N 2.76Å; S319-S321 PolarHBondContact OG-OG 3.23Å
320	G	63.8	Low	77	Confident	79 Å²	79	35.2 Å²	35.2	81%	0.814	21%	0.208	S	C	*	.	S	Bend	trans	69	4.6	-175.9	0	0	0	0	0	115	T318	T318-G320 PolarHBondContact O-N 3.34Å
321	S	70.5	Confident	77.4	Confident	58 Å²	58	40.3 Å²	40.3	41%	0.406	23%	0.23	S	C	.	.			trans	-135.9	58.5	-175.3	56.9	0	0	0	0	111.3	R100 S319 F323	R100-S321 PolarHBondContact NH1-O 3.47Å; R100-S321 PolarHBondContact NH2-O 3.3Å; S319-S321 PolarHBondContact O-N 3.35Å; S319-S321 VanDerWaalsContact O-N 3.16Å; S319-S321 PolarHBondContact OG-N 2.76Å; S319-S321 PolarHBondContact OG-OG 3.23Å; S321-F323 WeakPolarHBondContact O-CE2 3.25Å
322	V	80.9	Confident	77.8	Confident	22 Å²	22	39.2 Å²	39.2	13%	0.133	23%	0.231	C	C	.	.			trans	-84.2	129.4	-178.5	-173.4	0	0	0	0	110.5	L317 D326 I327 L440	L317-V322 HydrophobicContact CD2-CG1 4.25Å; L317-V322 WeakPolarHBondContact O-CG2 3.47Å; V322-D326 HydrophobicContact CG1-CB 4.32Å; V322-I327 HydrophobicContact CG1-CD1 3.86Å; V322-I327 HydrophobicContact CG1-CG1 4.1Å; V322-L440 HydrophobicContact CB-CD1 4.16Å; V322-L440 HydrophobicContact CB-CD2 4.13Å; V322-L440 HydrophobicContact CG1-CD2 4.13Å; V322-L440 HydrophobicContact CG2-CD2 4.35Å
323	F	83.4	Confident	78.2	Confident	105 Å²	105	39 Å²	39	46%	0.461	23%	0.23	S	C	.	.			trans	-101.9	157.5	177.7	-59.6	-80.9	0	0	0	111.2	S321 A325 D326	S321-F323 WeakPolarHBondContact O-CE2 3.25Å; F323-A325 PolarHBondContact O-N 2.77Å; F323-D326 PolarHBondContact N-OD2 3.45Å; F323-D326 WeakPolarHBondContact O-CB 3.35Å; F323-D326 PolarHBondContact O-N 3.4Å
324	L	82.6	Confident	78.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-33	177.9	-177.1	62.7	0	0	0	112	D326 I327 L328 F337 W428 M431 E432 L436	L324-D326 VanDerWaalsContact C-N 3.32Å; L324-D326 PolarHBondContact O-N 3.32Å; L324-I327 PolarHBondContact O-N 3.07Å; L324-L328 HydrophobicContact CD1-CD1 3.91Å; L324-L328 HydrophobicContact CD1-CD2 4.25Å; L324-L328 HydrophobicContact CD1-CG 3.78Å; L324-L328 HydrophobicContact CD2-CD1 3.91Å; L324-L328 HydrophobicContact CG-CD1 3.64Å; L324-L328 HydrophobicContact CG-CG 3.89Å; L324-L328 PolarHBondContact O-N 3.37Å; L324-F337 HydrophobicContact CD1-CE1 4.23Å; L324-F337 HydrophobicContact CD1-CZ 4.03Å; L324-W428 HydrophobicContact CB-CH2 4.16Å; L324-W428 HydrophobicContact CB-CZ2 3.86Å; L324-W428 HydrophobicContact CD2-CD2 3.7Å; L324-W428 HydrophobicContact CD2-CE3 3.83Å; L324-W428 HydrophobicContact CD2-CG 4.15Å; L324-W428 HydrophobicContact CD2-CH2 4.42Å; L324-W428 HydrophobicContact CD2-CZ2 4.27Å; L324-W428 HydrophobicContact CD2-CZ3 4.21Å; L324-W428 HydrophobicContact CG-CE3 4.42Å; L324-W428 HydrophobicContact CG-CH2 4.24Å; L324-W428 HydrophobicContact CG-CZ2 4.28Å; L324-W428 HydrophobicContact CG-CZ3 4.29Å; L324-M431 HydrophobicContact CD1-CB 4.19Å; L324-M431 HydrophobicContact CD2-CB 3.5Å; L324-M431 HydrophobicContact CD2-CE 4.39Å; L324-E432 HydrophobicContact CB-CB 4.08Å; L324-E432 HydrophobicContact CB-CG 4.09Å; L324-E432 HydrophobicContact CD2-CB 3.97Å; L324-L436 HydrophobicContact CB-CD2 4.09Å
325	A	80.1	Confident	79.4	Confident	14 Å²	14	45 Å²	45	12%	0.116	26%	0.257	C	S	.	.	H	α-helix	trans	-57.1	-43.2	174.2	0	0	0	0	0	112.8	S99 F323 I327 L328 F329 W428	S99-A325 VanDerWaalsContact CB-O 3.24Å; S99-A325 WeakPolarHBondContact CB-O 3.33Å; S99-A325 PolarHBondContact OG-O 2.72Å; F323-A325 PolarHBondContact O-N 2.77Å; A325-I327 PolarHBondContact O-N 3.15Å; A325-L328 PolarHBondContact O-N 2.91Å; A325-F329 HydrophobicContact CB-CD2 4.23Å; A325-F329 HydrophobicContact CB-CE2 4.45Å; A325-F329 WeakPolarHBondContact O-CD2 3.46Å; A325-F329 PolarHBondContact O-N 2.91Å; A325-F329 VanDerWaalsContact O-N 3.16Å; A325-W428 HydrophobicContact CB-CH2 3.83Å; A325-W428 HydrophobicContact CB-CZ2 4.33Å
326	D	79.7	Confident	80.1	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.011	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-37.9	-178.5	-58.4	-50.2	0	0	0	110.9	S99 R100 M101 V322 F323 L324 C330	S99-D326 WeakPolarHBondContact OG-CA 3.43Å; R100-D326 VanDerWaalsContact CB-OD1 3.26Å; R100-D326 WeakPolarHBondContact CB-OD1 3.48Å; R100-D326 WeakPolarHBondContact CG-OD1 3.48Å; R100-D326 IonicContact CZ-OD2 3.19Å; R100-D326 VanDerWaalsContact CZ-OD2 3.31Å; R100-D326 PolarHBondContact N-OD1 3.23Å; R100-D326 IonicContact NE-OD1 2.73Å; R100-D326 PolarHBondContact NE-OD1 2.85Å; R100-D326 IonicContact NE-OD2 3.16Å; R100-D326 PolarHBondContact NE-OD2 3.43Å; R100-D326 VanDerWaalsContact NE-OD2 3.15Å; R100-D326 IonicContact NH2-OD1 2.82Å; R100-D326 IonicContact NH2-OD2 3.14Å; R100-D326 PolarHBondContact NH2-OD2 3.39Å; M101-D326 HydrophobicContact CG-CB 4.35Å; M101-D326 HydrophobicContact SD-CB 3.88Å; V322-D326 HydrophobicContact CG1-CB 4.32Å; F323-D326 PolarHBondContact N-OD2 3.45Å; F323-D326 WeakPolarHBondContact O-CB 3.35Å; F323-D326 PolarHBondContact O-N 3.4Å; L324-D326 VanDerWaalsContact C-N 3.32Å; L324-D326 PolarHBondContact O-N 3.32Å; D326-C330 VanDerWaalsContact O-CB 3.23Å; D326-C330 WeakPolarHBondContact O-CB 3.45Å
327	I	84.8	Confident	80.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-76	-52.4	178.1	-55	-52.8	0	0	0	112	L317 V322 L324 A325 F329 C330 A333 L334 F337 L436 F439	L317-I327 HydrophobicContact CD2-CD1 3.89Å; V322-I327 HydrophobicContact CG1-CD1 3.86Å; V322-I327 HydrophobicContact CG1-CG1 4.1Å; L324-I327 PolarHBondContact O-N 3.07Å; A325-I327 PolarHBondContact O-N 3.15Å; I327-F329 PolarHBondContact O-N 2.75Å; I327-C330 PolarHBondContact O-N 3.49Å; I327-A333 HydrophobicContact CB-CB 4.46Å; I327-A333 HydrophobicContact CD1-CB 4.07Å; I327-A333 HydrophobicContact CG2-CB 4.16Å; I327-L334 PolarHBondContact O-N 2.82Å; I327-F337 HydrophobicContact CG2-CB 3.5Å; I327-F337 VanDerWaalsContact CG2-CB 3.5Å; I327-F337 HydrophobicContact CG2-CD1 4.38Å; I327-F337 HydrophobicContact CG2-CD2 4.04Å; I327-F337 HydrophobicContact CG2-CG 3.73Å; I327-L436 HydrophobicContact CG1-CD1 3.93Å; I327-F439 HydrophobicContact CD1-CE1 4.03Å; I327-F439 HydrophobicContact CG1-CE1 4.28Å; I327-F439 HydrophobicContact CG2-CE1 4.05Å
328	L	82.6	Confident	81.3	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-70.7	-33.6	-170.5	-67.4	-175.1	0	0	0	114.2	L324 A325 L334 F337 L350 W353 W428 M431	L324-L328 HydrophobicContact CD1-CD1 3.91Å; L324-L328 HydrophobicContact CD1-CD2 4.25Å; L324-L328 HydrophobicContact CD1-CG 3.78Å; L324-L328 HydrophobicContact CD2-CD1 3.91Å; L324-L328 HydrophobicContact CG-CD1 3.64Å; L324-L328 HydrophobicContact CG-CG 3.89Å; L324-L328 PolarHBondContact O-N 3.37Å; A325-L328 PolarHBondContact O-N 2.91Å; L328-L334 HydrophobicContact CD2-CD1 3.76Å; L328-F337 HydrophobicContact CD2-CD1 3.65Å; L328-F337 HydrophobicContact CD2-CE1 3.81Å; L328-L350 HydrophobicContact CD2-CD1 3.6Å; L328-W353 HydrophobicContact CB-CZ3 4.39Å; L328-W353 HydrophobicContact CD1-CD2 4.29Å; L328-W353 HydrophobicContact CD1-CE3 3.86Å; L328-W353 HydrophobicContact CD1-CH2 4.17Å; L328-W353 HydrophobicContact CD1-CZ3 3.79Å; L328-W428 HydrophobicContact CD1-CE3 4.23Å; L328-W428 HydrophobicContact CD1-CZ3 3.93Å; L328-M431 HydrophobicContact CD1-CE 4.09Å
329	F	78.8	Confident	81.9	Confident	75 Å²	75	42 Å²	42	33%	0.329	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	2.9	-180	-62.8	-75.3	0	0	0	113.6	S102 A325 I327 W353	S102-F329 VanDerWaalsContact OG-C 3.3Å; S102-F329 WeakPolarHBondContact OG-CB 3.49Å; S102-F329 PolarHBondContact OG-O 2.89Å; A325-F329 HydrophobicContact CB-CD2 4.23Å; A325-F329 HydrophobicContact CB-CE2 4.45Å; A325-F329 WeakPolarHBondContact O-CD2 3.46Å; A325-F329 PolarHBondContact O-N 2.91Å; A325-F329 VanDerWaalsContact O-N 3.16Å; I327-F329 PolarHBondContact O-N 2.75Å; F329-W353 HydrophobicContact CE1-CH2 4.3Å; F329-W353 HydrophobicContact CE2-CH2 4.32Å; F329-W353 AromaticContact CZ-CH2 3.79Å; F329-W353 HydrophobicContact CZ-CH2 3.79Å
330	C	79.6	Confident	83	Confident	12 Å²	12	40 Å²	40	8%	0.081	22%	0.223	C	C	.	.	S	Bend	trans	-102.9	113.3	171.2	-178.8	0	0	0	0	109.5	M101 D326 I327 S332 A333 L334	M101-C330 HydrophobicContact CB-CB 4.24Å; M101-C330 HydrophobicContact CE-CB 3.93Å; M101-C330 WeakPolarHBondContact CE-SG 3.32Å; M101-C330 HydrophobicContact SD-CB 4.19Å; D326-C330 VanDerWaalsContact O-CB 3.23Å; D326-C330 WeakPolarHBondContact O-CB 3.45Å; I327-C330 PolarHBondContact O-N 3.49Å; C330-S332 VanDerWaalsContact C-N 3.26Å; C330-S332 PolarHBondContact O-N 3.18Å; C330-S332 VanDerWaalsContact O-N 3.16Å; C330-S332 PolarHBondContact SG-OG 2.81Å; C330-S332 VanDerWaalsContact SG-OG 3.39Å; C330-A333 HydrophobicContact CB-CB 3.92Å; C330-A333 PolarHBondContact O-N 3.31Å; C330-A333 VanDerWaalsContact O-N 3.1Å; C330-L334 WeakPolarHBondContact O-CB 3.36Å; C330-L334 PolarHBondContact O-N 3.37Å
331	E	77.9	Confident	84.3	Confident	130 Å²	130	36.2 Å²	36.2	61%	0.607	18%	0.184	S	C	*	.	H	α-helix	trans	-45.5	-47.7	-179.9	171.7	177.7	149.1	0	0	113.3	F335 Y533	E331-F335 PolarHBondContact O-N 2.98Å; E331-Y533 VanDerWaalsContact CG-OH 3.23Å; E331-Y533 WeakPolarHBondContact CG-OH 3.33Å; E331-Y533 PolarHBondContact OE2-OH 3.44Å
332	S	80.9	Confident	85.3	Confident	43 Å²	43	39.7 Å²	39.7	30%	0.301	19%	0.194	S	C	.	.	H	α-helix	trans	-69	-46	-178.7	65.2	0	0	0	0	111.7	C330 F335 Y336 Y448	C330-S332 VanDerWaalsContact C-N 3.26Å; C330-S332 PolarHBondContact O-N 3.18Å; C330-S332 VanDerWaalsContact O-N 3.16Å; C330-S332 PolarHBondContact SG-OG 2.81Å; C330-S332 VanDerWaalsContact SG-OG 3.39Å; S332-F335 PolarHBondContact O-N 2.9Å; S332-Y336 VanDerWaalsContact O-CD2 3.25Å; S332-Y336 WeakPolarHBondContact O-CD2 3.27Å; S332-Y448 PolarHBondContact OG-OH 3.09Å; S332-Y448 VanDerWaalsContact OG-OH 3.1Å
333	A	83.9	Confident	85.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-39.3	179.3	0	0	0	0	0	112.5	I327 C330 F335 Y336 F337 Y448	I327-A333 HydrophobicContact CB-CB 4.46Å; I327-A333 HydrophobicContact CD1-CB 4.07Å; I327-A333 HydrophobicContact CG2-CB 4.16Å; C330-A333 HydrophobicContact CB-CB 3.92Å; C330-A333 PolarHBondContact O-N 3.31Å; C330-A333 VanDerWaalsContact O-N 3.1Å; A333-F335 VanDerWaalsContact C-N 3.3Å; A333-F335 PolarHBondContact O-N 3.11Å; A333-Y336 PolarHBondContact O-N 3.16Å; A333-F337 PolarHBondContact O-N 3.38Å; A333-Y448 HydrophobicContact CB-CE1 3.78Å
334	L	87.4	Confident	86.1	Confident	41 Å²	41	44 Å²	44	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-39.2	178.3	176.7	62.2	0	0	0	111.8	I327 L328 C330 F337 S338 L350	I327-L334 PolarHBondContact O-N 2.82Å; L328-L334 HydrophobicContact CD2-CD1 3.76Å; C330-L334 WeakPolarHBondContact O-CB 3.36Å; C330-L334 PolarHBondContact O-N 3.37Å; L334-F337 CarbonylContact O-C 3.59Å; L334-F337 PolarHBondContact O-N 2.68Å; L334-S338 WeakPolarHBondContact O-CB 3.25Å; L334-S338 PolarHBondContact O-N 2.71Å; L334-S338 PolarHBondContact O-OG 3.23Å; L334-L350 HydrophobicContact CD1-CD1 4.15Å; L334-L350 HydrophobicContact CD1-CD2 4.38Å
335	F	89.9	Confident	86.5	Confident	128 Å²	128	50.9 Å²	50.9	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-61.9	-44.7	176.6	176.6	-94.8	0	0	0	112.7	E331 S332 A333 F337 S338 E339	E331-F335 PolarHBondContact O-N 2.98Å; S332-F335 PolarHBondContact O-N 2.9Å; A333-F335 VanDerWaalsContact C-N 3.3Å; A333-F335 PolarHBondContact O-N 3.11Å; F335-F337 VanDerWaalsContact C-N 3.35Å; F335-S338 PolarHBondContact O-N 2.92Å; F335-S338 PolarHBondContact O-OG 3.38Å; F335-E339 PolarHBondContact O-N 2.83Å
336	Y	89.6	Confident	87	Confident	32 Å²	32	50.4 Å²	50.4	13%	0.125	24%	0.241	C	C	.	.	H	α-helix	trans	-70.1	-32.9	175.4	-71.7	-87.4	0	0	0	112	S332 A333 E339 Y340 F439 I444 K447 Y448 D451	S332-Y336 VanDerWaalsContact O-CD2 3.25Å; S332-Y336 WeakPolarHBondContact O-CD2 3.27Å; A333-Y336 PolarHBondContact O-N 3.16Å; Y336-E339 PolarHBondContact O-N 2.95Å; Y336-Y340 PolarHBondContact O-N 3.36Å; Y336-Y340 VanDerWaalsContact O-N 3.12Å; Y336-F439 WeakPolarHBondContact O-CE2 3.48Å; Y336-I444 HydrophobicContact CD1-CG2 3.85Å; Y336-I444 HydrophobicContact CG-CG2 4.45Å; Y336-I444 WeakPolarHBondContact O-CG2 3.35Å; Y336-K447 HydrophobicContact CE1-CD 3.91Å; Y336-K447 HydrophobicContact CE1-CG 4Å; Y336-Y448 AromaticContact CD2-CD2 3.33Å; Y336-Y448 HydrophobicContact CD2-CD2 3.33Å; Y336-Y448 HydrophobicContact CD2-CE2 4.14Å; Y336-Y448 AromaticContact CD2-CG 3.72Å; Y336-Y448 HydrophobicContact CD2-CG 3.72Å; Y336-Y448 AromaticContact CE2-CD2 3.46Å; Y336-Y448 HydrophobicContact CE2-CD2 3.46Å; Y336-Y448 VanDerWaalsContact CE2-CD2 3.46Å; Y336-Y448 HydrophobicContact CE2-CE2 4.3Å; Y336-Y448 HydrophobicContact CE2-CG 4.16Å; Y336-Y448 HydrophobicContact CG-CD2 4.12Å; Y336-Y448 HydrophobicContact CG-CG 4.05Å; Y336-D451 PolarHBondContact OH-OD2 3.05Å
337	F	91	Very high	87.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-69.2	-34.9	173.5	-170.2	-110.9	0	0	0	112.2	L324 I327 L328 A333 L334 F335 Y340 M341 L350 M431 F439	L324-F337 HydrophobicContact CD1-CE1 4.23Å; L324-F337 HydrophobicContact CD1-CZ 4.03Å; I327-F337 HydrophobicContact CG2-CB 3.5Å; I327-F337 VanDerWaalsContact CG2-CB 3.5Å; I327-F337 HydrophobicContact CG2-CD1 4.38Å; I327-F337 HydrophobicContact CG2-CD2 4.04Å; I327-F337 HydrophobicContact CG2-CG 3.73Å; L328-F337 HydrophobicContact CD2-CD1 3.65Å; L328-F337 HydrophobicContact CD2-CE1 3.81Å; A333-F337 PolarHBondContact O-N 3.38Å; L334-F337 CarbonylContact O-C 3.59Å; L334-F337 PolarHBondContact O-N 2.68Å; F335-F337 VanDerWaalsContact C-N 3.35Å; F337-Y340 HydrophobicContact CD2-CD1 4.46Å; F337-Y340 HydrophobicContact CE2-CD1 4.33Å; F337-Y340 WeakPolarHBondContact O-CB 3.39Å; F337-Y340 PolarHBondContact O-N 3.21Å; F337-M341 HydrophobicContact CD1-CG 3.92Å; F337-M341 HydrophobicContact CE1-CG 3.59Å; F337-M341 HydrophobicContact CE1-SD 3.98Å; F337-M341 HydrophobicContact CE2-CG 4.29Å; F337-M341 HydrophobicContact CE2-SD 4.34Å; F337-M341 HydrophobicContact CG-CG 4.4Å; F337-M341 HydrophobicContact CZ-CG 3.8Å; F337-M341 HydrophobicContact CZ-SD 3.7Å; F337-M341 WeakPolarHBondContact O-CB 3.32Å; F337-M341 VanDerWaalsContact O-CG 3.26Å; F337-M341 WeakPolarHBondContact O-CG 3.44Å; F337-M341 PolarHBondContact O-N 3.32Å; F337-L350 HydrophobicContact CD1-CD1 4.33Å; F337-L350 HydrophobicContact CD1-CD2 4.19Å; F337-L350 HydrophobicContact CE1-CD1 4.3Å; F337-M431 HydrophobicContact CE1-SD 4.16Å; F337-F439 HydrophobicContact CB-CE1 4.46Å; F337-F439 HydrophobicContact CB-CE2 4.37Å; F337-F439 HydrophobicContact CB-CZ 4.2Å; F337-F439 HydrophobicContact CD2-CB 4.03Å; F337-F439 AromaticContact CD2-CD1 3.77Å; F337-F439 HydrophobicContact CD2-CD1 3.77Å; F337-F439 HydrophobicContact CD2-CD2 4.02Å; F337-F439 HydrophobicContact CD2-CE1 4.16Å; F337-F439 HydrophobicContact CD2-CE2 4.4Å; F337-F439 AromaticContact CD2-CG 3.66Å; F337-F439 HydrophobicContact CD2-CG 3.66Å; F337-F439 HydrophobicContact CD2-CZ 4.45Å; F337-F439 HydrophobicContact CE2-CB 4.06Å; F337-F439 HydrophobicContact CE2-CD1 4.4Å; F337-F439 HydrophobicContact CE2-CG 4.2Å
338	S	90.3	Very high	87.7	Confident	32 Å²	32	54.5 Å²	54.5	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-69.4	-39.3	173	65.9	0	0	0	0	111.8	L334 F335 Y340 M341 E342 M347	L334-S338 WeakPolarHBondContact O-CB 3.25Å; L334-S338 PolarHBondContact O-N 2.71Å; L334-S338 PolarHBondContact O-OG 3.23Å; F335-S338 PolarHBondContact O-N 2.92Å; F335-S338 PolarHBondContact O-OG 3.38Å; S338-Y340 PolarHBondContact O-N 3.41Å; S338-M341 PolarHBondContact O-N 2.98Å; S338-E342 WeakPolarHBondContact O-CB 3.11Å; S338-E342 PolarHBondContact O-N 3.24Å; S338-M347 VanDerWaalsContact O-CE 3.25Å; S338-M347 WeakPolarHBondContact O-CE 3.18Å
339	E	91.5	Very high	88.1	Confident	44 Å²	44	55 Å²	55	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-28.3	171.6	-159.4	-156.5	124.9	0	0	111.9	F335 Y336 K343 I444 K447	F335-E339 PolarHBondContact O-N 2.83Å; Y336-E339 PolarHBondContact O-N 2.95Å; E339-K343 WeakPolarHBondContact O-CD 3.37Å; E339-K343 WeakPolarHBondContact O-CE 3.37Å; E339-K343 WeakPolarHBondContact O-CG 3.46Å; E339-K343 IonicContact OE1-NZ 2.99Å; E339-K343 PolarHBondContact OE1-NZ 3.12Å; E339-I444 HydrophobicContact CB-CG2 4.27Å; E339-K447 IonicContact OE2-NZ 3.31Å; E339-K447 PolarHBondContact OE2-NZ 3.37Å; E339-K447 VanDerWaalsContact OE2-NZ 3.16Å
340	Y	93.4	Very high	88.7	Confident	17 Å²	17	51.5 Å²	51.5	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-80.1	-51.1	174.2	179.1	-109.1	0	0	0	112.4	Y336 F337 S338 E342 K343 E344 Y435 G438 F439 I444	Y336-Y340 PolarHBondContact O-N 3.36Å; Y336-Y340 VanDerWaalsContact O-N 3.12Å; F337-Y340 HydrophobicContact CD2-CD1 4.46Å; F337-Y340 HydrophobicContact CE2-CD1 4.33Å; F337-Y340 WeakPolarHBondContact O-CB 3.39Å; F337-Y340 PolarHBondContact O-N 3.21Å; S338-Y340 PolarHBondContact O-N 3.41Å; Y340-E342 PolarHBondContact O-N 3.29Å; Y340-K343 PolarHBondContact O-N 3.47Å; Y340-E344 HydrophobicContact CD1-CG 4.4Å; Y340-E344 HydrophobicContact CD2-CG 4.23Å; Y340-E344 HydrophobicContact CE1-CG 3.87Å; Y340-E344 HydrophobicContact CE2-CG 3.65Å; Y340-E344 WeakPolarHBondContact CE2-OE1 3.37Å; Y340-E344 VanDerWaalsContact CZ-CG 3.43Å; Y340-E344 PolarHBondContact O-N 3.49Å; Y340-E344 VanDerWaalsContact O-N 3.13Å; Y340-E344 VanDerWaalsContact OH-CD 3.25Å; Y340-E344 WeakPolarHBondContact OH-CG 3.38Å; Y340-E344 PolarHBondContact OH-OE1 3.23Å; Y340-Y435 HydrophobicContact CE1-CD1 4.43Å; Y340-Y435 VanDerWaalsContact CE1-O 3.28Å; Y340-Y435 WeakPolarHBondContact CE1-O 3.39Å; Y340-G438 WeakPolarHBondContact OH-CA 3.24Å; Y340-F439 HydrophobicContact CD1-CB 3.59Å; Y340-F439 HydrophobicContact CD1-CD2 4Å; Y340-F439 HydrophobicContact CD1-CG 4.21Å; Y340-F439 HydrophobicContact CD2-CD2 4.47Å; Y340-F439 HydrophobicContact CE1-CB 3.75Å; Y340-F439 HydrophobicContact CG-CB 4.12Å; Y340-F439 AromaticContact CG-CD2 3.77Å; Y340-F439 HydrophobicContact CG-CD2 3.77Å; Y340-F439 HydrophobicContact CG-CG 4.41Å; Y340-I444 HydrophobicContact CD2-CD1 4.07Å
341	M	91.3	Very high	89.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-24.7	179.3	-68.4	-70.5	-75.8	0	0	113	F337 S338 A346 M347 I349 L350 M431 Y435	F337-M341 HydrophobicContact CD1-CG 3.92Å; F337-M341 HydrophobicContact CE1-CG 3.59Å; F337-M341 HydrophobicContact CE1-SD 3.98Å; F337-M341 HydrophobicContact CE2-CG 4.29Å; F337-M341 HydrophobicContact CE2-SD 4.34Å; F337-M341 HydrophobicContact CG-CG 4.4Å; F337-M341 HydrophobicContact CZ-CG 3.8Å; F337-M341 HydrophobicContact CZ-SD 3.7Å; F337-M341 WeakPolarHBondContact O-CB 3.32Å; F337-M341 VanDerWaalsContact O-CG 3.26Å; F337-M341 WeakPolarHBondContact O-CG 3.44Å; F337-M341 PolarHBondContact O-N 3.32Å; S338-M341 PolarHBondContact O-N 2.98Å; M341-A346 HydrophobicContact CE-CB 3.6Å; M341-A346 WeakPolarHBondContact CE-O 3.32Å; M341-A346 CarbonylContact O-C 3.5Å; M341-A346 PolarHBondContact O-N 3.42Å; M341-A346 HydrophobicContact SD-CB 3.96Å; M341-M347 PolarHBondContact O-N 3.28Å; M341-I349 HydrophobicContact CE-CB 4.28Å; M341-L350 HydrophobicContact CB-CD2 4.31Å; M341-L350 HydrophobicContact CE-CB 4.17Å; M341-L350 HydrophobicContact CG-CD2 4.23Å; M341-M431 HydrophobicContact CE-CG 3.89Å; M341-M431 HydrophobicContact CE-SD 4.11Å; M341-Y435 HydrophobicContact CE-CD2 4.11Å; M341-Y435 HydrophobicContact CE-CG 4.3Å; M341-Y435 HydrophobicContact SD-CD1 4.03Å; M341-Y435 HydrophobicContact SD-CD2 4.06Å; M341-Y435 HydrophobicContact SD-CG 3.64Å
342	E	92.1	Very high	90	Very high	131 Å²	131	48.3 Å²	48.3	61%	0.612	23%	0.233	S	C	*	.	H	α-helix	trans	-68.2	-41.1	171	-169.3	168.2	-150.8	0	0	112.4	S338 Y340 E345 M347	S338-E342 WeakPolarHBondContact O-CB 3.11Å; S338-E342 PolarHBondContact O-N 3.24Å; Y340-E342 PolarHBondContact O-N 3.29Å; E342-E345 PolarHBondContact O-N 3.46Å; E342-M347 HydrophobicContact CB-CE 3.74Å; E342-M347 HydrophobicContact CG-CE 4.43Å
343	K	91.3	Very high	90.6	Very high	124 Å²	124	46.9 Å²	46.9	54%	0.539	22%	0.221	S	C	.	.	H	α-helix	trans	-77.8	-25.3	-177.5	-67.2	168.4	-166.9	169.5	0	113.8	E339 Y340 I444	E339-K343 WeakPolarHBondContact O-CD 3.37Å; E339-K343 WeakPolarHBondContact O-CE 3.37Å; E339-K343 WeakPolarHBondContact O-CG 3.46Å; E339-K343 IonicContact OE1-NZ 2.99Å; E339-K343 PolarHBondContact OE1-NZ 3.12Å; Y340-K343 PolarHBondContact O-N 3.47Å; K343-I444 HydrophobicContact CD-CD1 3.86Å; K343-I444 VanDerWaalsContact NZ-CD1 3.3Å
344	E	90.4	Very high	90.8	Very high	92 Å²	92	50 Å²	50	43%	0.43	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	11.7	171.7	-57.3	-74.1	177.3	0	0	111.9	Y340 A346 Y435	Y340-E344 HydrophobicContact CD1-CG 4.4Å; Y340-E344 HydrophobicContact CD2-CG 4.23Å; Y340-E344 HydrophobicContact CE1-CG 3.87Å; Y340-E344 HydrophobicContact CE2-CG 3.65Å; Y340-E344 WeakPolarHBondContact CE2-OE1 3.37Å; Y340-E344 VanDerWaalsContact CZ-CG 3.43Å; Y340-E344 PolarHBondContact O-N 3.49Å; Y340-E344 VanDerWaalsContact O-N 3.13Å; Y340-E344 VanDerWaalsContact OH-CD 3.25Å; Y340-E344 WeakPolarHBondContact OH-CG 3.38Å; Y340-E344 PolarHBondContact OH-OE1 3.23Å; E344-A346 HydrophobicContact CB-CB 4.34Å; E344-A346 PolarHBondContact O-N 2.91Å; E344-Y435 HydrophobicContact CB-CD1 4.11Å; E344-Y435 HydrophobicContact CB-CE1 3.85Å; E344-Y435 HydrophobicContact CG-CD1 4.33Å; E344-Y435 HydrophobicContact CG-CE1 4.48Å
345	E	89.9	Confident	91	Very high	145 Å²	145	49.7 Å²	49.7	68%	0.678	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	9.5	-176.6	-57.8	-173.8	160.1	0	0	115.1	E342	E342-E345 PolarHBondContact O-N 3.46Å
346	A	89.8	Confident	91	Very high	5 Å²	5	43.6 Å²	43.6	4%	0.041	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.2	-171	0	0	0	0	0	114.7	M341 E344 N348 I349 Y435	M341-A346 HydrophobicContact CE-CB 3.6Å; M341-A346 WeakPolarHBondContact CE-O 3.32Å; M341-A346 CarbonylContact O-C 3.5Å; M341-A346 PolarHBondContact O-N 3.42Å; M341-A346 HydrophobicContact SD-CB 3.96Å; E344-A346 HydrophobicContact CB-CB 4.34Å; E344-A346 PolarHBondContact O-N 2.91Å; A346-N348 PolarHBondContact O-N 3.48Å; A346-I349 HydrophobicContact CB-CD1 4.44Å; A346-I349 WeakPolarHBondContact O-CB 3.28Å; A346-I349 PolarHBondContact O-N 3.3Å; A346-Y435 HydrophobicContact CB-CD1 4.15Å; A346-Y435 HydrophobicContact CB-CD2 4.45Å; A346-Y435 HydrophobicContact CB-CE1 3.54Å; A346-Y435 HydrophobicContact CB-CE2 3.87Å; A346-Y435 WeakPolarHBondContact CB-OH 3.32Å
347	M	91.8	Very high	90.9	Very high	40 Å²	40	44 Å²	44	20%	0.197	22%	0.218	C	C	.	.	H	α-helix	trans	-45.2	-35.2	-177.7	178.4	60.3	68.2	0	0	113.9	S338 M341 E342 I349 L350 Q351	S338-M347 VanDerWaalsContact O-CE 3.25Å; S338-M347 WeakPolarHBondContact O-CE 3.18Å; M341-M347 PolarHBondContact O-N 3.28Å; E342-M347 HydrophobicContact CB-CE 3.74Å; E342-M347 HydrophobicContact CG-CE 4.43Å; M347-I349 VanDerWaalsContact C-N 3.27Å; M347-I349 PolarHBondContact O-N 3.1Å; M347-L350 PolarHBondContact O-N 2.93Å; M347-L350 HydrophobicContact SD-CD2 4.46Å; M347-Q351 HydrophobicContact CG-CG 4.11Å; M347-Q351 WeakPolarHBondContact O-CG 3.4Å; M347-Q351 PolarHBondContact O-N 3.24Å; M347-Q351 HydrophobicContact SD-CG 4.03Å
348	N	89.5	Confident	90.8	Very high	47 Å²	47	47.9 Å²	47.9	25%	0.251	24%	0.239	S	C	.	.	H	α-helix	trans	-57	-37.8	177.7	-60.2	-45.4	0	0	0	112.7	A346 F352 N393 L395	A346-N348 PolarHBondContact O-N 3.48Å; N348-F352 WeakPolarHBondContact O-CB 3.42Å; N348-F352 PolarHBondContact O-N 2.95Å; N348-N393 HydrophobicContact CB-CB 4.38Å; N348-N393 PolarHBondContact OD1-ND2 3.4Å; N348-L395 HydrophobicContact CB-CD2 3.48Å; N348-L395 VanDerWaalsContact CB-CD2 3.48Å
349	I	89.8	Confident	90.8	Very high	16 Å²	16	46.9 Å²	46.9	8%	0.082	23%	0.231	C	C	.	.	H	α-helix	trans	-66.9	-43.9	179.4	-57.7	171.7	0	0	0	110.1	M341 A346 M347 W353 L395 A427 T430 M431 Y435	M341-I349 HydrophobicContact CE-CB 4.28Å; A346-I349 HydrophobicContact CB-CD1 4.44Å; A346-I349 WeakPolarHBondContact O-CB 3.28Å; A346-I349 PolarHBondContact O-N 3.3Å; M347-I349 VanDerWaalsContact C-N 3.27Å; M347-I349 PolarHBondContact O-N 3.1Å; I349-W353 WeakPolarHBondContact O-CB 3.37Å; I349-W353 PolarHBondContact O-N 3.48Å; I349-L395 HydrophobicContact CG1-CD2 3.91Å; I349-A427 HydrophobicContact CG2-CB 3.87Å; I349-T430 HydrophobicContact CD1-CG2 4.26Å; I349-M431 HydrophobicContact CG2-CG 3.89Å; I349-M431 HydrophobicContact CG2-SD 4.27Å; I349-Y435 HydrophobicContact CD1-CE2 3.86Å
350	L	91.3	Very high	90.6	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-45.1	177.8	179.8	60.2	0	0	0	111.4	L328 L334 F337 M341 M347 W353 L354 M431	L328-L350 HydrophobicContact CD2-CD1 3.6Å; L334-L350 HydrophobicContact CD1-CD1 4.15Å; L334-L350 HydrophobicContact CD1-CD2 4.38Å; F337-L350 HydrophobicContact CD1-CD1 4.33Å; F337-L350 HydrophobicContact CD1-CD2 4.19Å; F337-L350 HydrophobicContact CE1-CD1 4.3Å; M341-L350 HydrophobicContact CB-CD2 4.31Å; M341-L350 HydrophobicContact CE-CB 4.17Å; M341-L350 HydrophobicContact CG-CD2 4.23Å; M347-L350 PolarHBondContact O-N 2.93Å; M347-L350 HydrophobicContact SD-CD2 4.46Å; L350-W353 PolarHBondContact O-N 3.48Å; L350-L354 HydrophobicContact CD1-CD1 3.93Å; L350-L354 HydrophobicContact CD1-CG 4.15Å; L350-L354 HydrophobicContact CG-CD1 3.97Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 3.34Å; L350-M431 HydrophobicContact CB-SD 4.27Å; L350-M431 HydrophobicContact CD1-SD 4Å
351	Q	92.1	Very high	90.3	Very high	74 Å²	74	50.1 Å²	50.1	35%	0.346	25%	0.249	S	C	.	.	H	α-helix	trans	-62.6	-41.4	176.7	-71.7	-174.6	10.5	0	0	112.4	M347 A355 Y386	M347-Q351 HydrophobicContact CG-CG 4.11Å; M347-Q351 WeakPolarHBondContact O-CG 3.4Å; M347-Q351 PolarHBondContact O-N 3.24Å; M347-Q351 HydrophobicContact SD-CG 4.03Å; Q351-A355 VanDerWaalsContact O-CB 3.23Å; Q351-A355 WeakPolarHBondContact O-CB 3.48Å; Q351-A355 PolarHBondContact O-N 3.08Å; Q351-A355 VanDerWaalsContact O-N 3.11Å; Q351-Y386 WeakPolarHBondContact CB-OH 3.2Å
352	F	93.5	Very high	90	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-50.1	173.8	162.6	-107.7	0	0	0	111.1	N348 L354 A355 A356 Y386 F387 L395 F397 F420 P423 L424 A427	N348-F352 WeakPolarHBondContact O-CB 3.42Å; N348-F352 PolarHBondContact O-N 2.95Å; F352-L354 PolarHBondContact O-N 2.93Å; F352-A355 PolarHBondContact O-N 2.85Å; F352-A356 HydrophobicContact CD2-CB 4.13Å; F352-A356 HydrophobicContact CE2-CB 3.53Å; F352-A356 HydrophobicContact CZ-CB 3.84Å; F352-A356 WeakPolarHBondContact O-CB 3.48Å; F352-A356 PolarHBondContact O-N 3.11Å; F352-Y386 HydrophobicContact CB-CD1 4.05Å; F352-Y386 HydrophobicContact CB-CD2 3.94Å; F352-Y386 HydrophobicContact CB-CE1 3.92Å; F352-Y386 HydrophobicContact CB-CE2 3.79Å; F352-Y386 HydrophobicContact CB-CG 4.05Å; F352-Y386 AromaticContact CD2-CD2 3.69Å; F352-Y386 HydrophobicContact CD2-CD2 3.69Å; F352-Y386 HydrophobicContact CD2-CE2 4.05Å; F352-Y386 HydrophobicContact CD2-CG 4.21Å; F352-Y386 HydrophobicContact CG-CD2 4.22Å; F352-Y386 HydrophobicContact CG-CE2 4.42Å; F352-Y386 HydrophobicContact CG-CG 4.42Å; F352-Y386 PolarHBondContact N-OH 3.32Å; F352-F387 AromaticContact CD2-CE2 3.94Å; F352-F387 HydrophobicContact CD2-CE2 3.94Å; F352-F387 HydrophobicContact CD2-CZ 4.2Å; F352-F387 HydrophobicContact CE1-CZ 4.36Å; F352-F387 AromaticContact CE2-CE2 3.5Å; F352-F387 HydrophobicContact CE2-CE2 3.5Å; F352-F387 AromaticContact CE2-CZ 3.54Å; F352-F387 HydrophobicContact CE2-CZ 3.54Å; F352-F387 HydrophobicContact CZ-CE2 4.12Å; F352-F387 AromaticContact CZ-CZ 3.66Å; F352-F387 HydrophobicContact CZ-CZ 3.66Å; F352-L395 HydrophobicContact CB-CD1 3.44Å; F352-L395 VanDerWaalsContact CB-CD1 3.44Å; F352-L395 HydrophobicContact CD1-CD1 3.78Å; F352-L395 HydrophobicContact CG-CD1 3.63Å; F352-F397 HydrophobicContact CD1-CZ 4.35Å; F352-F397 HydrophobicContact CE1-CE2 4.45Å; F352-F397 HydrophobicContact CE1-CZ 4.01Å; F352-F420 HydrophobicContact CE2-CD1 4.41Å; F352-P423 HydrophobicContact CE1-CB 4.05Å; F352-P423 HydrophobicContact CZ-CB 3.8Å; F352-P423 HydrophobicContact CZ-CG 3.98Å; F352-L424 HydrophobicContact CZ-CG 4.36Å; F352-A427 HydrophobicContact CD1-CB 3.96Å; F352-A427 HydrophobicContact CE1-CB 3.98Å
353	W	92.8	Very high	89.8	Confident	14 Å²	14	48.3 Å²	48.3	5%	0.053	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-47.1	-176	-173.9	89.7	0	0	0	111.8	L328 F329 I349 L350 A355 D357 L424 A427 W428 M431	L328-W353 HydrophobicContact CB-CZ3 4.39Å; L328-W353 HydrophobicContact CD1-CD2 4.29Å; L328-W353 HydrophobicContact CD1-CE3 3.86Å; L328-W353 HydrophobicContact CD1-CH2 4.17Å; L328-W353 HydrophobicContact CD1-CZ3 3.79Å; F329-W353 HydrophobicContact CE1-CH2 4.3Å; F329-W353 HydrophobicContact CE2-CH2 4.32Å; F329-W353 AromaticContact CZ-CH2 3.79Å; F329-W353 HydrophobicContact CZ-CH2 3.79Å; I349-W353 WeakPolarHBondContact O-CB 3.37Å; I349-W353 PolarHBondContact O-N 3.48Å; L350-W353 PolarHBondContact O-N 3.48Å; W353-A355 PolarHBondContact O-N 3.33Å; W353-D357 HydrophobicContact CH2-CB 4.4Å; W353-D357 HydrophobicContact CZ2-CB 4.44Å; W353-D357 VanDerWaalsContact O-CB 3.28Å; W353-D357 WeakPolarHBondContact O-CB 3.19Å; W353-D357 PolarHBondContact O-N 3.39Å; W353-L424 HydrophobicContact CB-CD2 4.37Å; W353-L424 VanDerWaalsContact CD1-CD2 3.41Å; W353-L424 HydrophobicContact CD2-CD2 4.47Å; W353-L424 HydrophobicContact CG-CD2 3.89Å; W353-L424 WeakPolarHBondContact O-CD2 3.34Å; W353-A427 HydrophobicContact CB-CB 4.46Å; W353-W428 AromaticContact CE2-CE3 3.67Å; W353-W428 HydrophobicContact CH2-CE3 4.34Å; W353-W428 HydrophobicContact CH2-CZ3 4Å; W353-W428 AromaticContact CZ2-CE3 3.51Å; W353-W428 HydrophobicContact CZ2-CE3 3.51Å; W353-W428 AromaticContact CZ2-CZ3 3.56Å; W353-W428 HydrophobicContact CZ2-CZ3 3.56Å; W353-W428 AromaticContact NE1-CE3 3.74Å; W353-M431 HydrophobicContact CB-CE 3.57Å; W353-M431 HydrophobicContact CD2-CE 3.98Å; W353-M431 HydrophobicContact CG-CE 3.47Å; W353-M431 VanDerWaalsContact CG-CE 3.47Å
354	L	89.4	Confident	89.5	Confident	66 Å²	66	44.9 Å²	44.9	35%	0.346	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-41.4	176.7	-70.5	168.9	0	0	0	112.5	L350 F352 N358	L350-L354 HydrophobicContact CD1-CD1 3.93Å; L350-L354 HydrophobicContact CD1-CG 4.15Å; L350-L354 HydrophobicContact CG-CD1 3.97Å; L350-L354 WeakPolarHBondContact O-CB 3.49Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 3.34Å; F352-L354 PolarHBondContact O-N 2.93Å; L354-N358 WeakPolarHBondContact O-CB 3.23Å; L354-N358 PolarHBondContact O-N 3.41Å; L354-N358 VanDerWaalsContact O-N 3.13Å
355	A	90.7	Very high	89.2	Confident	34 Å²	34	44.2 Å²	44.2	28%	0.281	25%	0.246	S	C	.	.	H	α-helix	trans	-73	-38.7	-178.2	0	0	0	0	0	112.5	Q351 F352 W353 F359 L382	Q351-A355 VanDerWaalsContact O-CB 3.23Å; Q351-A355 WeakPolarHBondContact O-CB 3.48Å; Q351-A355 PolarHBondContact O-N 3.08Å; Q351-A355 VanDerWaalsContact O-N 3.11Å; F352-A355 PolarHBondContact O-N 2.85Å; W353-A355 PolarHBondContact O-N 3.33Å; A355-F359 PolarHBondContact O-N 3.05Å; A355-L382 HydrophobicContact CB-CD2 3.7Å
356	A	89.8	Confident	88.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-74.6	-38.4	177.8	0	0	0	0	0	112.5	F352 F359 Q360 L382 F420 L424	F352-A356 HydrophobicContact CD2-CB 4.13Å; F352-A356 HydrophobicContact CE2-CB 3.53Å; F352-A356 HydrophobicContact CZ-CB 3.84Å; F352-A356 WeakPolarHBondContact O-CB 3.48Å; F352-A356 PolarHBondContact O-N 3.11Å; A356-F359 WeakPolarHBondContact O-CB 3.34Å; A356-F359 PolarHBondContact O-N 3.16Å; A356-Q360 WeakPolarHBondContact O-CG 3.5Å; A356-Q360 PolarHBondContact O-N 3.45Å; A356-L382 HydrophobicContact CB-CD1 4.23Å; A356-F420 HydrophobicContact CB-CB 4.09Å; A356-F420 HydrophobicContact CB-CG 4.3Å; A356-L424 HydrophobicContact CB-CD1 4Å; A356-L424 HydrophobicContact CB-CD2 3.77Å; A356-L424 HydrophobicContact CB-CG 3.89Å
357	D	87.5	Confident	88.3	Confident	40 Å²	40	49.4 Å²	49.4	21%	0.214	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-44.1	171.8	175.8	87.5	0	0	0	111.2	W353 F359 Q360 N361 L424	W353-D357 HydrophobicContact CH2-CB 4.4Å; W353-D357 HydrophobicContact CZ2-CB 4.44Å; W353-D357 VanDerWaalsContact O-CB 3.28Å; W353-D357 WeakPolarHBondContact O-CB 3.19Å; W353-D357 PolarHBondContact O-N 3.39Å; D357-F359 VanDerWaalsContact C-N 3.33Å; D357-F359 PolarHBondContact O-N 3.39Å; D357-Q360 PolarHBondContact O-N 3.05Å; D357-N361 VanDerWaalsContact CG-ND2 3.34Å; D357-N361 WeakPolarHBondContact O-CB 3.46Å; D357-N361 PolarHBondContact O-N 2.71Å; D357-N361 PolarHBondContact O-ND2 3.05Å; D357-N361 PolarHBondContact OD1-ND2 3.36Å; D357-N361 PolarHBondContact OD2-ND2 3.09Å; D357-L424 HydrophobicContact CB-CD2 4.42Å
358	N	89.3	Confident	87.5	Confident	81 Å²	81	50.4 Å²	50.4	43%	0.433	29%	0.286	S	S	.	.	H	α-helix	trans	-58.1	-43.1	173.2	-176.2	22.6	0	0	0	111.8	L354 N361 Q362	L354-N358 WeakPolarHBondContact O-CB 3.23Å; L354-N358 PolarHBondContact O-N 3.41Å; L354-N358 VanDerWaalsContact O-N 3.13Å; N358-N361 PolarHBondContact O-N 3.31Å; N358-Q362 VanDerWaalsContact CG-NE2 3.33Å; N358-Q362 PolarHBondContact ND2-NE2 3.5Å; N358-Q362 WeakPolarHBondContact O-CB 3.49Å; N358-Q362 VanDerWaalsContact O-CG 3.32Å; N358-Q362 WeakPolarHBondContact O-CG 3.28Å; N358-Q362 PolarHBondContact O-N 3.25Å; N358-Q362 PolarHBondContact OD1-NE2 2.77Å
359	F	89.1	Confident	86.9	Confident	12 Å²	12	56.8 Å²	56.8	5%	0.053	31%	0.314	C	S	.	.	H	α-helix	trans	-60	-48.9	173.4	175.2	-87.2	0	0	0	112.2	A355 A356 D357 N361 Q362 L363 A375 D378 A379 L382 P415 C419 F420	A355-F359 PolarHBondContact O-N 3.05Å; A356-F359 WeakPolarHBondContact O-CB 3.34Å; A356-F359 PolarHBondContact O-N 3.16Å; D357-F359 VanDerWaalsContact C-N 3.33Å; D357-F359 PolarHBondContact O-N 3.39Å; F359-N361 VanDerWaalsContact C-N 3.31Å; F359-N361 PolarHBondContact O-N 3.44Å; F359-Q362 PolarHBondContact O-N 2.73Å; F359-L363 HydrophobicContact CD1-CD1 4.25Å; F359-L363 HydrophobicContact CD2-CD1 3.85Å; F359-L363 HydrophobicContact CE1-CD1 4.03Å; F359-L363 HydrophobicContact CE1-CD2 3.68Å; F359-L363 HydrophobicContact CE1-CG 4.47Å; F359-L363 HydrophobicContact CE2-CD1 3.6Å; F359-L363 HydrophobicContact CE2-CD2 4.31Å; F359-L363 HydrophobicContact CG-CD1 4.17Å; F359-L363 HydrophobicContact CZ-CD1 3.7Å; F359-L363 HydrophobicContact CZ-CD2 3.55Å; F359-L363 HydrophobicContact CZ-CG 4.29Å; F359-L363 WeakPolarHBondContact O-CD1 3.49Å; F359-L363 PolarHBondContact O-N 2.77Å; F359-L363 VanDerWaalsContact O-N 3.07Å; F359-A375 WeakPolarHBondContact CE2-O 3.27Å; F359-D378 HydrophobicContact CD2-CB 4.04Å; F359-D378 HydrophobicContact CE2-CB 3.88Å; F359-A379 HydrophobicContact CE2-CB 4.05Å; F359-A379 HydrophobicContact CZ-CB 3.88Å; F359-L382 HydrophobicContact CB-CD1 4.21Å; F359-L382 HydrophobicContact CG-CD1 4.42Å; F359-P415 HydrophobicContact CZ-CB 4.33Å; F359-P415 HydrophobicContact CZ-CG 4.02Å; F359-C419 HydrophobicContact CE1-CB 4.4Å; F359-F420 AromaticContact CD1-CD2 3.74Å; F359-F420 HydrophobicContact CD1-CD2 3.74Å; F359-F420 AromaticContact CD1-CE2 3.87Å; F359-F420 HydrophobicContact CD1-CE2 3.87Å; F359-F420 AromaticContact CE1-CD2 3.91Å; F359-F420 HydrophobicContact CE1-CD2 3.91Å; F359-F420 AromaticContact CE1-CE2 3.8Å; F359-F420 HydrophobicContact CE1-CE2 3.8Å; F359-F420 HydrophobicContact CG-CD2 4.49Å; F359-F420 HydrophobicContact CG-CE2 4.38Å; F359-F420 HydrophobicContact CZ-CE2 4.26Å
360	Q	88.8	Confident	86.6	Confident	39 Å²	39	58.1 Å²	58.1	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-56.9	-46.9	177.4	-52.4	-149.9	-68.8	0	0	110.9	A356 D357 Q362 A364 P417 T421 L424	A356-Q360 WeakPolarHBondContact O-CG 3.5Å; A356-Q360 PolarHBondContact O-N 3.45Å; D357-Q360 PolarHBondContact O-N 3.05Å; Q360-Q362 PolarHBondContact O-N 3.14Å; Q360-A364 WeakPolarHBondContact O-CB 3.34Å; Q360-A364 PolarHBondContact O-N 3.19Å; Q360-P417 WeakPolarHBondContact CB-O 3.47Å; Q360-P417 VanDerWaalsContact CD-O 3.31Å; Q360-P417 WeakPolarHBondContact CG-O 3.44Å; Q360-P417 PolarHBondContact NE2-O 2.66Å; Q360-T421 PolarHBondContact NE2-OG1 3.23Å; Q360-L424 HydrophobicContact CG-CD1 3.68Å
361	N	86.1	Confident	86.3	Confident	90 Å²	90	62.7 Å²	62.7	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-38.5	-179.2	-79.1	-55.3	0	0	0	112.6	D357 N358 F359 A365	D357-N361 VanDerWaalsContact CG-ND2 3.34Å; D357-N361 WeakPolarHBondContact O-CB 3.46Å; D357-N361 PolarHBondContact O-N 2.71Å; D357-N361 PolarHBondContact O-ND2 3.05Å; D357-N361 PolarHBondContact OD1-ND2 3.36Å; D357-N361 PolarHBondContact OD2-ND2 3.09Å; N358-N361 PolarHBondContact O-N 3.31Å; F359-N361 VanDerWaalsContact C-N 3.31Å; F359-N361 PolarHBondContact O-N 3.44Å; N361-A365 VanDerWaalsContact O-CB 3.23Å; N361-A365 WeakPolarHBondContact O-CB 3.49Å; N361-A365 PolarHBondContact O-N 3.39Å
362	Q	85.7	Confident	86	Confident	87 Å²	87	60 Å²	60	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-67.8	-46.5	176.7	-75	-177.6	47.3	0	0	112.8	N358 F359 Q360 A364 A365 K366	N358-Q362 VanDerWaalsContact CG-NE2 3.33Å; N358-Q362 PolarHBondContact ND2-NE2 3.5Å; N358-Q362 WeakPolarHBondContact O-CB 3.49Å; N358-Q362 VanDerWaalsContact O-CG 3.32Å; N358-Q362 WeakPolarHBondContact O-CG 3.28Å; N358-Q362 PolarHBondContact O-N 3.25Å; N358-Q362 PolarHBondContact OD1-NE2 2.77Å; F359-Q362 PolarHBondContact O-N 2.73Å; Q360-Q362 PolarHBondContact O-N 3.14Å; Q362-A364 VanDerWaalsContact C-N 3.34Å; Q362-A364 PolarHBondContact O-N 3.4Å; Q362-A365 PolarHBondContact O-N 3.49Å; Q362-K366 WeakPolarHBondContact O-CG 3.46Å; Q362-K366 PolarHBondContact O-N 3.46Å
363	L	86.6	Confident	85.7	Confident	5 Å²	5	64.6 Å²	64.6	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-64.6	-40	176.7	-87.3	68.3	0	0	0	111.3	F359 K366 K367 Y370 A375 P417	F359-L363 HydrophobicContact CD1-CD1 4.25Å; F359-L363 HydrophobicContact CD2-CD1 3.85Å; F359-L363 HydrophobicContact CE1-CD1 4.03Å; F359-L363 HydrophobicContact CE1-CD2 3.68Å; F359-L363 HydrophobicContact CE1-CG 4.47Å; F359-L363 HydrophobicContact CE2-CD1 3.6Å; F359-L363 HydrophobicContact CE2-CD2 4.31Å; F359-L363 HydrophobicContact CG-CD1 4.17Å; F359-L363 HydrophobicContact CZ-CD1 3.7Å; F359-L363 HydrophobicContact CZ-CD2 3.55Å; F359-L363 HydrophobicContact CZ-CG 4.29Å; F359-L363 WeakPolarHBondContact O-CD1 3.49Å; F359-L363 PolarHBondContact O-N 2.77Å; F359-L363 VanDerWaalsContact O-N 3.07Å; L363-K366 PolarHBondContact O-N 2.84Å; L363-K367 PolarHBondContact O-N 3.34Å; L363-Y370 HydrophobicContact CD2-CE2 4.06Å; L363-Y370 HydrophobicContact CG-CD2 4.38Å; L363-Y370 HydrophobicContact CG-CE2 4.33Å; L363-A375 HydrophobicContact CD1-CB 4.25Å; L363-A375 HydrophobicContact CD2-CB 4.11Å; L363-A375 HydrophobicContact CG-CB 4.31Å; L363-P417 HydrophobicContact CB-CB 4.09Å; L363-P417 HydrophobicContact CB-CG 3.87Å
364	A	85.7	Confident	85.6	Confident	53 Å²	53	68 Å²	68	44%	0.438	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-41.5	175.3	0	0	0	0	0	112.3	Q360 Q362 K366 K367 P417	Q360-A364 WeakPolarHBondContact O-CB 3.34Å; Q360-A364 PolarHBondContact O-N 3.19Å; Q362-A364 VanDerWaalsContact C-N 3.34Å; Q362-A364 PolarHBondContact O-N 3.4Å; A364-K366 VanDerWaalsContact C-N 3.34Å; A364-K366 PolarHBondContact O-N 3.29Å; A364-K367 WeakPolarHBondContact O-CG 3.49Å; A364-K367 PolarHBondContact O-N 3.09Å; A364-P417 HydrophobicContact CB-CB 4.34Å
365	A	84.4	Confident	85.6	Confident	78 Å²	78	64.9 Å²	64.9	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-64	-36.6	176.3	0	0	0	0	0	112.6	N361 Q362 K367	N361-A365 VanDerWaalsContact O-CB 3.23Å; N361-A365 WeakPolarHBondContact O-CB 3.49Å; N361-A365 PolarHBondContact O-N 3.39Å; Q362-A365 PolarHBondContact O-N 3.49Å; A365-K367 PolarHBondContact O-N 2.94Å
366	K	83.5	Confident	85.7	Confident	70 Å²	70	65.6 Å²	65.6	30%	0.304	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9.5	172.7	-70.8	179.3	-179.2	172.4	0	113.2	Q362 L363 A364 G368 Q369 Y370 E374	Q362-K366 WeakPolarHBondContact O-CG 3.46Å; Q362-K366 PolarHBondContact O-N 3.46Å; L363-K366 PolarHBondContact O-N 2.84Å; A364-K366 VanDerWaalsContact C-N 3.34Å; A364-K366 PolarHBondContact O-N 3.29Å; K366-G368 VanDerWaalsContact C-N 3.28Å; K366-G368 PolarHBondContact O-N 3.13Å; K366-G368 VanDerWaalsContact O-N 3.13Å; K366-Q369 WeakPolarHBondContact O-CA 3.4Å; K366-Q369 WeakPolarHBondContact O-CB 3.44Å; K366-Q369 PolarHBondContact O-N 3.47Å; K366-Y370 HydrophobicContact CB-CD1 4.46Å; K366-Y370 VanDerWaalsContact CD-CB 3.45Å; K366-E374 VanDerWaalsContact NZ-CD 3.26Å; K366-E374 IonicContact NZ-OE1 3.33Å; K366-E374 PolarHBondContact NZ-OE1 2.59Å; K366-E374 IonicContact NZ-OE2 2.63Å; K366-E374 PolarHBondContact NZ-OE2 3.1Å
367	K	77.3	Confident	85.7	Confident	188 Å²	188	69.8 Å²	69.8	82%	0.817	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	39.1	173.5	-65.7	-177.4	-177.6	176.4	0	115.2	L363 A364 A365 Q369	L363-K367 PolarHBondContact O-N 3.34Å; A364-K367 WeakPolarHBondContact O-CG 3.49Å; A364-K367 PolarHBondContact O-N 3.09Å; A365-K367 PolarHBondContact O-N 2.94Å; K367-Q369 VanDerWaalsContact C-N 3.28Å; K367-Q369 PolarHBondContact O-N 2.84Å
368	G	74.1	Confident	85.9	Confident	61 Å²	61	70.9 Å²	70.9	63%	0.629	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	3	-177.5	0	0	0	0	0	115.2	K366	K366-G368 VanDerWaalsContact C-N 3.28Å; K366-G368 PolarHBondContact O-N 3.13Å; K366-G368 VanDerWaalsContact O-N 3.13Å
369	Q	78.3	Confident	86	Confident	182 Å²	182	67 Å²	67	85%	0.85	36%	0.362	S	S	*	.			trans	-99.7	59.7	166.6	-62.2	-172.2	-8.6	0	0	109.7	K366 K367	K366-Q369 WeakPolarHBondContact O-CA 3.4Å; K366-Q369 WeakPolarHBondContact O-CB 3.44Å; K366-Q369 PolarHBondContact O-N 3.47Å; K367-Q369 VanDerWaalsContact C-N 3.28Å; K367-Q369 PolarHBondContact O-N 2.84Å
370	Y	82	Confident	86.2	Confident	43 Å²	43	69.6 Å²	69.6	17%	0.169	38%	0.375	C	S	.	.	S	Bend	trans	-120.9	153.8	172.5	62.1	-90.2	0	0	0	110.2	L363 K366 G372 A375 P415	L363-Y370 HydrophobicContact CD2-CE2 4.06Å; L363-Y370 HydrophobicContact CG-CD2 4.38Å; L363-Y370 HydrophobicContact CG-CE2 4.33Å; K366-Y370 HydrophobicContact CB-CD1 4.46Å; K366-Y370 VanDerWaalsContact CD-CB 3.45Å; Y370-G372 PolarHBondContact O-N 3.49Å; Y370-A375 HydrophobicContact CD2-CB 3.69Å; Y370-A375 HydrophobicContact CE2-CB 3.87Å; Y370-P415 VanDerWaalsContact CE2-O 3.32Å; Y370-P415 WeakPolarHBondContact CE2-O 3.47Å; Y370-P415 PolarHBondContact OH-O 3.23Å
371	D	85.4	Confident	86.3	Confident	99 Å²	99	73 Å²	73	53%	0.529	39%	0.394	S	S	.	.			trans	-76.8	121.3	170.7	-177.1	-14.7	0	0	0	108.5	Q373 E374 A375	D371-Q373 PolarHBondContact O-N 3.4Å; D371-Q373 WeakPolarHBondContact OD1-CB 3.42Å; D371-Q373 PolarHBondContact OD1-N 2.93Å; D371-E374 HydrophobicContact CB-CB 3.77Å; D371-E374 PolarHBondContact O-N 3.02Å; D371-A375 WeakPolarHBondContact O-CB 3.16Å; D371-A375 PolarHBondContact O-N 3.3Å
372	G	86.5	Confident	86.6	Confident	17 Å²	17	69.5 Å²	69.5	18%	0.175	38%	0.375	C	S	.	.	H	α-helix	trans	-63.1	-27	178.9	0	0	0	0	0	113	Y370 Q376 G413	Y370-G372 PolarHBondContact O-N 3.49Å; G372-Q376 WeakPolarHBondContact O-CB 3.23Å; G372-Q376 PolarHBondContact O-N 2.95Å; G372-G413 WeakPolarHBondContact CA-O 3.42Å
373	Q	87.6	Confident	86.8	Confident	97 Å²	97	66.8 Å²	66.8	45%	0.453	36%	0.361	S	S	.	.	H	α-helix	trans	-80.1	-39.1	176.8	-166	63.6	71	0	0	112	D371 Q376 N377	D371-Q373 PolarHBondContact O-N 3.4Å; D371-Q373 WeakPolarHBondContact OD1-CB 3.42Å; D371-Q373 PolarHBondContact OD1-N 2.93Å; Q373-Q376 PolarHBondContact O-N 3.38Å; Q373-N377 PolarHBondContact NE2-OD1 3.41Å; Q373-N377 WeakPolarHBondContact O-CB 3.33Å; Q373-N377 PolarHBondContact O-N 3.03Å; Q373-N377 PolarHBondContact O-ND2 3.4Å; Q373-N377 PolarHBondContact O-OD1 3.35Å
374	E	89.4	Confident	87	Confident	85 Å²	85	70.4 Å²	70.4	40%	0.397	38%	0.38	S	S	.	.	H	α-helix	trans	-55.9	-54.3	169.6	-177.8	-166.4	-145.9	0	0	109.6	K366 D371 Q376 N377 D378	K366-E374 VanDerWaalsContact NZ-CD 3.26Å; K366-E374 IonicContact NZ-OE1 3.33Å; K366-E374 PolarHBondContact NZ-OE1 2.59Å; K366-E374 IonicContact NZ-OE2 2.63Å; K366-E374 PolarHBondContact NZ-OE2 3.1Å; D371-E374 HydrophobicContact CB-CB 3.77Å; D371-E374 PolarHBondContact O-N 3.02Å; E374-Q376 VanDerWaalsContact C-N 3.32Å; E374-Q376 PolarHBondContact O-N 3.33Å; E374-N377 PolarHBondContact O-N 2.87Å; E374-N377 VanDerWaalsContact O-N 3.15Å; E374-D378 PolarHBondContact O-N 2.89Å
375	A	90	Very high	87.3	Confident	2 Å²	2	70.7 Å²	70.7	2%	0.017	37%	0.372	C	S	.	.	H	α-helix	trans	-64.3	-32.9	179.9	0	0	0	0	0	113.4	F359 L363 Y370 D371 A379 P415	F359-A375 WeakPolarHBondContact CE2-O 3.27Å; L363-A375 HydrophobicContact CD1-CB 4.25Å; L363-A375 HydrophobicContact CD2-CB 4.11Å; L363-A375 HydrophobicContact CG-CB 4.31Å; Y370-A375 HydrophobicContact CD2-CB 3.69Å; Y370-A375 HydrophobicContact CE2-CB 3.87Å; D371-A375 WeakPolarHBondContact O-CB 3.16Å; D371-A375 PolarHBondContact O-N 3.3Å; A375-A379 VanDerWaalsContact O-CB 3.29Å; A375-A379 WeakPolarHBondContact O-CB 3.25Å; A375-A379 PolarHBondContact O-N 2.91Å; A375-P415 HydrophobicContact CB-CG 4.02Å; A375-P415 WeakPolarHBondContact O-CG 3.26Å
376	Q	92.1	Very high	87.5	Confident	48 Å²	48	67.4 Å²	67.4	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-67.7	-41.7	173.4	-177.3	174.2	80.1	0	0	111.6	G372 Q373 E374 A379 M380 I409	G372-Q376 WeakPolarHBondContact O-CB 3.23Å; G372-Q376 PolarHBondContact O-N 2.95Å; Q373-Q376 PolarHBondContact O-N 3.38Å; E374-Q376 VanDerWaalsContact C-N 3.32Å; E374-Q376 PolarHBondContact O-N 3.33Å; Q376-A379 PolarHBondContact O-N 3.27Å; Q376-M380 WeakPolarHBondContact O-CB 3.4Å; Q376-M380 WeakPolarHBondContact O-CG 3.27Å; Q376-M380 PolarHBondContact O-N 3.35Å; Q376-I409 HydrophobicContact CG-CG2 3.91Å; Q376-I409 PolarHBondContact NE2-O 3.12Å
377	N	91.1	Very high	87.8	Confident	88 Å²	88	64.4 Å²	64.4	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-44.5	177.3	-62.9	-15.3	0	0	0	111.1	Q373 E374 A379 M380 I381	Q373-N377 PolarHBondContact NE2-OD1 3.41Å; Q373-N377 WeakPolarHBondContact O-CB 3.33Å; Q373-N377 PolarHBondContact O-N 3.03Å; Q373-N377 PolarHBondContact O-ND2 3.4Å; Q373-N377 PolarHBondContact O-OD1 3.35Å; E374-N377 PolarHBondContact O-N 2.87Å; E374-N377 VanDerWaalsContact O-N 3.15Å; N377-A379 PolarHBondContact O-N 3.24Å; N377-M380 PolarHBondContact O-N 2.85Å; N377-I381 WeakPolarHBondContact O-CG1 3.4Å; N377-I381 PolarHBondContact O-N 3.19Å; N377-I381 VanDerWaalsContact O-N 3.15Å
378	D	91.1	Very high	88.2	Confident	64 Å²	64	56.7 Å²	56.7	34%	0.342	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-41.6	175.8	-73.1	-20.4	0	0	0	112	F359 E374 I381 L382	F359-D378 HydrophobicContact CD2-CB 4.04Å; F359-D378 HydrophobicContact CE2-CB 3.88Å; E374-D378 PolarHBondContact O-N 2.89Å; D378-I381 PolarHBondContact O-N 2.91Å; D378-L382 PolarHBondContact O-N 3.32Å
379	A	92.3	Very high	88.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.8	-35.8	175.7	0	0	0	0	0	112.5	F359 A375 Q376 N377 I381 L382 Y383 I409 P415 F420	F359-A379 HydrophobicContact CE2-CB 4.05Å; F359-A379 HydrophobicContact CZ-CB 3.88Å; A375-A379 VanDerWaalsContact O-CB 3.29Å; A375-A379 WeakPolarHBondContact O-CB 3.25Å; A375-A379 PolarHBondContact O-N 2.91Å; Q376-A379 PolarHBondContact O-N 3.27Å; N377-A379 PolarHBondContact O-N 3.24Å; A379-I381 VanDerWaalsContact C-N 3.35Å; A379-I381 PolarHBondContact O-N 3.37Å; A379-L382 PolarHBondContact O-N 3.41Å; A379-Y383 PolarHBondContact O-N 2.69Å; A379-I409 HydrophobicContact CB-CD1 3.91Å; A379-I409 HydrophobicContact CB-CG1 3.9Å; A379-P415 HydrophobicContact CB-CB 4.47Å; A379-P415 HydrophobicContact CB-CG 4Å; A379-F420 HydrophobicContact CB-CE2 3.93Å; A379-F420 HydrophobicContact CB-CZ 3.91Å
380	M	92.1	Very high	88.8	Confident	65 Å²	65	60.5 Å²	60.5	32%	0.32	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-36.5	175	-79.3	-57.8	-52.3	0	0	112.4	Q376 N377 L382 Y383 D384 I409	Q376-M380 WeakPolarHBondContact O-CB 3.4Å; Q376-M380 WeakPolarHBondContact O-CG 3.27Å; Q376-M380 PolarHBondContact O-N 3.35Å; N377-M380 PolarHBondContact O-N 2.85Å; M380-L382 VanDerWaalsContact C-N 3.28Å; M380-L382 PolarHBondContact O-N 3.11Å; M380-Y383 HydrophobicContact CE-CD1 3.72Å; M380-Y383 HydrophobicContact CE-CE1 4.43Å; M380-Y383 HydrophobicContact CE-CG 4.48Å; M380-Y383 PolarHBondContact O-N 3.07Å; M380-Y383 HydrophobicContact SD-CD1 4.27Å; M380-D384 WeakPolarHBondContact O-CB 3.28Å; M380-D384 PolarHBondContact O-N 3.1Å; M380-I409 HydrophobicContact CG-CG2 4.21Å; M380-I409 HydrophobicContact SD-CG2 3.93Å
381	I	91.9	Very high	88.8	Confident	112 Å²	112	59.2 Å²	59.2	57%	0.574	30%	0.303	S	S	*	.	H	α-helix	trans	-60.4	-38.6	174.5	-66.3	165.2	0	0	0	111.3	N377 D378 A379 K385	N377-I381 WeakPolarHBondContact O-CG1 3.4Å; N377-I381 PolarHBondContact O-N 3.19Å; N377-I381 VanDerWaalsContact O-N 3.15Å; D378-I381 PolarHBondContact O-N 2.91Å; A379-I381 VanDerWaalsContact C-N 3.35Å; A379-I381 PolarHBondContact O-N 3.37Å; I381-K385 WeakPolarHBondContact O-CB 3.5Å; I381-K385 PolarHBondContact O-N 3.16Å
382	L	91	Very high	88.5	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-71.5	-41.3	174.5	-64.8	175.8	0	0	0	112	A355 A356 F359 D378 A379 M380 Y386 F420	A355-L382 HydrophobicContact CB-CD2 3.7Å; A356-L382 HydrophobicContact CB-CD1 4.23Å; F359-L382 HydrophobicContact CB-CD1 4.21Å; F359-L382 HydrophobicContact CG-CD1 4.42Å; D378-L382 PolarHBondContact O-N 3.32Å; A379-L382 PolarHBondContact O-N 3.41Å; M380-L382 VanDerWaalsContact C-N 3.28Å; M380-L382 PolarHBondContact O-N 3.11Å; L382-Y386 HydrophobicContact CD2-CD2 4.41Å; L382-Y386 HydrophobicContact CD2-CE2 4Å; L382-Y386 WeakPolarHBondContact O-CD2 3.31Å; L382-Y386 PolarHBondContact O-N 3.44Å; L382-F420 HydrophobicContact CB-CE1 4.24Å; L382-F420 HydrophobicContact CB-CE2 4.48Å; L382-F420 HydrophobicContact CB-CZ 3.88Å; L382-F420 HydrophobicContact CD1-CD2 4.21Å; L382-F420 HydrophobicContact CD1-CE2 3.73Å; L382-F420 HydrophobicContact CD1-CZ 3.99Å
383	Y	91.3	Very high	88.1	Confident	30 Å²	30	61 Å²	61	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-52.6	176.3	178.4	-94.6	0	0	0	111.9	A379 M380 K385 Y386 F387 S388 R402 I405 E406 I409	A379-Y383 PolarHBondContact O-N 2.69Å; M380-Y383 HydrophobicContact CE-CD1 3.72Å; M380-Y383 HydrophobicContact CE-CE1 4.43Å; M380-Y383 HydrophobicContact CE-CG 4.48Å; M380-Y383 PolarHBondContact O-N 3.07Å; M380-Y383 HydrophobicContact SD-CD1 4.27Å; Y383-K385 VanDerWaalsContact C-N 3.34Å; Y383-K385 PolarHBondContact O-N 2.92Å; Y383-Y386 PolarHBondContact O-N 3.01Å; Y383-F387 HydrophobicContact CD2-CB 3.74Å; Y383-F387 HydrophobicContact CE2-CB 3.95Å; Y383-F387 HydrophobicContact CG-CB 4.43Å; Y383-F387 WeakPolarHBondContact O-CA 3.44Å; Y383-F387 WeakPolarHBondContact O-CB 3.28Å; Y383-F387 PolarHBondContact O-N 3.11Å; Y383-S388 PolarHBondContact O-N 3.16Å; Y383-R402 HydrophobicContact CE2-CG 3.82Å; Y383-I405 HydrophobicContact CD2-CG2 4.07Å; Y383-E406 HydrophobicContact CE2-CG 3.86Å; Y383-E406 PolarHBondContact OH-OE1 2.84Å; Y383-E406 VanDerWaalsContact OH-OE1 3.12Å; Y383-I409 HydrophobicContact CD2-CD1 4.47Å; Y383-I409 HydrophobicContact CG-CD1 4.42Å
384	D	90.9	Very high	87.8	Confident	81 Å²	81	60.8 Å²	60.8	43%	0.433	32%	0.32	S	S	.	.	H	α-helix	trans	-65.2	-34.9	-177.4	-73.6	-26.2	0	0	0	112.5	M380 A391	M380-D384 WeakPolarHBondContact O-CB 3.28Å; M380-D384 PolarHBondContact O-N 3.1Å; D384-A391 VanDerWaalsContact O-CA 3.31Å; D384-A391 WeakPolarHBondContact O-CA 3.43Å
385	K	90.9	Very high	87.5	Confident	59 Å²	59	57.5 Å²	57.5	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-73.9	-37.7	179.1	-172	176.9	173.2	-159.6	0	113.7	I381 Y383 A391 N393	I381-K385 WeakPolarHBondContact O-CB 3.5Å; I381-K385 PolarHBondContact O-N 3.16Å; Y383-K385 VanDerWaalsContact C-N 3.34Å; Y383-K385 PolarHBondContact O-N 2.92Å; K385-A391 WeakPolarHBondContact O-CB 2.97Å; K385-N393 WeakPolarHBondContact CE-OD1 3.41Å; K385-N393 HydrophobicContact CG-CB 4.24Å; K385-N393 CarbonylContact O-C 3.53Å; K385-N393 PolarHBondContact O-N 3.01Å
386	Y	89.6	Confident	87.1	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.035	31%	0.313	C	S	.	.	H	α-helix	trans	-122.7	-21.5	-165.1	-56.9	-67.3	0	0	0	116.2	Q351 F352 L382 Y383 N393 L395	Q351-Y386 WeakPolarHBondContact CB-OH 3.2Å; F352-Y386 HydrophobicContact CB-CD1 4.05Å; F352-Y386 HydrophobicContact CB-CD2 3.94Å; F352-Y386 HydrophobicContact CB-CE1 3.92Å; F352-Y386 HydrophobicContact CB-CE2 3.79Å; F352-Y386 HydrophobicContact CB-CG 4.05Å; F352-Y386 AromaticContact CD2-CD2 3.69Å; F352-Y386 HydrophobicContact CD2-CD2 3.69Å; F352-Y386 HydrophobicContact CD2-CE2 4.05Å; F352-Y386 HydrophobicContact CD2-CG 4.21Å; F352-Y386 HydrophobicContact CG-CD2 4.22Å; F352-Y386 HydrophobicContact CG-CE2 4.42Å; F352-Y386 HydrophobicContact CG-CG 4.42Å; F352-Y386 PolarHBondContact N-OH 3.32Å; L382-Y386 HydrophobicContact CD2-CD2 4.41Å; L382-Y386 HydrophobicContact CD2-CE2 4Å; L382-Y386 WeakPolarHBondContact O-CD2 3.31Å; L382-Y386 PolarHBondContact O-N 3.44Å; Y383-Y386 PolarHBondContact O-N 3.01Å; Y386-N393 HydrophobicContact CD1-CB 4.02Å; Y386-N393 WeakPolarHBondContact CD1-O 3.19Å; Y386-N393 HydrophobicContact CE1-CB 4.14Å; Y386-L395 HydrophobicContact CD1-CD1 3.88Å; Y386-L395 HydrophobicContact CD1-CD2 4.47Å; Y386-L395 HydrophobicContact CD1-CG 3.99Å; Y386-L395 HydrophobicContact CG-CD1 4.12Å; Y386-L395 HydrophobicContact CG-CG 4.45Å; Y386-L395 PolarHBondContact O-N 3.21Å
387	F	88.5	Confident	86.6	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.026	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-33.7	-169.7	-63.3	-88	0	0	0	114.4	F352 Y383 F397 R402 I405 F420 P423	F352-F387 AromaticContact CD2-CE2 3.94Å; F352-F387 HydrophobicContact CD2-CE2 3.94Å; F352-F387 HydrophobicContact CD2-CZ 4.2Å; F352-F387 HydrophobicContact CE1-CZ 4.36Å; F352-F387 AromaticContact CE2-CE2 3.5Å; F352-F387 HydrophobicContact CE2-CE2 3.5Å; F352-F387 AromaticContact CE2-CZ 3.54Å; F352-F387 HydrophobicContact CE2-CZ 3.54Å; F352-F387 HydrophobicContact CZ-CE2 4.12Å; F352-F387 AromaticContact CZ-CZ 3.66Å; F352-F387 HydrophobicContact CZ-CZ 3.66Å; Y383-F387 HydrophobicContact CD2-CB 3.74Å; Y383-F387 HydrophobicContact CE2-CB 3.95Å; Y383-F387 HydrophobicContact CG-CB 4.43Å; Y383-F387 WeakPolarHBondContact O-CA 3.44Å; Y383-F387 WeakPolarHBondContact O-CB 3.28Å; Y383-F387 PolarHBondContact O-N 3.11Å; F387-F397 HydrophobicContact CD1-CB 4.29Å; F387-F397 AromaticContact CD1-CD2 3.5Å; F387-F397 HydrophobicContact CD1-CD2 3.5Å; F387-F397 VanDerWaalsContact CD1-CD2 3.5Å; F387-F397 HydrophobicContact CD1-CE2 4.02Å; F387-F397 HydrophobicContact CD1-CG 4.07Å; F387-F397 HydrophobicContact CE1-CB 4.37Å; F387-F397 HydrophobicContact CE1-CD1 4.32Å; F387-F397 AromaticContact CE1-CD2 3.1Å; F387-F397 HydrophobicContact CE1-CD2 3.1Å; F387-F397 HydrophobicContact CE1-CE1 4.42Å; F387-F397 AromaticContact CE1-CE2 3.2Å; F387-F397 HydrophobicContact CE1-CE2 3.2Å; F387-F397 AromaticContact CE1-CG 3.71Å; F387-F397 HydrophobicContact CE1-CG 3.71Å; F387-F397 AromaticContact CE1-CZ 3.92Å; F387-F397 HydrophobicContact CE1-CZ 3.92Å; F387-F397 HydrophobicContact CE2-CE2 4.43Å; F387-F397 HydrophobicContact CG-CD2 4.49Å; F387-F397 AromaticContact CZ-CD2 3.85Å; F387-F397 HydrophobicContact CZ-CD2 3.85Å; F387-F397 AromaticContact CZ-CE2 3.46Å; F387-F397 HydrophobicContact CZ-CE2 3.46Å; F387-F397 VanDerWaalsContact CZ-CE2 3.46Å; F387-F397 HydrophobicContact CZ-CZ 4.09Å; F387-R402 PolarHBondContact O-NE 3.25Å; F387-I405 HydrophobicContact CD1-CD1 3.31Å; F387-I405 HydrophobicContact CD2-CD1 4.4Å; F387-I405 HydrophobicContact CE1-CD1 3.13Å; F387-I405 HydrophobicContact CE2-CD1 4.27Å; F387-I405 HydrophobicContact CG-CD1 3.96Å; F387-I405 HydrophobicContact CZ-CD1 3.67Å; F387-F420 HydrophobicContact CE2-CD1 4.41Å; F387-F420 HydrophobicContact CE2-CE1 4.3Å; F387-P423 HydrophobicContact CE1-CB 3.67Å; F387-P423 HydrophobicContact CE1-CG 4.09Å; F387-P423 HydrophobicContact CZ-CB 3.64Å; F387-P423 HydrophobicContact CZ-CG 3.88Å
388	S	86.9	Confident	86.1	Confident	26 Å²	26	53.8 Å²	53.8	18%	0.182	30%	0.296	C	S	.	.	S	Bend	trans	-51.5	149.1	179.7	176.4	0	0	0	0	112.7	Y383 Q390 A391	Y383-S388 PolarHBondContact O-N 3.16Å; S388-Q390 PolarHBondContact O-N 2.77Å; S388-Q390 VanDerWaalsContact O-N 3.08Å; S388-Q390 PolarHBondContact OG-N 2.86Å; S388-A391 WeakPolarHBondContact O-CB 3.35Å; S388-A391 PolarHBondContact O-N 3.43Å
389	L	83.1	Confident	85.8	Confident	145 Å²	145	55.5 Å²	55.5	76%	0.759	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-12	171.9	-69	168.3	0	0	0	113.1
390	Q	81.9	Confident	85.5	Confident	179 Å²	179	58.7 Å²	58.7	84%	0.836	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	20.4	174	-61.2	-176.3	-9.7	0	0	112.4	S388	S388-Q390 PolarHBondContact O-N 2.77Å; S388-Q390 VanDerWaalsContact O-N 3.08Å; S388-Q390 PolarHBondContact OG-N 2.86Å
391	A	82.3	Confident	85.3	Confident	16 Å²	16	56.2 Å²	56.2	13%	0.132	32%	0.316	C	S	.	.			trans	-56.7	137	-176.5	0	0	0	0	0	113	D384 K385 S388 N393 P394	D384-A391 VanDerWaalsContact O-CA 3.31Å; D384-A391 WeakPolarHBondContact O-CA 3.43Å; K385-A391 WeakPolarHBondContact O-CB 2.97Å; S388-A391 WeakPolarHBondContact O-CB 3.35Å; S388-A391 PolarHBondContact O-N 3.43Å; A391-N393 VanDerWaalsContact C-N 3.33Å; A391-P394 HydrophobicContact CB-CB 4.18Å; A391-P394 WeakPolarHBondContact O-CD 3.22Å
392	T	77.2	Confident	85.1	Confident	110 Å²	110	52.6 Å²	52.6	68%	0.675	30%	0.295	S	S	*	.	S	Bend	trans	-74.8	-24.9	177.7	56.8	0	0	0	0	112.7
393	N	79.5	Confident	85	Confident	43 Å²	43	57.3 Å²	57.3	23%	0.23	32%	0.318	C	S	.	.	S	Bend	trans	-134.3	59	-177.3	-58.9	85.4	0	0	0	109.7	N348 K385 Y386 A391 L395	N348-N393 HydrophobicContact CB-CB 4.38Å; N348-N393 PolarHBondContact OD1-ND2 3.4Å; K385-N393 WeakPolarHBondContact CE-OD1 3.41Å; K385-N393 HydrophobicContact CG-CB 4.24Å; K385-N393 CarbonylContact O-C 3.53Å; K385-N393 PolarHBondContact O-N 3.01Å; Y386-N393 HydrophobicContact CD1-CB 4.02Å; Y386-N393 WeakPolarHBondContact CD1-O 3.19Å; Y386-N393 HydrophobicContact CE1-CB 4.14Å; A391-N393 VanDerWaalsContact C-N 3.33Å; N393-L395 PolarHBondContact O-N 2.93Å
394	P	81.8	Confident	84.9	Confident	93 Å²	93	59.4 Å²	59.4	60%	0.604	33%	0.329	S	S	*	.			trans	-64.7	130.3	-171.1	28.3	-34.2	0	0	0	110.9	A391	A391-P394 HydrophobicContact CB-CB 4.18Å; A391-P394 WeakPolarHBondContact O-CD 3.22Å
395	L	83.3	Confident	84.9	Confident	15 Å²	15	55.5 Å²	55.5	8%	0.079	31%	0.308	C	S	.	.			trans	-94.3	3	-173.9	-68.5	-174.5	0	0	0	115.2	L85 N348 I349 F352 Y386 N393 F397	L85-L395 HydrophobicContact CD1-CB 4.26Å; L85-L395 WeakPolarHBondContact CD1-O 3.23Å; L85-L395 VanDerWaalsContact CG-O 3.26Å; L85-L395 WeakPolarHBondContact CG-O 3.42Å; N348-L395 HydrophobicContact CB-CD2 3.48Å; N348-L395 VanDerWaalsContact CB-CD2 3.48Å; I349-L395 HydrophobicContact CG1-CD2 3.91Å; F352-L395 HydrophobicContact CB-CD1 3.44Å; F352-L395 VanDerWaalsContact CB-CD1 3.44Å; F352-L395 HydrophobicContact CD1-CD1 3.78Å; F352-L395 HydrophobicContact CG-CD1 3.63Å; Y386-L395 HydrophobicContact CD1-CD1 3.88Å; Y386-L395 HydrophobicContact CD1-CD2 4.47Å; Y386-L395 HydrophobicContact CD1-CG 3.99Å; Y386-L395 HydrophobicContact CG-CD1 4.12Å; Y386-L395 HydrophobicContact CG-CG 4.45Å; Y386-L395 PolarHBondContact O-N 3.21Å; N393-L395 PolarHBondContact O-N 2.93Å; L395-F397 HydrophobicContact CB-CD2 3.69Å; L395-F397 HydrophobicContact CB-CE2 3.51Å; L395-F397 HydrophobicContact CB-CZ 4.37Å; L395-F397 HydrophobicContact CD1-CE2 3.73Å; L395-F397 HydrophobicContact CD1-CZ 4.36Å; L395-F397 HydrophobicContact CG-CE2 4.21Å
396	G	80.6	Confident	84.9	Confident	19 Å²	19	56.4 Å²	56.4	20%	0.196	31%	0.313	C	S	.	.			trans	72.6	28.6	-178.6	0	0	0	0	0	113.9	G83 D84 L85	G83-G396 WeakPolarHBondContact O-CA 3.37Å; D84-G396 WeakPolarHBondContact CA-O 3.22Å; L85-G396 PolarHBondContact N-O 2.68Å
397	F	82.6	Confident	84.9	Confident	16 Å²	16	60 Å²	60	7%	0.07	34%	0.34	C	S	.	.			trans	-72.7	129.2	169.1	-67.6	-70.6	0	0	0	110.8	L85 F352 F387 L395 V401 P423 Q426	L85-F397 HydrophobicContact CB-CD1 4.38Å; L85-F397 HydrophobicContact CD1-CD1 3.79Å; L85-F397 HydrophobicContact CD1-CD2 4.41Å; L85-F397 HydrophobicContact CD1-CE1 3.52Å; L85-F397 HydrophobicContact CD1-CE2 4.21Å; L85-F397 HydrophobicContact CD1-CG 4.23Å; L85-F397 HydrophobicContact CD1-CZ 3.76Å; F352-F397 HydrophobicContact CD1-CZ 4.35Å; F352-F397 HydrophobicContact CE1-CE2 4.45Å; F352-F397 HydrophobicContact CE1-CZ 4.01Å; F387-F397 HydrophobicContact CD1-CB 4.29Å; F387-F397 AromaticContact CD1-CD2 3.5Å; F387-F397 HydrophobicContact CD1-CD2 3.5Å; F387-F397 VanDerWaalsContact CD1-CD2 3.5Å; F387-F397 HydrophobicContact CD1-CE2 4.02Å; F387-F397 HydrophobicContact CD1-CG 4.07Å; F387-F397 HydrophobicContact CE1-CB 4.37Å; F387-F397 HydrophobicContact CE1-CD1 4.32Å; F387-F397 AromaticContact CE1-CD2 3.1Å; F387-F397 HydrophobicContact CE1-CD2 3.1Å; F387-F397 HydrophobicContact CE1-CE1 4.42Å; F387-F397 AromaticContact CE1-CE2 3.2Å; F387-F397 HydrophobicContact CE1-CE2 3.2Å; F387-F397 AromaticContact CE1-CG 3.71Å; F387-F397 HydrophobicContact CE1-CG 3.71Å; F387-F397 AromaticContact CE1-CZ 3.92Å; F387-F397 HydrophobicContact CE1-CZ 3.92Å; F387-F397 HydrophobicContact CE2-CE2 4.43Å; F387-F397 HydrophobicContact CG-CD2 4.49Å; F387-F397 AromaticContact CZ-CD2 3.85Å; F387-F397 HydrophobicContact CZ-CD2 3.85Å; F387-F397 AromaticContact CZ-CE2 3.46Å; F387-F397 HydrophobicContact CZ-CE2 3.46Å; F387-F397 VanDerWaalsContact CZ-CE2 3.46Å; F387-F397 HydrophobicContact CZ-CZ 4.09Å; L395-F397 HydrophobicContact CB-CD2 3.69Å; L395-F397 HydrophobicContact CB-CE2 3.51Å; L395-F397 HydrophobicContact CB-CZ 4.37Å; L395-F397 HydrophobicContact CD1-CE2 3.73Å; L395-F397 HydrophobicContact CD1-CZ 4.36Å; L395-F397 HydrophobicContact CG-CE2 4.21Å; F397-V401 HydrophobicContact CB-CB 4.4Å; F397-V401 HydrophobicContact CB-CG1 4.41Å; F397-V401 HydrophobicContact CD1-CG1 4.03Å; F397-V401 HydrophobicContact CG-CG1 4.38Å; F397-P423 HydrophobicContact CD1-CB 4.2Å; F397-P423 HydrophobicContact CE1-CB 3.52Å; F397-P423 HydrophobicContact CE2-CB 4.15Å; F397-P423 HydrophobicContact CZ-CB 3.49Å; F397-P423 VanDerWaalsContact CZ-CB 3.49Å; F397-Q426 HydrophobicContact CD1-CG 4.39Å; F397-Q426 HydrophobicContact CE1-CB 4.14Å; F397-Q426 HydrophobicContact CE1-CG 3.99Å
398	G	80.7	Confident	85	Confident	25 Å²	25	62 Å²	62	26%	0.258	35%	0.351	S	S	.	.			trans	-67	155.9	173.7	0	0	0	0	0	113.2	S400 V401 R402	G398-S400 PolarHBondContact O-N 3.5Å; G398-V401 PolarHBondContact O-N 2.92Å; G398-R402 PolarHBondContact O-N 3.36Å
399	D	82.9	Confident	85.1	Confident	100 Å²	100	61 Å²	61	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-29.2	-169.3	-58.3	-34.4	0	0	0	114.4	V401 R402 M403	D399-V401 VanDerWaalsContact C-N 3.31Å; D399-V401 PolarHBondContact O-N 2.9Å; D399-R402 PolarHBondContact O-N 3.4Å; D399-R402 IonicContact OD1-CZ 3.58Å; D399-R402 IonicContact OD1-NH1 2.68Å; D399-R402 PolarHBondContact OD1-NH1 3.5Å; D399-R402 IonicContact OD1-NH2 3.63Å; D399-M403 WeakPolarHBondContact O-CG 3.23Å; D399-M403 PolarHBondContact O-N 2.95Å
400	S	86.5	Confident	85.3	Confident	68 Å²	68	58.8 Å²	58.8	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-59	-40.8	174.5	50.1	0	0	0	0	112.9	G398 E404	G398-S400 PolarHBondContact O-N 3.5Å; S400-E404 WeakPolarHBondContact O-CB 3.49Å; S400-E404 PolarHBondContact O-N 3.27Å; S400-E404 VanDerWaalsContact O-N 3.1Å
401	V	87.6	Confident	85.6	Confident	12 Å²	12	55.9 Å²	55.9	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-74	-33.7	178.3	180	0	0	0	0	110.4	F397 G398 D399 I405 T422 P423	F397-V401 HydrophobicContact CB-CB 4.4Å; F397-V401 HydrophobicContact CB-CG1 4.41Å; F397-V401 HydrophobicContact CD1-CG1 4.03Å; F397-V401 HydrophobicContact CG-CG1 4.38Å; G398-V401 PolarHBondContact O-N 2.92Å; D399-V401 VanDerWaalsContact C-N 3.31Å; D399-V401 PolarHBondContact O-N 2.9Å; V401-I405 HydrophobicContact CG1-CD1 3.97Å; V401-I405 VanDerWaalsContact O-CD1 3.28Å; V401-I405 WeakPolarHBondContact O-CD1 3.45Å; V401-I405 VanDerWaalsContact O-CG1 3.23Å; V401-I405 WeakPolarHBondContact O-CG1 3.47Å; V401-I405 PolarHBondContact O-N 3.47Å; V401-I405 VanDerWaalsContact O-N 3.16Å; V401-T422 HydrophobicContact CG1-CG2 4.47Å; V401-T422 HydrophobicContact CG2-CG2 4.31Å; V401-P423 HydrophobicContact CG1-CB 4.08Å; V401-P423 HydrophobicContact CG1-CG 4.45Å
402	R	88.3	Confident	85.2	Confident	36 Å²	36	63.9 Å²	63.9	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-63.6	-50.2	173.5	-163.6	-168.6	-65.1	103.1	11.1	111.2	Y383 F387 G398 D399 E404 I405 E406	Y383-R402 HydrophobicContact CE2-CG 3.82Å; F387-R402 PolarHBondContact O-NE 3.25Å; G398-R402 PolarHBondContact O-N 3.36Å; D399-R402 PolarHBondContact O-N 3.4Å; D399-R402 IonicContact OD1-CZ 3.58Å; D399-R402 IonicContact OD1-NH1 2.68Å; D399-R402 PolarHBondContact OD1-NH1 3.5Å; D399-R402 IonicContact OD1-NH2 3.63Å; R402-E404 VanDerWaalsContact C-N 3.3Å; R402-E404 PolarHBondContact O-N 3.43Å; R402-I405 PolarHBondContact O-N 3.37Å; R402-I405 VanDerWaalsContact O-N 3.14Å; R402-E406 VanDerWaalsContact CD-OE1 3.24Å; R402-E406 WeakPolarHBondContact CD-OE1 3.3Å; R402-E406 VanDerWaalsContact CG-OE1 3.29Å; R402-E406 WeakPolarHBondContact CG-OE1 3.49Å; R402-E406 WeakPolarHBondContact O-CG 3.02Å; R402-E406 PolarHBondContact O-N 3.13Å
403	M	87.9	Confident	85.2	Confident	116 Å²	116	61.5 Å²	61.5	57%	0.571	35%	0.352	S	S	*	.	H	α-helix	trans	-61.5	-35.6	178.2	-69.8	-176.9	-67.2	0	0	112.9	D399 S407	D399-M403 WeakPolarHBondContact O-CG 3.23Å; D399-M403 PolarHBondContact O-N 2.95Å; M403-S407 WeakPolarHBondContact O-CB 3.49Å; M403-S407 PolarHBondContact O-N 3.05Å
404	E	90.1	Very high	85.4	Confident	73 Å²	73	59.7 Å²	59.7	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-61.3	-45.9	173.5	-172.2	-174.7	141.8	0	0	111.3	S400 R402 S407 N408 T422	S400-E404 WeakPolarHBondContact O-CB 3.49Å; S400-E404 PolarHBondContact O-N 3.27Å; S400-E404 VanDerWaalsContact O-N 3.1Å; R402-E404 VanDerWaalsContact C-N 3.3Å; R402-E404 PolarHBondContact O-N 3.43Å; E404-S407 PolarHBondContact O-N 3.29Å; E404-N408 PolarHBondContact O-N 2.84Å; E404-N408 PolarHBondContact O-ND2 3.31Å; E404-T422 WeakPolarHBondContact OE1-CB 3.07Å; E404-T422 PolarHBondContact OE1-OG1 2.94Å
405	I	90.8	Very high	85.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68.9	-43.7	179.4	-64.4	160.6	0	0	0	111.3	Y383 F387 V401 R402 S407 N408 I409 F420 P423	Y383-I405 HydrophobicContact CD2-CG2 4.07Å; F387-I405 HydrophobicContact CD1-CD1 3.31Å; F387-I405 HydrophobicContact CD2-CD1 4.4Å; F387-I405 HydrophobicContact CE1-CD1 3.13Å; F387-I405 HydrophobicContact CE2-CD1 4.27Å; F387-I405 HydrophobicContact CG-CD1 3.96Å; F387-I405 HydrophobicContact CZ-CD1 3.67Å; V401-I405 HydrophobicContact CG1-CD1 3.97Å; V401-I405 VanDerWaalsContact O-CD1 3.28Å; V401-I405 WeakPolarHBondContact O-CD1 3.45Å; V401-I405 VanDerWaalsContact O-CG1 3.23Å; V401-I405 WeakPolarHBondContact O-CG1 3.47Å; V401-I405 PolarHBondContact O-N 3.47Å; V401-I405 VanDerWaalsContact O-N 3.16Å; R402-I405 PolarHBondContact O-N 3.37Å; R402-I405 VanDerWaalsContact O-N 3.14Å; I405-S407 VanDerWaalsContact C-N 3.29Å; I405-S407 PolarHBondContact O-N 3.06Å; I405-N408 PolarHBondContact O-N 3.29Å; I405-I409 HydrophobicContact CG2-CD1 3.61Å; I405-I409 HydrophobicContact CG2-CG1 4.15Å; I405-I409 WeakPolarHBondContact O-CG1 3.48Å; I405-I409 PolarHBondContact O-N 3.05Å; I405-F420 HydrophobicContact CG2-CD1 4.33Å; I405-F420 HydrophobicContact CG2-CE1 3.77Å; I405-P423 HydrophobicContact CD1-CB 4.36Å; I405-P423 HydrophobicContact CD1-CG 3.78Å; I405-P423 HydrophobicContact CG1-CG 4.31Å
406	E	90.5	Very high	85.9	Confident	77 Å²	77	57.3 Å²	57.3	36%	0.36	33%	0.326	S	S	.	.	H	α-helix	trans	-54	-47.3	173.1	-71.5	167.2	-163.5	0	0	110.6	Y383 R402 N408 I409 C410	Y383-E406 HydrophobicContact CE2-CG 3.86Å; Y383-E406 PolarHBondContact OH-OE1 2.84Å; Y383-E406 VanDerWaalsContact OH-OE1 3.12Å; R402-E406 VanDerWaalsContact CD-OE1 3.24Å; R402-E406 WeakPolarHBondContact CD-OE1 3.3Å; R402-E406 VanDerWaalsContact CG-OE1 3.29Å; R402-E406 WeakPolarHBondContact CG-OE1 3.49Å; R402-E406 WeakPolarHBondContact O-CG 3.02Å; R402-E406 PolarHBondContact O-N 3.13Å; E406-N408 VanDerWaalsContact C-N 3.3Å; E406-N408 PolarHBondContact O-N 3.22Å; E406-I409 PolarHBondContact O-N 3.34Å; E406-C410 WeakPolarHBondContact O-CB 3.26Å; E406-C410 PolarHBondContact O-N 3.45Å; E406-C410 PolarHBondContact O-SG 3.18Å
407	S	89.9	Confident	86.1	Confident	85 Å²	85	58.2 Å²	58.2	59%	0.594	33%	0.328	S	S	*	.	H	α-helix	trans	-65.2	-29.4	176.5	-171.5	0	0	0	0	113.8	M403 E404 I405	M403-S407 WeakPolarHBondContact O-CB 3.49Å; M403-S407 PolarHBondContact O-N 3.05Å; E404-S407 PolarHBondContact O-N 3.29Å; I405-S407 VanDerWaalsContact C-N 3.29Å; I405-S407 PolarHBondContact O-N 3.06Å
408	N	90	Very high	86.3	Confident	48 Å²	48	61.8 Å²	61.8	26%	0.257	35%	0.348	S	S	.	.	H	α-helix	trans	-79.5	-35.8	177.7	-70	-20.8	0	0	0	112.3	E404 I405 E406 P415 C419	E404-N408 PolarHBondContact O-N 2.84Å; E404-N408 PolarHBondContact O-ND2 3.31Å; I405-N408 PolarHBondContact O-N 3.29Å; E406-N408 VanDerWaalsContact C-N 3.3Å; E406-N408 PolarHBondContact O-N 3.22Å; N408-P415 WeakPolarHBondContact O-CA 3.41Å; N408-C419 HydrophobicContact CB-CB 4.17Å; N408-C419 VanDerWaalsContact CB-SG 3.51Å; N408-C419 PolarHBondContact ND2-O 2.87Å; N408-C419 VanDerWaalsContact ND2-O 3.11Å
409	I	90.6	Very high	86.7	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-76.3	-39.2	179.4	-66.1	177.9	0	0	0	111.4	Q376 A379 M380 Y383 I405 E406 R411 F420	Q376-I409 HydrophobicContact CG-CG2 3.91Å; Q376-I409 PolarHBondContact NE2-O 3.12Å; A379-I409 HydrophobicContact CB-CD1 3.91Å; A379-I409 HydrophobicContact CB-CG1 3.9Å; M380-I409 HydrophobicContact CG-CG2 4.21Å; M380-I409 HydrophobicContact SD-CG2 3.93Å; Y383-I409 HydrophobicContact CD2-CD1 4.47Å; Y383-I409 HydrophobicContact CG-CD1 4.42Å; I405-I409 HydrophobicContact CG2-CD1 3.61Å; I405-I409 HydrophobicContact CG2-CG1 4.15Å; I405-I409 WeakPolarHBondContact O-CG1 3.48Å; I405-I409 PolarHBondContact O-N 3.05Å; E406-I409 PolarHBondContact O-N 3.34Å; I409-R411 PolarHBondContact O-N 3.49Å; I409-F420 HydrophobicContact CD1-CZ 4.22Å
410	C	87.3	Confident	87.1	Confident	100 Å²	100	55.9 Å²	55.9	68%	0.676	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	16.3	-179.3	-66.1	0	0	0	0	114.4	E406	E406-C410 WeakPolarHBondContact O-CB 3.26Å; E406-C410 PolarHBondContact O-N 3.45Å; E406-C410 PolarHBondContact O-SG 3.18Å
411	R	86.7	Confident	87.2	Confident	118 Å²	118	54.7 Å²	54.7	45%	0.445	30%	0.3	S	S	.	.	S	Bend	trans	-73.8	144.7	-177.6	-152.1	-166.2	81.2	161.7	1.2	112.3	I409 G413 G414	I409-R411 PolarHBondContact O-N 3.49Å; R411-G413 PolarHBondContact O-N 2.94Å; R411-G414 WeakPolarHBondContact O-CA 3.5Å; R411-G414 PolarHBondContact O-N 3.1Å
412	E	75.1	Confident	87.2	Confident	184 Å²	184	56.1 Å²	56.1	86%	0.86	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	130.7	166.1	-65.9	-175.1	-179	0	0	110.5	G414	E412-G414 VanDerWaalsContact C-N 3.35Å
413	G	77	Confident	87.2	Confident	60 Å²	60	54.4 Å²	54.4	62%	0.619	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	4.2	-171	0	0	0	0	0	115.4	G372 R411	G372-G413 WeakPolarHBondContact CA-O 3.42Å; R411-G413 PolarHBondContact O-N 2.94Å
414	G	83.1	Confident	87.3	Confident	5 Å²	5	49.3 Å²	49.3	5%	0.052	28%	0.278	C	S	.	.			trans	82.6	176.5	-179.6	0	0	0	0	0	114.1	R411 E412	R411-G414 WeakPolarHBondContact O-CA 3.5Å; R411-G414 PolarHBondContact O-N 3.1Å; E412-G414 VanDerWaalsContact C-N 3.35Å
415	P	88.3	Confident	87.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.277	C	S	.	.			trans	-64	149.1	-179.2	25.5	-33.6	0	0	0	112.2	F359 Y370 A375 A379 N408 C419	F359-P415 HydrophobicContact CZ-CB 4.33Å; F359-P415 HydrophobicContact CZ-CG 4.02Å; Y370-P415 VanDerWaalsContact CE2-O 3.32Å; Y370-P415 WeakPolarHBondContact CE2-O 3.47Å; Y370-P415 PolarHBondContact OH-O 3.23Å; A375-P415 HydrophobicContact CB-CG 4.02Å; A375-P415 WeakPolarHBondContact O-CG 3.26Å; A379-P415 HydrophobicContact CB-CB 4.47Å; A379-P415 HydrophobicContact CB-CG 4Å; N408-P415 WeakPolarHBondContact O-CA 3.41Å; P415-C419 HydrophobicContact CB-CB 4.02Å
416	L	87.4	Confident	87	Confident	58 Å²	58	50.8 Å²	50.8	30%	0.304	28%	0.281	S	S	.	.			trans	-85.3	164.2	171.3	-77.7	-174.7	0	0	0	111.9	D418 C419	L416-D418 WeakPolarHBondContact CB-OD1 3.41Å; L416-D418 WeakPolarHBondContact CD1-OD1 3.25Å; L416-D418 PolarHBondContact O-N 2.88Å; L416-D418 VanDerWaalsContact O-N 3.16Å; L416-C419 WeakPolarHBondContact O-CB 3.41Å; L416-C419 PolarHBondContact O-N 2.89Å; L416-C419 VanDerWaalsContact O-N 3.11Å
417	P	85.7	Confident	87	Confident	38 Å²	38	47.1 Å²	47.1	25%	0.247	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-52.3	-33.6	169.7	-20.6	26.9	0	0	0	113.3	Q360 L363 A364 C419	Q360-P417 WeakPolarHBondContact CB-O 3.47Å; Q360-P417 VanDerWaalsContact CD-O 3.31Å; Q360-P417 WeakPolarHBondContact CG-O 3.44Å; Q360-P417 PolarHBondContact NE2-O 2.66Å; L363-P417 HydrophobicContact CB-CB 4.09Å; L363-P417 HydrophobicContact CB-CG 3.87Å; A364-P417 HydrophobicContact CB-CB 4.34Å; P417-C419 VanDerWaalsContact C-N 3.32Å; P417-C419 PolarHBondContact O-N 3.13Å
418	D	85.8	Confident	86.9	Confident	91 Å²	91	44.7 Å²	44.7	49%	0.487	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-82.6	0.8	-177.5	60.7	-1.8	0	0	0	114.7	L416 F420 T421	L416-D418 WeakPolarHBondContact CB-OD1 3.41Å; L416-D418 WeakPolarHBondContact CD1-OD1 3.25Å; L416-D418 PolarHBondContact O-N 2.88Å; L416-D418 VanDerWaalsContact O-N 3.16Å; D418-F420 PolarHBondContact O-N 3Å; D418-T421 VanDerWaalsContact CA-OG1 3.27Å; D418-T421 WeakPolarHBondContact CA-OG1 3.4Å; D418-T421 WeakPolarHBondContact CB-OG1 3.35Å; D418-T421 VanDerWaalsContact O-CB 3.28Å; D418-T421 WeakPolarHBondContact O-CB 3.25Å; D418-T421 PolarHBondContact O-N 3.21Å; D418-T421 PolarHBondContact O-OG1 3.41Å
419	C	88.8	Confident	86.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-47.2	-36.9	-176.6	179.2	0	0	0	0	115.2	F359 N408 P415 L416 P417	F359-C419 HydrophobicContact CE1-CB 4.4Å; N408-C419 HydrophobicContact CB-CB 4.17Å; N408-C419 VanDerWaalsContact CB-SG 3.51Å; N408-C419 PolarHBondContact ND2-O 2.87Å; N408-C419 VanDerWaalsContact ND2-O 3.11Å; P415-C419 HydrophobicContact CB-CB 4.02Å; L416-C419 WeakPolarHBondContact O-CB 3.41Å; L416-C419 PolarHBondContact O-N 2.89Å; L416-C419 VanDerWaalsContact O-N 3.11Å; P417-C419 VanDerWaalsContact C-N 3.32Å; P417-C419 PolarHBondContact O-N 3.13Å
420	F	90.8	Very high	86.6	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-106.2	14.2	-178.5	-63.2	-73.9	0	0	0	114	F352 A356 F359 A379 L382 F387 I405 I409 D418 T422 P423 L424	F352-F420 HydrophobicContact CE2-CD1 4.41Å; A356-F420 HydrophobicContact CB-CB 4.09Å; A356-F420 HydrophobicContact CB-CG 4.3Å; F359-F420 AromaticContact CD1-CD2 3.74Å; F359-F420 HydrophobicContact CD1-CD2 3.74Å; F359-F420 AromaticContact CD1-CE2 3.87Å; F359-F420 HydrophobicContact CD1-CE2 3.87Å; F359-F420 AromaticContact CE1-CD2 3.91Å; F359-F420 HydrophobicContact CE1-CD2 3.91Å; F359-F420 AromaticContact CE1-CE2 3.8Å; F359-F420 HydrophobicContact CE1-CE2 3.8Å; F359-F420 HydrophobicContact CG-CD2 4.49Å; F359-F420 HydrophobicContact CG-CE2 4.38Å; F359-F420 HydrophobicContact CZ-CE2 4.26Å; A379-F420 HydrophobicContact CB-CE2 3.93Å; A379-F420 HydrophobicContact CB-CZ 3.91Å; L382-F420 HydrophobicContact CB-CE1 4.24Å; L382-F420 HydrophobicContact CB-CE2 4.48Å; L382-F420 HydrophobicContact CB-CZ 3.88Å; L382-F420 HydrophobicContact CD1-CD2 4.21Å; L382-F420 HydrophobicContact CD1-CE2 3.73Å; L382-F420 HydrophobicContact CD1-CZ 3.99Å; F387-F420 HydrophobicContact CE2-CD1 4.41Å; F387-F420 HydrophobicContact CE2-CE1 4.3Å; I405-F420 HydrophobicContact CG2-CD1 4.33Å; I405-F420 HydrophobicContact CG2-CE1 3.77Å; I409-F420 HydrophobicContact CD1-CZ 4.22Å; D418-F420 PolarHBondContact O-N 3Å; F420-T422 PolarHBondContact O-N 3.42Å; F420-P423 HydrophobicContact CB-CG 4.2Å; F420-P423 HydrophobicContact CD1-CG 4.31Å; F420-P423 VanDerWaalsContact O-CD 3.23Å; F420-P423 WeakPolarHBondContact O-CD 3.48Å; F420-P423 VanDerWaalsContact O-CG 3.25Å; F420-P423 WeakPolarHBondContact O-CG 3.48Å; F420-L424 HydrophobicContact CB-CD1 4.05Å; F420-L424 HydrophobicContact CB-CG 4.34Å; F420-L424 WeakPolarHBondContact O-CB 3.39Å; F420-L424 WeakPolarHBondContact O-CD1 3.23Å; F420-L424 VanDerWaalsContact O-CG 3.31Å; F420-L424 WeakPolarHBondContact O-CG 3.28Å; F420-L424 PolarHBondContact O-N 3.29Å
421	T	88.6	Confident	86.8	Confident	43 Å²	43	40.3 Å²	40.3	26%	0.264	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-40.3	-173.3	-57.5	0	0	0	0	113.4	Q360 D418 R425	Q360-T421 PolarHBondContact NE2-OG1 3.23Å; D418-T421 VanDerWaalsContact CA-OG1 3.27Å; D418-T421 WeakPolarHBondContact CA-OG1 3.4Å; D418-T421 WeakPolarHBondContact CB-OG1 3.35Å; D418-T421 VanDerWaalsContact O-CB 3.28Å; D418-T421 WeakPolarHBondContact O-CB 3.25Å; D418-T421 PolarHBondContact O-N 3.21Å; D418-T421 PolarHBondContact O-OG1 3.41Å; T421-R425 WeakPolarHBondContact O-CB 3.35Å; T421-R425 PolarHBondContact O-N 2.6Å
422	T	88.1	Confident	86.8	Confident	42 Å²	42	36.6 Å²	36.6	26%	0.258	20%	0.201	S	C	.	.	H	α-helix	trans	-65.5	-56.1	178.3	-61.8	0	0	0	0	112.3	V401 E404 F420 L424 R425 Q426	V401-T422 HydrophobicContact CG1-CG2 4.47Å; V401-T422 HydrophobicContact CG2-CG2 4.31Å; E404-T422 WeakPolarHBondContact OE1-CB 3.07Å; E404-T422 PolarHBondContact OE1-OG1 2.94Å; F420-T422 PolarHBondContact O-N 3.42Å; T422-L424 VanDerWaalsContact C-N 3.32Å; T422-L424 PolarHBondContact O-N 2.95Å; T422-R425 PolarHBondContact O-N 3.1Å; T422-Q426 WeakPolarHBondContact O-CB 3.21Å; T422-Q426 PolarHBondContact O-N 3.06Å; T422-Q426 VanDerWaalsContact O-N 3.1Å
423	P	89.3	Confident	87.4	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-29.9	176.9	28.4	-38.4	0	0	0	113.4	F352 F387 F397 V401 I405 F420 Q426 A427	F352-P423 HydrophobicContact CE1-CB 4.05Å; F352-P423 HydrophobicContact CZ-CB 3.8Å; F352-P423 HydrophobicContact CZ-CG 3.98Å; F387-P423 HydrophobicContact CE1-CB 3.67Å; F387-P423 HydrophobicContact CE1-CG 4.09Å; F387-P423 HydrophobicContact CZ-CB 3.64Å; F387-P423 HydrophobicContact CZ-CG 3.88Å; F397-P423 HydrophobicContact CD1-CB 4.2Å; F397-P423 HydrophobicContact CE1-CB 3.52Å; F397-P423 HydrophobicContact CE2-CB 4.15Å; F397-P423 HydrophobicContact CZ-CB 3.49Å; F397-P423 VanDerWaalsContact CZ-CB 3.49Å; V401-P423 HydrophobicContact CG1-CB 4.08Å; V401-P423 HydrophobicContact CG1-CG 4.45Å; I405-P423 HydrophobicContact CD1-CB 4.36Å; I405-P423 HydrophobicContact CD1-CG 3.78Å; I405-P423 HydrophobicContact CG1-CG 4.31Å; F420-P423 HydrophobicContact CB-CG 4.2Å; F420-P423 HydrophobicContact CD1-CG 4.31Å; F420-P423 VanDerWaalsContact O-CD 3.23Å; F420-P423 WeakPolarHBondContact O-CD 3.48Å; F420-P423 VanDerWaalsContact O-CG 3.25Å; F420-P423 WeakPolarHBondContact O-CG 3.48Å; P423-Q426 PolarHBondContact O-N 3.32Å; P423-A427 WeakPolarHBondContact O-CB 3.44Å; P423-A427 PolarHBondContact O-N 3.26Å
424	L	89.8	Confident	87.9	Confident	10 Å²	10	35.3 Å²	35.3	5%	0.052	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-46.4	173.2	-85.3	166.7	0	0	0	112.3	F352 W353 A356 D357 Q360 F420 T422 Q426 A427 W428	F352-L424 HydrophobicContact CZ-CG 4.36Å; W353-L424 HydrophobicContact CB-CD2 4.37Å; W353-L424 VanDerWaalsContact CD1-CD2 3.41Å; W353-L424 HydrophobicContact CD2-CD2 4.47Å; W353-L424 HydrophobicContact CG-CD2 3.89Å; W353-L424 WeakPolarHBondContact O-CD2 3.34Å; A356-L424 HydrophobicContact CB-CD1 4Å; A356-L424 HydrophobicContact CB-CD2 3.77Å; A356-L424 HydrophobicContact CB-CG 3.89Å; D357-L424 HydrophobicContact CB-CD2 4.42Å; Q360-L424 HydrophobicContact CG-CD1 3.68Å; F420-L424 HydrophobicContact CB-CD1 4.05Å; F420-L424 HydrophobicContact CB-CG 4.34Å; F420-L424 WeakPolarHBondContact O-CB 3.39Å; F420-L424 WeakPolarHBondContact O-CD1 3.23Å; F420-L424 VanDerWaalsContact O-CG 3.31Å; F420-L424 WeakPolarHBondContact O-CG 3.28Å; F420-L424 PolarHBondContact O-N 3.29Å; T422-L424 VanDerWaalsContact C-N 3.32Å; T422-L424 PolarHBondContact O-N 2.95Å; L424-Q426 VanDerWaalsContact C-N 3.26Å; L424-Q426 PolarHBondContact O-N 2.85Å; L424-A427 PolarHBondContact O-N 3.12Å; L424-W428 WeakPolarHBondContact O-CB 3.42Å; L424-W428 PolarHBondContact O-N 2.88Å
425	R	87	Confident	88.3	Confident	84 Å²	84	36.6 Å²	36.6	32%	0.317	19%	0.186	S	C	.	.	H	α-helix	trans	-59.2	-40.8	174.8	-175.1	-165	-54.5	-159.3	1.5	111.4	V90 Y92 T421 T422 T429	V90-R425 PolarHBondContact O-NH1 3.22Å; Y92-R425 HydrophobicContact CG-CG 4.3Å; T421-R425 WeakPolarHBondContact O-CB 3.35Å; T421-R425 PolarHBondContact O-N 2.6Å; T422-R425 PolarHBondContact O-N 3.1Å; R425-T429 WeakPolarHBondContact O-CB 3.41Å; R425-T429 PolarHBondContact O-N 2.96Å; R425-T429 PolarHBondContact O-OG1 3.14Å
426	Q	86.9	Confident	88.3	Confident	19 Å²	19	37 Å²	37	9%	0.089	19%	0.188	C	C	.	.	H	α-helix	trans	-69.3	-47.6	-178.7	-169.9	172.9	5	0	0	111.3	L85 F397 T422 P423 L424 W428 T429 T430	L85-Q426 HydrophobicContact CB-CG 3.99Å; L85-Q426 WeakPolarHBondContact O-CG 3.5Å; L85-Q426 PolarHBondContact O-NE2 3.22Å; F397-Q426 HydrophobicContact CD1-CG 4.39Å; F397-Q426 HydrophobicContact CE1-CB 4.14Å; F397-Q426 HydrophobicContact CE1-CG 3.99Å; T422-Q426 WeakPolarHBondContact O-CB 3.21Å; T422-Q426 PolarHBondContact O-N 3.06Å; T422-Q426 VanDerWaalsContact O-N 3.1Å; P423-Q426 PolarHBondContact O-N 3.32Å; L424-Q426 VanDerWaalsContact C-N 3.26Å; L424-Q426 PolarHBondContact O-N 2.85Å; Q426-W428 PolarHBondContact O-N 2.94Å; Q426-T429 PolarHBondContact O-N 3.01Å; Q426-T430 PolarHBondContact O-N 3.24Å; Q426-T430 PolarHBondContact O-OG1 3.35Å
427	A	89.9	Confident	88.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-43.3	172.4	0	0	0	0	0	112.6	I349 F352 W353 P423 L424 T430 M431	I349-A427 HydrophobicContact CG2-CB 3.87Å; F352-A427 HydrophobicContact CD1-CB 3.96Å; F352-A427 HydrophobicContact CE1-CB 3.98Å; W353-A427 HydrophobicContact CB-CB 4.46Å; P423-A427 WeakPolarHBondContact O-CB 3.44Å; P423-A427 PolarHBondContact O-N 3.26Å; L424-A427 PolarHBondContact O-N 3.12Å; A427-T430 PolarHBondContact O-N 3.36Å; A427-M431 WeakPolarHBondContact O-CG 3.16Å; A427-M431 PolarHBondContact O-N 2.95Å
428	W	88.6	Confident	88.6	Confident	35 Å²	35	36.7 Å²	36.7	13%	0.133	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-48.6	172.6	178.4	-80.2	0	0	0	111.9	L324 A325 L328 W353 L424 Q426 T430 M431 E432	L324-W428 HydrophobicContact CB-CH2 4.16Å; L324-W428 HydrophobicContact CB-CZ2 3.86Å; L324-W428 HydrophobicContact CD2-CD2 3.7Å; L324-W428 HydrophobicContact CD2-CE3 3.83Å; L324-W428 HydrophobicContact CD2-CG 4.15Å; L324-W428 HydrophobicContact CD2-CH2 4.42Å; L324-W428 HydrophobicContact CD2-CZ2 4.27Å; L324-W428 HydrophobicContact CD2-CZ3 4.21Å; L324-W428 HydrophobicContact CG-CE3 4.42Å; L324-W428 HydrophobicContact CG-CH2 4.24Å; L324-W428 HydrophobicContact CG-CZ2 4.28Å; L324-W428 HydrophobicContact CG-CZ3 4.29Å; A325-W428 HydrophobicContact CB-CH2 3.83Å; A325-W428 HydrophobicContact CB-CZ2 4.33Å; L328-W428 HydrophobicContact CD1-CE3 4.23Å; L328-W428 HydrophobicContact CD1-CZ3 3.93Å; W353-W428 AromaticContact CE2-CE3 3.67Å; W353-W428 HydrophobicContact CH2-CE3 4.34Å; W353-W428 HydrophobicContact CH2-CZ3 4Å; W353-W428 AromaticContact CZ2-CE3 3.51Å; W353-W428 HydrophobicContact CZ2-CE3 3.51Å; W353-W428 AromaticContact CZ2-CZ3 3.56Å; W353-W428 HydrophobicContact CZ2-CZ3 3.56Å; W353-W428 AromaticContact NE1-CE3 3.74Å; L424-W428 WeakPolarHBondContact O-CB 3.42Å; L424-W428 PolarHBondContact O-N 2.88Å; Q426-W428 PolarHBondContact O-N 2.94Å; W428-T430 VanDerWaalsContact C-N 3.3Å; W428-T430 PolarHBondContact O-N 3.45Å; W428-M431 PolarHBondContact O-N 3.01Å; W428-E432 WeakPolarHBondContact O-CB 3.39Å; W428-E432 PolarHBondContact O-N 3.16Å
429	T	86.6	Confident	88.9	Confident	33 Å²	33	32.4 Å²	32.4	20%	0.202	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-41.9	-178.9	-57.6	0	0	0	0	110.9	R425 Q426 E432 K433	R425-T429 WeakPolarHBondContact O-CB 3.41Å; R425-T429 PolarHBondContact O-N 2.96Å; R425-T429 PolarHBondContact O-OG1 3.14Å; Q426-T429 PolarHBondContact O-N 3.01Å; T429-E432 PolarHBondContact O-N 3.16Å; T429-K433 HydrophobicContact CG2-CG 4.16Å; T429-K433 WeakPolarHBondContact O-CB 3.47Å; T429-K433 WeakPolarHBondContact O-CG 3.32Å; T429-K433 PolarHBondContact O-N 2.92Å
430	T	88.8	Confident	88.9	Confident	26 Å²	26	34.6 Å²	34.6	16%	0.16	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-46.6	175.2	-58.4	0	0	0	0	112.1	L85 I349 Q426 A427 W428 E432 V434 Y435	L85-T430 HydrophobicContact CD2-CG2 3.95Å; L85-T430 WeakPolarHBondContact CD2-OG1 3.39Å; I349-T430 HydrophobicContact CD1-CG2 4.26Å; Q426-T430 PolarHBondContact O-N 3.24Å; Q426-T430 PolarHBondContact O-OG1 3.35Å; A427-T430 PolarHBondContact O-N 3.36Å; W428-T430 VanDerWaalsContact C-N 3.3Å; W428-T430 PolarHBondContact O-N 3.45Å; T430-E432 VanDerWaalsContact C-N 3.32Å; T430-E432 PolarHBondContact O-N 2.96Å; T430-V434 HydrophobicContact CG2-CB 4.4Å; T430-V434 HydrophobicContact CG2-CG2 4.09Å; T430-V434 WeakPolarHBondContact O-CA 3.32Å; T430-V434 VanDerWaalsContact O-CB 3.27Å; T430-V434 WeakPolarHBondContact O-CB 3.49Å; T430-V434 PolarHBondContact O-N 3Å; T430-Y435 HydrophobicContact CG2-CD2 4.24Å; T430-Y435 HydrophobicContact CG2-CE2 3.85Å; T430-Y435 PolarHBondContact O-N 3.33Å
431	M	90.6	Very high	88.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	I	π-helix	trans	-60.5	-39.4	175.3	-72.9	-170.2	-67.7	0	0	112.5	L324 L328 F337 M341 I349 L350 W353 A427 W428 Y435 L436	L324-M431 HydrophobicContact CD1-CB 4.19Å; L324-M431 HydrophobicContact CD2-CB 3.5Å; L324-M431 HydrophobicContact CD2-CE 4.39Å; L328-M431 HydrophobicContact CD1-CE 4.09Å; F337-M431 HydrophobicContact CE1-SD 4.16Å; M341-M431 HydrophobicContact CE-CG 3.89Å; M341-M431 HydrophobicContact CE-SD 4.11Å; I349-M431 HydrophobicContact CG2-CG 3.89Å; I349-M431 HydrophobicContact CG2-SD 4.27Å; L350-M431 HydrophobicContact CB-SD 4.27Å; L350-M431 HydrophobicContact CD1-SD 4Å; W353-M431 HydrophobicContact CB-CE 3.57Å; W353-M431 HydrophobicContact CD2-CE 3.98Å; W353-M431 HydrophobicContact CG-CE 3.47Å; W353-M431 VanDerWaalsContact CG-CE 3.47Å; A427-M431 WeakPolarHBondContact O-CG 3.16Å; A427-M431 PolarHBondContact O-N 2.95Å; W428-M431 PolarHBondContact O-N 3.01Å; M431-Y435 PolarHBondContact O-N 3.2Å; M431-L436 VanDerWaalsContact O-CB 3.32Å; M431-L436 WeakPolarHBondContact O-CB 3.35Å; M431-L436 PolarHBondContact O-N 3.34Å
432	E	86.9	Confident	89	Confident	40 Å²	40	37.1 Å²	37.1	19%	0.187	20%	0.201	C	C	.	.	I	π-helix	trans	-79.1	-33.1	-177.4	-169.6	-179.8	-128.1	0	0	113.4	L324 W428 T429 T430 L436	L324-E432 HydrophobicContact CB-CB 4.08Å; L324-E432 HydrophobicContact CB-CG 4.09Å; L324-E432 HydrophobicContact CD2-CB 3.97Å; W428-E432 WeakPolarHBondContact O-CB 3.39Å; W428-E432 PolarHBondContact O-N 3.16Å; T429-E432 PolarHBondContact O-N 3.16Å; T430-E432 VanDerWaalsContact C-N 3.32Å; T430-E432 PolarHBondContact O-N 2.96Å; E432-L436 HydrophobicContact CG-CD2 4.17Å
433	K	87	Confident	89.1	Confident	136 Å²	136	41.9 Å²	41.9	59%	0.591	23%	0.225	S	C	*	.	I	π-helix	trans	-98.3	-27.8	-175.7	-57.1	-45.6	-177	-140.9	0	114.4	T429	T429-K433 HydrophobicContact CG2-CG 4.16Å; T429-K433 WeakPolarHBondContact O-CB 3.47Å; T429-K433 WeakPolarHBondContact O-CG 3.32Å; T429-K433 PolarHBondContact O-N 2.92Å
434	V	88.8	Confident	89.2	Confident	81 Å²	81	42.6 Å²	42.6	49%	0.491	23%	0.229	S	C	.	.	I	π-helix	trans	-100.8	-57.9	-179	-172.9	0	0	0	0	110.7	T430	T430-V434 HydrophobicContact CG2-CB 4.4Å; T430-V434 HydrophobicContact CG2-CG2 4.09Å; T430-V434 WeakPolarHBondContact O-CA 3.32Å; T430-V434 VanDerWaalsContact O-CB 3.27Å; T430-V434 WeakPolarHBondContact O-CB 3.49Å; T430-V434 PolarHBondContact O-N 3Å
435	Y	90.3	Very high	89.1	Confident	33 Å²	33	42.7 Å²	42.7	13%	0.129	23%	0.229	C	C	.	.	I	π-helix	trans	-87.1	-38.4	-168.2	-63.6	-71.4	0	0	0	114.2	Y340 M341 E344 A346 I349 T430 M431 G438 F439	Y340-Y435 HydrophobicContact CE1-CD1 4.43Å; Y340-Y435 VanDerWaalsContact CE1-O 3.28Å; Y340-Y435 WeakPolarHBondContact CE1-O 3.39Å; M341-Y435 HydrophobicContact CE-CD2 4.11Å; M341-Y435 HydrophobicContact CE-CG 4.3Å; M341-Y435 HydrophobicContact SD-CD1 4.03Å; M341-Y435 HydrophobicContact SD-CD2 4.06Å; M341-Y435 HydrophobicContact SD-CG 3.64Å; E344-Y435 HydrophobicContact CB-CD1 4.11Å; E344-Y435 HydrophobicContact CB-CE1 3.85Å; E344-Y435 HydrophobicContact CG-CD1 4.33Å; E344-Y435 HydrophobicContact CG-CE1 4.48Å; A346-Y435 HydrophobicContact CB-CD1 4.15Å; A346-Y435 HydrophobicContact CB-CD2 4.45Å; A346-Y435 HydrophobicContact CB-CE1 3.54Å; A346-Y435 HydrophobicContact CB-CE2 3.87Å; A346-Y435 WeakPolarHBondContact CB-OH 3.32Å; I349-Y435 HydrophobicContact CD1-CE2 3.86Å; T430-Y435 HydrophobicContact CG2-CD2 4.24Å; T430-Y435 HydrophobicContact CG2-CE2 3.85Å; T430-Y435 PolarHBondContact O-N 3.33Å; M431-Y435 PolarHBondContact O-N 3.2Å; Y435-G438 PolarHBondContact O-N 3.38Å; Y435-F439 WeakPolarHBondContact O-CB 3.47Å; Y435-F439 PolarHBondContact O-N 3.06Å
436	L	89.4	Confident	89.1	Confident	8 Å²	8	45 Å²	45	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-43.5	-179.6	-179.9	68.4	0	0	0	113.5	L324 I327 M431 E432 G438 F439 L440	L324-L436 HydrophobicContact CB-CD2 4.09Å; I327-L436 HydrophobicContact CG1-CD1 3.93Å; M431-L436 VanDerWaalsContact O-CB 3.32Å; M431-L436 WeakPolarHBondContact O-CB 3.35Å; M431-L436 PolarHBondContact O-N 3.34Å; E432-L436 HydrophobicContact CG-CD2 4.17Å; L436-G438 VanDerWaalsContact C-N 3.32Å; L436-G438 PolarHBondContact O-N 3.38Å; L436-F439 HydrophobicContact CD1-CD1 4.31Å; L436-F439 PolarHBondContact O-N 2.83Å; L436-L440 HydrophobicContact CD1-CD1 4.06Å; L436-L440 HydrophobicContact CD1-CD2 4.47Å; L436-L440 HydrophobicContact CD1-CG 4.05Å; L436-L440 HydrophobicContact CG-CD1 3.94Å; L436-L440 HydrophobicContact CG-CG 4.34Å; L436-L440 VanDerWaalsContact O-CG 3.27Å; L436-L440 WeakPolarHBondContact O-CG 3.44Å; L436-L440 PolarHBondContact O-N 2.79Å
437	P	89.5	Confident	89.2	Confident	71 Å²	71	48.3 Å²	48.3	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-38.2	175.4	-22.3	34.9	0	0	0	112.7	S441	P437-S441 PolarHBondContact O-N 3.37Å; P437-S441 PolarHBondContact O-OG 2.86Å
438	G	90	Very high	89.1	Confident	19 Å²	19	48.5 Å²	48.5	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-52.5	173.5	0	0	0	0	0	111.4	Y340 Y435 L436 L440 S441 S442	Y340-G438 WeakPolarHBondContact OH-CA 3.24Å; Y435-G438 PolarHBondContact O-N 3.38Å; L436-G438 VanDerWaalsContact C-N 3.32Å; L436-G438 PolarHBondContact O-N 3.38Å; G438-L440 PolarHBondContact O-N 3.37Å; G438-S441 CarbonylContact O-C 3.58Å; G438-S441 PolarHBondContact O-N 2.87Å; G438-S441 PolarHBondContact O-OG 3.46Å; G438-S442 PolarHBondContact O-N 3.22Å; G438-S442 VanDerWaalsContact O-N 3.11Å
439	F	91.9	Very high	89	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-52.1	-51.9	176.5	176.4	-118.4	0	0	0	112.5	I327 Y336 F337 Y340 Y435 L436 S441 S442 I444 Y445	I327-F439 HydrophobicContact CD1-CE1 4.03Å; I327-F439 HydrophobicContact CG1-CE1 4.28Å; I327-F439 HydrophobicContact CG2-CE1 4.05Å; Y336-F439 WeakPolarHBondContact O-CE2 3.48Å; F337-F439 HydrophobicContact CB-CE1 4.46Å; F337-F439 HydrophobicContact CB-CE2 4.37Å; F337-F439 HydrophobicContact CB-CZ 4.2Å; F337-F439 HydrophobicContact CD2-CB 4.03Å; F337-F439 AromaticContact CD2-CD1 3.77Å; F337-F439 HydrophobicContact CD2-CD1 3.77Å; F337-F439 HydrophobicContact CD2-CD2 4.02Å; F337-F439 HydrophobicContact CD2-CE1 4.16Å; F337-F439 HydrophobicContact CD2-CE2 4.4Å; F337-F439 AromaticContact CD2-CG 3.66Å; F337-F439 HydrophobicContact CD2-CG 3.66Å; F337-F439 HydrophobicContact CD2-CZ 4.45Å; F337-F439 HydrophobicContact CE2-CB 4.06Å; F337-F439 HydrophobicContact CE2-CD1 4.4Å; F337-F439 HydrophobicContact CE2-CG 4.2Å; Y340-F439 HydrophobicContact CD1-CB 3.59Å; Y340-F439 HydrophobicContact CD1-CD2 4Å; Y340-F439 HydrophobicContact CD1-CG 4.21Å; Y340-F439 HydrophobicContact CD2-CD2 4.47Å; Y340-F439 HydrophobicContact CE1-CB 3.75Å; Y340-F439 HydrophobicContact CG-CB 4.12Å; Y340-F439 AromaticContact CG-CD2 3.77Å; Y340-F439 HydrophobicContact CG-CD2 3.77Å; Y340-F439 HydrophobicContact CG-CG 4.41Å; Y435-F439 WeakPolarHBondContact O-CB 3.47Å; Y435-F439 PolarHBondContact O-N 3.06Å; L436-F439 HydrophobicContact CD1-CD1 4.31Å; L436-F439 PolarHBondContact O-N 2.83Å; F439-S441 PolarHBondContact O-N 2.92Å; F439-S441 VanDerWaalsContact O-N 3.16Å; F439-S442 VanDerWaalsContact O-CB 3.25Å; F439-S442 WeakPolarHBondContact O-CB 3.29Å; F439-S442 PolarHBondContact O-N 3.11Å; F439-S442 PolarHBondContact O-OG 3Å; F439-I444 HydrophobicContact CE2-CG2 4.38Å; F439-Y445 HydrophobicContact CD1-CD2 4.18Å; F439-Y445 AromaticContact CE1-CD2 3.55Å; F439-Y445 HydrophobicContact CE1-CD2 3.55Å; F439-Y445 HydrophobicContact CE1-CE2 4.19Å; F439-Y445 HydrophobicContact CE1-CG 4.34Å; F439-Y445 AromaticContact CZ-CD2 3.8Å; F439-Y445 HydrophobicContact CZ-CD2 3.8Å; F439-Y445 WeakPolarHBondContact O-CB 3.36Å
440	L	89.1	Confident	89	Confident	46 Å²	46	48.9 Å²	48.9	24%	0.241	26%	0.26	C	S	.	.	H	α-helix	trans	-64.2	-19.6	-178.5	-67	172.5	0	0	0	113.4	V322 L436 G438 Y445	V322-L440 HydrophobicContact CB-CD1 4.16Å; V322-L440 HydrophobicContact CB-CD2 4.13Å; V322-L440 HydrophobicContact CG1-CD2 4.13Å; V322-L440 HydrophobicContact CG2-CD2 4.35Å; L436-L440 HydrophobicContact CD1-CD1 4.06Å; L436-L440 HydrophobicContact CD1-CD2 4.47Å; L436-L440 HydrophobicContact CD1-CG 4.05Å; L436-L440 HydrophobicContact CG-CD1 3.94Å; L436-L440 HydrophobicContact CG-CG 4.34Å; L436-L440 VanDerWaalsContact O-CG 3.27Å; L436-L440 WeakPolarHBondContact O-CG 3.44Å; L436-L440 PolarHBondContact O-N 2.79Å; G438-L440 PolarHBondContact O-N 3.37Å; L440-Y445 HydrophobicContact CB-CD1 4.49Å; L440-Y445 HydrophobicContact CD2-CD1 4.08Å; L440-Y445 HydrophobicContact CD2-CD2 4.06Å; L440-Y445 HydrophobicContact CD2-CE1 3.65Å; L440-Y445 HydrophobicContact CD2-CE2 3.65Å; L440-Y445 HydrophobicContact CD2-CG 4.26Å; L440-Y445 VanDerWaalsContact CD2-CZ 3.42Å; L440-Y445 WeakPolarHBondContact O-CD1 3.45Å
441	S	88.7	Confident	88.9	Confident	80 Å²	80	50.7 Å²	50.7	56%	0.559	27%	0.269	S	S	*	.	H	α-helix	trans	-93.6	-7.7	172.3	75.9	0	0	0	0	114.1	P437 G438 F439	P437-S441 PolarHBondContact O-N 3.37Å; P437-S441 PolarHBondContact O-OG 2.86Å; G438-S441 CarbonylContact O-C 3.58Å; G438-S441 PolarHBondContact O-N 2.87Å; G438-S441 PolarHBondContact O-OG 3.46Å; F439-S441 PolarHBondContact O-N 2.92Å; F439-S441 VanDerWaalsContact O-N 3.16Å
442	S	91.6	Very high	88.5	Confident	17 Å²	17	51.5 Å²	51.5	12%	0.119	27%	0.273	C	S	.	.	S	Bend	trans	-83.2	153.2	-170.4	79.3	0	0	0	0	113.6	G438 F439 I444 Y445 Y446	G438-S442 PolarHBondContact O-N 3.22Å; G438-S442 VanDerWaalsContact O-N 3.11Å; F439-S442 VanDerWaalsContact O-CB 3.25Å; F439-S442 WeakPolarHBondContact O-CB 3.29Å; F439-S442 PolarHBondContact O-N 3.11Å; F439-S442 PolarHBondContact O-OG 3Å; S442-I444 PolarHBondContact O-N 3.03Å; S442-I444 VanDerWaalsContact O-N 3.09Å; S442-I444 PolarHBondContact OG-N 3.43Å; S442-Y445 PolarHBondContact O-N 3.13Å; S442-Y445 VanDerWaalsContact O-N 3.13Å; S442-Y445 PolarHBondContact OG-N 2.93Å; S442-Y446 WeakPolarHBondContact O-CD2 3.23Å; S442-Y446 PolarHBondContact O-N 3.07Å
443	N	89.9	Confident	88.3	Confident	142 Å²	142	52.1 Å²	52.1	76%	0.759	28%	0.278	S	S	*	.	H	α-helix	trans	-56.9	-23.9	170.7	-68.3	-35	0	0	0	113.2	K447	N443-K447 WeakPolarHBondContact O-CB 3.36Å; N443-K447 PolarHBondContact O-N 3.23Å
444	I	91.1	Very high	88	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-72.4	-40.3	-180	-51.8	175.5	0	0	0	110.1	Y336 E339 Y340 K343 F439 S442 K447 Y448	Y336-I444 HydrophobicContact CD1-CG2 3.85Å; Y336-I444 HydrophobicContact CG-CG2 4.45Å; Y336-I444 WeakPolarHBondContact O-CG2 3.35Å; E339-I444 HydrophobicContact CB-CG2 4.27Å; Y340-I444 HydrophobicContact CD2-CD1 4.07Å; K343-I444 HydrophobicContact CD-CD1 3.86Å; K343-I444 VanDerWaalsContact NZ-CD1 3.3Å; F439-I444 HydrophobicContact CE2-CG2 4.38Å; S442-I444 PolarHBondContact O-N 3.03Å; S442-I444 VanDerWaalsContact O-N 3.09Å; S442-I444 PolarHBondContact OG-N 3.43Å; I444-K447 WeakPolarHBondContact O-CB 3.33Å; I444-K447 PolarHBondContact O-N 2.85Å; I444-Y448 PolarHBondContact O-N 3.24Å
445	Y	88.1	Confident	87.6	Confident	12 Å²	12	49.6 Å²	49.6	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-38.7	174	-175.4	-113.5	0	0	0	112.3	L317 F439 L440 S442 K447 Y448 L449	L317-Y445 WeakPolarHBondContact CB-OH 3.35Å; L317-Y445 HydrophobicContact CD2-CE2 4.28Å; L317-Y445 PolarHBondContact O-OH 2.67Å; F439-Y445 HydrophobicContact CD1-CD2 4.18Å; F439-Y445 AromaticContact CE1-CD2 3.55Å; F439-Y445 HydrophobicContact CE1-CD2 3.55Å; F439-Y445 HydrophobicContact CE1-CE2 4.19Å; F439-Y445 HydrophobicContact CE1-CG 4.34Å; F439-Y445 AromaticContact CZ-CD2 3.8Å; F439-Y445 HydrophobicContact CZ-CD2 3.8Å; F439-Y445 WeakPolarHBondContact O-CB 3.36Å; L440-Y445 HydrophobicContact CB-CD1 4.49Å; L440-Y445 HydrophobicContact CD2-CD1 4.08Å; L440-Y445 HydrophobicContact CD2-CD2 4.06Å; L440-Y445 HydrophobicContact CD2-CE1 3.65Å; L440-Y445 HydrophobicContact CD2-CE2 3.65Å; L440-Y445 HydrophobicContact CD2-CG 4.26Å; L440-Y445 VanDerWaalsContact CD2-CZ 3.42Å; L440-Y445 WeakPolarHBondContact O-CD1 3.45Å; S442-Y445 PolarHBondContact O-N 3.13Å; S442-Y445 VanDerWaalsContact O-N 3.13Å; S442-Y445 PolarHBondContact OG-N 2.93Å; Y445-K447 VanDerWaalsContact C-N 3.34Å; Y445-K447 PolarHBondContact O-N 3.36Å; Y445-Y448 HydrophobicContact CD2-CD1 4.05Å; Y445-Y448 HydrophobicContact CE2-CD1 4.06Å; Y445-Y448 WeakPolarHBondContact O-CB 3.45Å; Y445-Y448 PolarHBondContact O-N 3.35Å; Y445-L449 HydrophobicContact CD1-CD1 4.03Å; Y445-L449 HydrophobicContact CD1-CG 4.49Å; Y445-L449 HydrophobicContact CE1-CD1 3.59Å; Y445-L449 HydrophobicContact CE1-CG 4.17Å; Y445-L449 HydrophobicContact CE2-CG 4.44Å; Y445-L449 WeakPolarHBondContact O-CG 3.2Å; Y445-L449 PolarHBondContact O-N 3.19Å
446	Y	86.8	Confident	86.4	Confident	133 Å²	133	48.6 Å²	48.6	52%	0.522	27%	0.271	S	S	.	.	H	α-helix	trans	-64.7	-36.3	172.8	-66.4	-60.9	0	0	0	112.8	S442 S450	S442-Y446 WeakPolarHBondContact O-CD2 3.23Å; S442-Y446 PolarHBondContact O-N 3.07Å; Y446-S450 WeakPolarHBondContact O-CB 3.47Å; Y446-S450 PolarHBondContact O-N 2.95Å
447	K	89.4	Confident	85.2	Confident	87 Å²	87	55.4 Å²	55.4	38%	0.378	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-50.3	170.2	176.7	-170.6	165	-155	0	110.9	Y336 E339 N443 I444 Y445 L449 S450 D451	Y336-K447 HydrophobicContact CE1-CD 3.91Å; Y336-K447 HydrophobicContact CE1-CG 4Å; E339-K447 IonicContact OE2-NZ 3.31Å; E339-K447 PolarHBondContact OE2-NZ 3.37Å; E339-K447 VanDerWaalsContact OE2-NZ 3.16Å; N443-K447 WeakPolarHBondContact O-CB 3.36Å; N443-K447 PolarHBondContact O-N 3.23Å; I444-K447 WeakPolarHBondContact O-CB 3.33Å; I444-K447 PolarHBondContact O-N 2.85Å; Y445-K447 VanDerWaalsContact C-N 3.34Å; Y445-K447 PolarHBondContact O-N 3.36Å; K447-L449 PolarHBondContact O-N 2.89Å; K447-S450 WeakPolarHBondContact O-CB 3.42Å; K447-S450 PolarHBondContact O-N 2.93Å; K447-S450 VanDerWaalsContact O-N 3.12Å; K447-D451 WeakPolarHBondContact CG-OD2 3.29Å; K447-D451 VanDerWaalsContact O-CG 3.3Å; K447-D451 PolarHBondContact O-N 3.47Å
448	Y	88.1	Confident	83.6	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-53	-49.6	175.9	173.5	-131.7	0	0	0	112.6	L317 S332 A333 Y336 I444 Y445 S450 D451 L452	L317-Y448 HydrophobicContact CD1-CD1 4.46Å; L317-Y448 HydrophobicContact CD1-CE1 3.5Å; L317-Y448 VanDerWaalsContact CD1-CE1 3.5Å; L317-Y448 HydrophobicContact CD2-CE1 4.25Å; S332-Y448 PolarHBondContact OG-OH 3.09Å; S332-Y448 VanDerWaalsContact OG-OH 3.1Å; A333-Y448 HydrophobicContact CB-CE1 3.78Å; Y336-Y448 AromaticContact CD2-CD2 3.33Å; Y336-Y448 HydrophobicContact CD2-CD2 3.33Å; Y336-Y448 HydrophobicContact CD2-CE2 4.14Å; Y336-Y448 AromaticContact CD2-CG 3.72Å; Y336-Y448 HydrophobicContact CD2-CG 3.72Å; Y336-Y448 AromaticContact CE2-CD2 3.46Å; Y336-Y448 HydrophobicContact CE2-CD2 3.46Å; Y336-Y448 VanDerWaalsContact CE2-CD2 3.46Å; Y336-Y448 HydrophobicContact CE2-CE2 4.3Å; Y336-Y448 HydrophobicContact CE2-CG 4.16Å; Y336-Y448 HydrophobicContact CG-CD2 4.12Å; Y336-Y448 HydrophobicContact CG-CG 4.05Å; I444-Y448 PolarHBondContact O-N 3.24Å; Y445-Y448 HydrophobicContact CD2-CD1 4.05Å; Y445-Y448 HydrophobicContact CE2-CD1 4.06Å; Y445-Y448 WeakPolarHBondContact O-CB 3.45Å; Y445-Y448 PolarHBondContact O-N 3.35Å; Y448-S450 PolarHBondContact O-N 3.39Å; Y448-D451 PolarHBondContact O-N 3.31Å; Y448-L452 HydrophobicContact CE2-CD2 4.5Å; Y448-L452 VanDerWaalsContact O-CB 3.28Å; Y448-L452 WeakPolarHBondContact O-CB 3.49Å; Y448-L452 PolarHBondContact O-N 3.33Å
449	L	86.8	Confident	81.5	Confident	22 Å²	22	57.4 Å²	57.4	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177.2	-70.2	178.7	0	0	0	112.3	L317 Y445 K447 I453	L317-L449 HydrophobicContact CB-CD2 3.87Å; L317-L449 HydrophobicContact CD1-CD2 4.19Å; Y445-L449 HydrophobicContact CD1-CD1 4.03Å; Y445-L449 HydrophobicContact CD1-CG 4.49Å; Y445-L449 HydrophobicContact CE1-CD1 3.59Å; Y445-L449 HydrophobicContact CE1-CG 4.17Å; Y445-L449 HydrophobicContact CE2-CG 4.44Å; Y445-L449 WeakPolarHBondContact O-CG 3.2Å; Y445-L449 PolarHBondContact O-N 3.19Å; K447-L449 PolarHBondContact O-N 2.89Å; L449-I453 WeakPolarHBondContact O-CB 3.35Å; L449-I453 WeakPolarHBondContact O-CD1 3.13Å; L449-I453 WeakPolarHBondContact O-CG1 3.33Å; L449-I453 PolarHBondContact O-N 2.93Å
450	S	85.9	Confident	79.5	Confident	54 Å²	54	62.4 Å²	62.4	38%	0.378	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-50.5	174.6	165.7	0	0	0	0	111.3	Y446 K447 Y448 L452 I453 N454	Y446-S450 WeakPolarHBondContact O-CB 3.47Å; Y446-S450 PolarHBondContact O-N 2.95Å; K447-S450 WeakPolarHBondContact O-CB 3.42Å; K447-S450 PolarHBondContact O-N 2.93Å; K447-S450 VanDerWaalsContact O-N 3.12Å; Y448-S450 PolarHBondContact O-N 3.39Å; S450-L452 PolarHBondContact O-N 2.8Å; S450-I453 PolarHBondContact O-N 3.12Å; S450-N454 WeakPolarHBondContact O-CB 3.41Å; S450-N454 PolarHBondContact O-N 2.95Å; S450-N454 PolarHBondContact O-ND2 3.44Å; S450-N454 VanDerWaalsContact O-ND2 3.08Å; S450-N454 PolarHBondContact OG-ND2 2.68Å
451	D	86.4	Confident	77.2	Confident	64 Å²	64	68 Å²	68	34%	0.342	36%	0.356	S	S	.	.	H	α-helix	trans	-69.8	-36	-174.5	-63.6	-18.2	0	0	0	111.3	Y336 K447 Y448 N454 S455	Y336-D451 PolarHBondContact OH-OD2 3.05Å; K447-D451 WeakPolarHBondContact CG-OD2 3.29Å; K447-D451 VanDerWaalsContact O-CG 3.3Å; K447-D451 PolarHBondContact O-N 3.47Å; Y448-D451 PolarHBondContact O-N 3.31Å; D451-N454 PolarHBondContact O-N 2.9Å; D451-S455 WeakPolarHBondContact O-CB 3.34Å; D451-S455 PolarHBondContact O-N 3.26Å
452	L	83.4	Confident	75.1	Confident	17 Å²	17	69.8 Å²	69.8	9%	0.089	36%	0.363	C	S	.	.	H	α-helix	trans	-65	-41.9	171.4	-173.6	64.2	0	0	0	112.4	C310 Q313 I314 L317 Y448 S450 S455 V456	C310-L452 HydrophobicContact CB-CD1 4.49Å; Q313-L452 HydrophobicContact CB-CD2 4.19Å; I314-L452 HydrophobicContact CD1-CG 4.21Å; I314-L452 HydrophobicContact CG1-CD2 3.65Å; I314-L452 HydrophobicContact CG1-CG 3.75Å; L317-L452 HydrophobicContact CD1-CD2 3.7Å; Y448-L452 HydrophobicContact CE2-CD2 4.5Å; Y448-L452 VanDerWaalsContact O-CB 3.28Å; Y448-L452 WeakPolarHBondContact O-CB 3.49Å; Y448-L452 PolarHBondContact O-N 3.33Å; S450-L452 PolarHBondContact O-N 2.8Å; L452-S455 WeakPolarHBondContact O-CB 3.45Å; L452-S455 PolarHBondContact O-N 3.39Å; L452-V456 PolarHBondContact O-N 3.35Å
453	I	82.3	Confident	72.5	Confident	54 Å²	54	76.3 Å²	76.3	28%	0.277	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-38.4	175.2	-71.6	164.2	0	0	0	111.2	I314 L449 S450 V456 R457	I314-I453 HydrophobicContact CD1-CG1 3.81Å; I314-I453 HydrophobicContact CG1-CG1 4.19Å; I314-I453 HydrophobicContact CG2-CG1 4.27Å; L449-I453 WeakPolarHBondContact O-CB 3.35Å; L449-I453 WeakPolarHBondContact O-CD1 3.13Å; L449-I453 WeakPolarHBondContact O-CG1 3.33Å; L449-I453 PolarHBondContact O-N 2.93Å; S450-I453 PolarHBondContact O-N 3.12Å; I453-V456 PolarHBondContact O-N 2.89Å; I453-R457 WeakPolarHBondContact O-CG 3.47Å; I453-R457 PolarHBondContact O-N 2.88Å; I453-R457 VanDerWaalsContact O-N 3.11Å
454	N	81.3	Confident	70	Confident	86 Å²	86	72.4 Å²	72.4	46%	0.46	39%	0.39	S	S	.	.	H	α-helix	trans	-69	-37.1	178	-69.4	-31	0	0	0	111.7	S450 D451 V456 R457 G458	S450-N454 WeakPolarHBondContact O-CB 3.41Å; S450-N454 PolarHBondContact O-N 2.95Å; S450-N454 PolarHBondContact O-ND2 3.44Å; S450-N454 VanDerWaalsContact O-ND2 3.08Å; S450-N454 PolarHBondContact OG-ND2 2.68Å; D451-N454 PolarHBondContact O-N 2.9Å; N454-V456 VanDerWaalsContact C-N 3.29Å; N454-V456 PolarHBondContact O-N 2.99Å; N454-R457 PolarHBondContact O-N 3.38Å; N454-R457 VanDerWaalsContact O-N 3.16Å; N454-G458 PolarHBondContact O-N 3.47Å
455	S	78.5	Confident	67.1	Low	78 Å²	78	80.7 Å²	80.7	55%	0.545	43%	0.425	S	S	.	.	H	α-helix	trans	-56	-41.6	171.2	175.5	0	0	0	0	112.2	D451 L452	D451-S455 WeakPolarHBondContact O-CB 3.34Å; D451-S455 PolarHBondContact O-N 3.26Å; L452-S455 WeakPolarHBondContact O-CB 3.45Å; L452-S455 PolarHBondContact O-N 3.39Å
456	V	66.6	Low	64.6	Low	11 Å²	11	83.7 Å²	83.7	7%	0.067	46%	0.459	C	S	.	.	H	α-helix	trans	-68.5	-39.8	175.2	174.5	0	0	0	0	112.5	C310 K311 I314 L452 I453 N454	C310-V456 HydrophobicContact CB-CG2 3.4Å; C310-V456 VanDerWaalsContact CB-CG2 3.4Å; K311-V456 HydrophobicContact CD-CG1 4.3Å; K311-V456 VanDerWaalsContact CE-CG1 3.43Å; K311-V456 HydrophobicContact CG-CG1 3.89Å; K311-V456 HydrophobicContact CG-CG2 4.49Å; I314-V456 HydrophobicContact CD1-CG2 3.85Å; L452-V456 PolarHBondContact O-N 3.35Å; I453-V456 PolarHBondContact O-N 2.89Å; N454-V456 VanDerWaalsContact C-N 3.29Å; N454-V456 PolarHBondContact O-N 2.99Å
457	R	64.5	Low	62	Low	151 Å²	151	87 Å²	87	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-74.3	-26.5	-175.7	-73	173.8	179	-89.6	0.9	114.3	I453 N454 D459	I453-R457 WeakPolarHBondContact O-CG 3.47Å; I453-R457 PolarHBondContact O-N 2.88Å; I453-R457 VanDerWaalsContact O-N 3.11Å; N454-R457 PolarHBondContact O-N 3.38Å; N454-R457 VanDerWaalsContact O-N 3.16Å; R457-D459 VanDerWaalsContact C-N 3.35Å; R457-D459 PolarHBondContact O-N 2.92Å
458	G	54.1	Low	59.2	Low	47 Å²	47	86.3 Å²	86.3	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-64.3	-37.1	-177	0	0	0	0	0	113.8	N454	N454-G458 PolarHBondContact O-N 3.47Å
459	D	47	Very low	56.5	Low	86 Å²	86	96.2 Å²	96.2	46%	0.46	54%	0.544	S	S	.	.	H	α-helix	trans	-76.4	-37.3	-173.3	-163.4	38.6	0	0	0	112.6	H307 R457 F461 V462 N463	H307-D459 IonicContact ND1-OD2 2.77Å; R457-D459 VanDerWaalsContact C-N 3.35Å; R457-D459 PolarHBondContact O-N 2.92Å; D459-F461 PolarHBondContact O-N 3.49Å; D459-F461 VanDerWaalsContact O-N 3.11Å; D459-V462 PolarHBondContact O-N 3.18Å; D459-V462 VanDerWaalsContact O-N 3.07Å; D459-N463 PolarHBondContact O-N 3.49Å
460	E	49	Very low	53.8	Low	104 Å²	104	98.5 Å²	98.5	49%	0.486	57%	0.573	S	S	.	*	H	α-helix	trans	-60.9	-23.2	179	-66.4	-176.7	167.1	0	0	113.1	K311	K311-E460 WeakPolarHBondContact CE-OE1 3.49Å; K311-E460 IonicContact NZ-OE1 3.63Å; K311-E460 PolarHBondContact NZ-OE1 3.23Å
461	F	41.4	Very low	51.2	Low	165 Å²	165	105.9 Å²	105.9	72%	0.724	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-22.1	176.3	-85.2	-83.7	0	0	0	114.8	D459	D459-F461 PolarHBondContact O-N 3.49Å; D459-F461 VanDerWaalsContact O-N 3.11Å
462	V	43.8	Very low	48.3	Very low	116 Å²	116	106.4 Å²	106.4	70%	0.703	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-44.3	178.3	177.1	0	0	0	0	110.2	D459 G464	D459-V462 PolarHBondContact O-N 3.18Å; D459-V462 VanDerWaalsContact O-N 3.07Å; V462-G464 PolarHBondContact O-N 3.35Å
463	N	37.1	Very low	45.9	Very low	155 Å²	155	112.2 Å²	112.2	83%	0.829	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-2.1	-175.3	-147.6	12.7	0	0	0	114.1	D459	D459-N463 PolarHBondContact O-N 3.49Å
464	G	38	Very low	44	Very low	60 Å²	60	115.6 Å²	115.6	62%	0.619	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	-0.3	-174.5	0	0	0	0	0	116.6	V462	V462-G464 PolarHBondContact O-N 3.35Å
465	K	31.3	Very low	41.7	Very low	189 Å²	189	115.3 Å²	115.3	82%	0.822	69%	0.692	S	S	*	*			trans	-135.2	57.1	-174.9	-68	-171.9	178.3	-179.7	0	113.2
466	G	34.8	Very low	39.3	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	71%	0.711	S	S	*	*			trans	-121.1	2	-173.7	0	0	0	0	0	117.4
467	Q	33.3	Very low	37.6	Very low	204 Å²	204	122.5 Å²	122.5	95%	0.953	74%	0.74	S	S	*	*			trans	-143.6	122.5	177.5	-74.3	-173.2	-20.3	0	0	111.3
468	G	29.8	Very low	35.9	Very low	72 Å²	72	123.6 Å²	123.6	74%	0.742	76%	0.757	S	S	*	*			trans	158.3	85.2	173.8	0	0	0	0	0	115.6
469	Q	31.7	Very low	34.9	Very low	212 Å²	212	132.2 Å²	132.2	99%	0.991	78%	0.775	S	S	*	*			trans	63.2	150.3	164.2	-62.7	178.5	-42.9	0	0	118.4
470	G	29.5	Very low	34.9	Very low	70 Å²	70	133.6 Å²	133.6	72%	0.722	79%	0.789	S	S	*	*			trans	-149.2	-167.5	166.7	0	0	0	0	0	110.1
471	Q	30.7	Very low	33.8	Very low	209 Å²	209	132.2 Å²	132.2	98%	0.977	80%	0.803	S	S	*	*			trans	78.8	110.9	169	-152.9	168.1	25.1	0	0	116.6
472	G	26.1	Very low	33.3	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	81%	0.809	S	S	*	*			trans	150.9	99.4	167.6	0	0	0	0	0	115.5
473	V	34.3	Very low	32.5	Very low	138 Å²	138	133.4 Å²	133.4	84%	0.836	81%	0.812	S	S	*	*			trans	-145.4	123.2	169	172.1	0	0	0	0	106.5
474	P	40.3	Very low	32.1	Very low	125 Å²	125	130.9 Å²	130.9	81%	0.812	81%	0.812	S	S	*	*				-122.5	163.1	89.1	2.8	20.2	0	0	0	111.9
475	A	34	Very low	31.5	Very low	80 Å²	80	132 Å²	132	66%	0.661	82%	0.824	S	S	*	*			cis	117.5	160.1	23.5	0	0	0	0	0	110.3
476	D	28.5	Very low	31.4	Very low	174 Å²	174	126.9 Å²	126.9	93%	0.93	83%	0.825	S	S	*	*			trans	63.5	145.2	-167.5	-57.4	-29	0	0	0	115.6
477	G	30.4	Very low	31	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	83%	0.832	S	S	*	*			cis	-172.4	166.1	-5.2	0	0	0	0	0	113.6
478	D	28.7	Very low	30.7	Very low	174 Å²	174	129 Å²	129	93%	0.93	83%	0.828	S	S	*	*			trans	69.6	150.3	166.2	-67	-31.5	0	0	0	123.7
479	R	33.5	Very low	30.5	Very low	228 Å²	228	130.4 Å²	130.4	86%	0.86	83%	0.827	S	S	*	*			trans	-132.2	-171.6	-179.8	-71.1	173.1	66.1	-163.5	2.6	107.6
480	P	46.9	Very low	30.4	Very low	115 Å²	115	129.5 Å²	129.5	75%	0.747	82%	0.823	S	S	*	*				-121.3	177.1	-56.2	35.1	-20.6	0	0	0	111.9
481	G	26.6	Very low	30.3	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	83%	0.832	S	S	*	*			trans	-151	153.7	170	0	0	0	0	0	112.1
482	L	29.2	Very low	30.3	Very low	162 Å²	162	132.5 Å²	132.5	85%	0.848	83%	0.828	S	S	*	*			trans	-128.8	159.5	-168	-80.7	171.9	0	0	0	114.5
483	N	29	Very low	30.5	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	83%	0.828	S	S	*	*			trans	85.2	118.3	150.5	-69.6	-11.4	0	0	0	122.2
484	A	28.4	Very low	30	Very low	102 Å²	102	134 Å²	134	84%	0.843	83%	0.827	S	S	*	*				84.4	116.1	120.7	0	0	0	0	0	122.2
485	G	25.5	Very low	29.6	Very low	84 Å²	84	132.8 Å²	132.8	87%	0.866	83%	0.828	S	S	*	*				106.7	147.4	127.4	0	0	0	0	0	117.7
486	G	27.3	Very low	29.5	Very low	81 Å²	81	139.1 Å²	139.1	84%	0.835	84%	0.84	S	S	*	*			trans	114.8	100.8	162.5	0	0	0	0	0	115.5
487	E	26.6	Very low	29.6	Very low	197 Å²	197	139.5 Å²	139.5	92%	0.921	83%	0.834	S	S	*	*			trans	-63.7	145	169.4	-54.7	157	111.2	0	0	112.2
488	S	27.1	Very low	29.7	Very low	125 Å²	125	141.4 Å²	141.4	87%	0.874	84%	0.843	S	S	*	*				-170.9	159.9	129.1	-164.3	0	0	0	0	111.7
489	S	26.7	Very low	29.9	Very low	103 Å²	103	137.9 Å²	137.9	72%	0.72	84%	0.838	S	S	*	*			trans	-105.5	173.4	-179.3	-73.7	0	0	0	0	113.5
490	Q	28.8	Very low	30	Very low	192 Å²	192	133.8 Å²	133.8	90%	0.897	83%	0.832	S	S	*	*			trans	87.8	105.3	165.8	-51.7	-170.3	1.6	0	0	117.7
491	V	28.1	Very low	29.3	Very low	152 Å²	152	137.4 Å²	137.4	92%	0.921	84%	0.836	S	S	*	*			trans	-119.4	146.5	151	175.5	0	0	0	0	108.3
492	Q	31.1	Very low	29.9	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	84%	0.838	S	S	*	*			trans	-82.8	147.8	-160.9	-159.9	165.5	-5.6	0	0	113.6
493	Q	29.8	Very low	30.3	Very low	166 Å²	166	141.8 Å²	141.8	78%	0.776	84%	0.839	S	S	*	*			trans	-86.3	135.9	-179.4	-68	-173.3	19.2	0	0	113.3	K497	Q493-K497 VanDerWaalsContact OE1-NZ 3.13Å
494	G	24.5	Very low	30.5	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	84%	0.839	S	S	*	*			trans	156.2	118.8	161.7	0	0	0	0	0	113.6
495	A	30.6	Very low	30.8	Very low	100 Å²	100	145.1 Å²	145.1	83%	0.826	84%	0.835	S	S	*	*	S	Bend	cis	-152.2	124	-7.4	0	0	0	0	0	112
496	K	31.5	Very low	31.4	Very low	214 Å²	214	151.2 Å²	151.2	93%	0.93	84%	0.838	S	S	*	*			trans	-145.4	104.5	158.5	-68.5	-169.3	-178.2	-179.1	0	108.7
497	K	30.5	Very low	31.9	Very low	182 Å²	182	155 Å²	155	79%	0.791	84%	0.839	S	S	*	*			trans	-141	105.6	177.5	-89	179.2	179.9	160.5	0	110.5	Q493	Q493-K497 VanDerWaalsContact OE1-NZ 3.13Å
498	A	33.7	Very low	32.3	Very low	106 Å²	106	154.7 Å²	154.7	88%	0.876	84%	0.837	S	S	*	*	S	Bend	trans	-162.9	-53.3	162.7	0	0	0	0	0	111.4
499	A	31.9	Very low	32.7	Very low	100 Å²	100	153.1 Å²	153.1	83%	0.826	83%	0.832	S	S	*	*	S	Bend	trans	-96.8	2.2	-159.7	0	0	0	0	0	117.3
500	I	36.8	Very low	33.1	Very low	141 Å²	141	156 Å²	156	72%	0.723	84%	0.837	S	S	*	*			trans	-126.6	88	-174.7	-50.1	177.8	0	0	0	110.3
501	K	32.6	Very low	33.3	Very low	191 Å²	191	153.5 Å²	153.5	83%	0.83	84%	0.836	S	S	*	*	S	Bend	trans	-148.2	-1.8	173.9	-94.2	-151.3	172.2	-165.1	0	117.4
502	I	38.3	Very low	33.8	Very low	163 Å²	163	151.2 Å²	151.2	84%	0.836	82%	0.822	S	S	*	*	S	Bend	trans	-104.9	-12.6	-178.6	-58.5	179.1	0	0	0	112.2
503	L	37.2	Very low	33.9	Very low	167 Å²	167	147.5 Å²	147.5	87%	0.874	81%	0.808	S	S	*	*	S	Bend	trans	-105.8	46	-175.6	-87.6	156.6	0	0	0	113.4
504	K	34.6	Very low	34.6	Very low	175 Å²	175	145.5 Å²	145.5	76%	0.761	81%	0.807	S	S	*	*	S	Bend	trans	-140.8	21.6	179.9	-80.4	-145.2	167.3	-137.8	0	115.8
505	N	34.1	Very low	35.5	Very low	141 Å²	141	146 Å²	146	75%	0.754	80%	0.804	S	S	*	*	S	Bend	trans	-123.2	24.2	-175.8	-72.2	46.8	0	0	0	113.6
506	F	36.9	Very low	36.2	Very low	212 Å²	212	145.3 Å²	145.3	93%	0.93	79%	0.793	S	S	*	*	S	Bend	trans	-132.3	18.8	-179.3	-82.9	-69.9	0	0	0	113.4
507	D	38.5	Very low	36.5	Very low	159 Å²	159	141.3 Å²	141.3	85%	0.85	78%	0.781	S	S	*	*			trans	-117.6	61.5	-172.8	-161.1	13.5	0	0	0	110.6
508	E	35.6	Very low	37	Very low	191 Å²	191	137.8 Å²	137.8	89%	0.893	77%	0.771	S	S	*	*	S	Bend	trans	-151.2	124.7	168.5	-143.4	164.4	-148.6	0	0	110.4
509	A	34	Very low	37.6	Very low	92 Å²	92	137.4 Å²	137.4	76%	0.76	76%	0.759	S	S	*	*			trans	62.7	71.5	170.5	0	0	0	0	0	120
510	I	35.9	Very low	38	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	76%	0.756	S	S	*	*			trans	-128	91.9	136.4	-54.4	-179.4	0	0	0	109.1	V512	I510-V512 HydrophobicContact CG2-CG2 4.2Å
511	T	34.1	Very low	38.4	Very low	140 Å²	140	141.3 Å²	141.3	86%	0.859	76%	0.759	S	S	*	*			trans	-90.9	108	171.8	48.8	0	0	0	0	110
512	V	37.9	Very low	38.8	Very low	105 Å²	105	139.1 Å²	139.1	64%	0.636	76%	0.756	S	S	*	*			trans	-91.2	134.4	168.1	-176.6	0	0	0	0	108.6	I510 V514	I510-V512 HydrophobicContact CG2-CG2 4.2Å; V512-V514 PolarHBondContact O-N 3.01Å
513	D	32.6	Very low	38.9	Very low	112 Å²	112	141.3 Å²	141.3	60%	0.599	76%	0.755	S	S	*	*			trans	-72	124.9	179.8	-170.1	-8	0	0	0	111	A515 S516	D513-A515 PolarHBondContact O-N 3.2Å; D513-A515 WeakPolarHBondContact OD1-CB 3.31Å; D513-A515 PolarHBondContact OD1-N 3.36Å; D513-S516 PolarHBondContact O-N 2.9Å; D513-S516 PolarHBondContact O-OG 3.49Å
514	V	45.4	Very low	38.7	Very low	124 Å²	124	141.9 Å²	141.9	75%	0.752	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-71.3	-14.8	-179.4	179.6	0	0	0	0	111.6	V512 S516	V512-V514 PolarHBondContact O-N 3.01Å; V514-S516 PolarHBondContact O-N 3.37Å
515	A	42.8	Very low	38.8	Very low	89 Å²	89	143.4 Å²	143.4	74%	0.736	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-70.4	-10	174.4	0	0	0	0	0	114.6	D513	D513-A515 PolarHBondContact O-N 3.2Å; D513-A515 WeakPolarHBondContact OD1-CB 3.31Å; D513-A515 PolarHBondContact OD1-N 3.36Å
516	S	45	Very low	38.6	Very low	85 Å²	85	142.9 Å²	142.9	59%	0.594	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-103.9	17	-175	85.8	0	0	0	0	115.5	D513 V514	D513-S516 PolarHBondContact O-N 2.9Å; D513-S516 PolarHBondContact O-OG 3.49Å; V514-S516 PolarHBondContact O-N 3.37Å
517	L	38.3	Very low	38.3	Very low	130 Å²	130	142.4 Å²	142.4	68%	0.681	75%	0.752	S	S	*	*			trans	-114.5	99.3	-177.7	-67.7	176.3	0	0	0	111.6	P519	L517-P519 WeakPolarHBondContact O-CD 3.39Å
518	D	40.5	Very low	37.9	Very low	108 Å²	108	139.6 Å²	139.6	58%	0.578	75%	0.751	S	S	*	*			trans	-70.3	120.2	173.5	-173.6	-16.4	0	0	0	110.9	E520	D518-E520 VanDerWaalsContact C-N 3.25Å; D518-E520 PolarHBondContact O-N 2.92Å; D518-E520 PolarHBondContact OD1-N 2.97Å; D518-E520 VanDerWaalsContact OD1-N 3.07Å
519	P	45.9	Very low	37.6	Very low	98 Å²	98	133.6 Å²	133.6	64%	0.636	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-61.8	-24.8	-178.8	-24.4	35.3	0	0	0	115.3	L517 M521 L522	L517-P519 WeakPolarHBondContact O-CD 3.39Å; P519-M521 VanDerWaalsContact C-N 3.31Å; P519-M521 PolarHBondContact O-N 3.35Å; P519-L522 PolarHBondContact O-N 3Å
520	E	41	Very low	37.2	Very low	164 Å²	164	137 Å²	137	77%	0.766	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-79.2	-16.3	-169	-155.7	152.6	-146.1	0	0	113	D518 L522	D518-E520 VanDerWaalsContact C-N 3.25Å; D518-E520 PolarHBondContact O-N 2.92Å; D518-E520 PolarHBondContact OD1-N 2.97Å; D518-E520 VanDerWaalsContact OD1-N 3.07Å; E520-L522 VanDerWaalsContact C-N 3.27Å; E520-L522 PolarHBondContact O-N 3.15Å
521	M	45.3	Very low	36.8	Very low	159 Å²	159	137 Å²	137	78%	0.783	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-71.2	-13.5	174.1	-76.5	-80.3	-77.5	0	0	114.4	P519 Y523	P519-M521 VanDerWaalsContact C-N 3.31Å; P519-M521 PolarHBondContact O-N 3.35Å; M521-Y523 VanDerWaalsContact C-N 3.34Å; M521-Y523 PolarHBondContact O-N 3.38Å
522	L	41	Very low	36.5	Very low	145 Å²	145	134.9 Å²	134.9	76%	0.759	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-76.7	-12.7	-174.1	-88	161.1	0	0	0	115.3	P519 E520	P519-L522 PolarHBondContact O-N 3Å; E520-L522 VanDerWaalsContact C-N 3.27Å; E520-L522 PolarHBondContact O-N 3.15Å
523	Y	39.3	Very low	36	Very low	208 Å²	208	137.7 Å²	137.7	82%	0.816	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-110.4	1.5	-167.1	-77.8	-80	0	0	0	116.2	M521	M521-Y523 VanDerWaalsContact C-N 3.34Å; M521-Y523 PolarHBondContact O-N 3.38Å
524	Q	33.6	Very low	35.5	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	74%	0.738	S	S	*	*			trans	-96.1	101.1	-179.3	-64.1	-160.4	20.4	0	0	113.9
525	R	36.4	Very low	34.5	Very low	206 Å²	206	146.1 Å²	146.1	78%	0.777	75%	0.746	S	S	*	*			trans	-143.7	137.5	152.7	-80.9	-166.6	179.3	-169.2	3	110.3
526	P	30.8	Very low	34	Very low	131 Å²	131	148.1 Å²	148.1	85%	0.851	74%	0.743	S	S	*	*			trans	-124.9	137.3	131.4	33.3	-25.4	0	0	0	110.9
527	Y	31	Very low	33.1	Very low	202 Å²	202	153.5 Å²	153.5	79%	0.792	75%	0.752	S	S	*	*			trans	-89.2	121.4	177.3	-130.7	-112	0	0	0	109.8
528	A	28.8	Very low	32.8	Very low	100 Å²	100	153 Å²	153	83%	0.826	75%	0.754	S	S	*	*			trans	-137.7	132.5	157.9	0	0	0	0	0	106.7
529	G	30.4	Very low	32.1	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	76%	0.764	S	S	*	*			trans	-88.4	-169.5	-161.6	0	0	0	0	0	116.4
530	I	25.8	Very low	31.8	Very low	164 Å²	164	154.7 Å²	154.7	84%	0.841	77%	0.774	S	S	*	*			trans	94.1	95.3	176.6	-52.1	169.1	0	0	0	115.3
531	M	27.4	Very low	31.6	Very low	164 Å²	164	152.8 Å²	152.8	81%	0.808	77%	0.773	S	S	*	*			trans	59.3	167.1	144.7	-109.6	68.2	171.9	0	0	118.6
532	T	27.9	Very low	30.5	Very low	95 Å²	95	152.1 Å²	152.1	58%	0.583	77%	0.772	S	S	*	*			cis	-138.1	176.3	9.8	48	0	0	0	0	113.4
533	Y	26.3	Very low	30	Very low	163 Å²	163	150.7 Å²	150.7	64%	0.639	76%	0.764	S	S	*	*			trans	-51.5	169.3	158	-73	-108	0	0	0	114.8	E331	E331-Y533 VanDerWaalsContact CG-OH 3.23Å; E331-Y533 WeakPolarHBondContact CG-OH 3.33Å; E331-Y533 PolarHBondContact OE2-OH 3.44Å
534	F	22.8	Very low	29.2	Very low	177 Å²	177	149.6 Å²	149.6	78%	0.776	76%	0.764	S	S	*	*			trans	-120.3	143.4	170.9	-72.3	-86.6	0	0	0	113.6
535	Y	25.3	Very low	28.8	Very low	237 Å²	237	149.2 Å²	149.2	93%	0.929	76%	0.759	S	S	*	*			trans	-139	158.5	131.2	-101.7	-80.7	0	0	0	107.6
536	I	31.2	Very low	28.1	Very low	130 Å²	130	145.6 Å²	145.6	67%	0.667	76%	0.764	S	S	*	*			trans	-116.6	134	-166	-67.4	169.6	0	0	0	110.4
537	Y	26.3	Very low	27.7	Very low	199 Å²	199	149.6 Å²	149.6	78%	0.78	76%	0.763	S	S	*	*				-167.7	129.2	125.5	-107.7	-70.3	0	0	0	113.3
538	T	31	Very low	27.4	Very low	119 Å²	119	148.9 Å²	148.9	73%	0.73	76%	0.764	S	S	*	*	S	Bend	trans	44.7	114.6	161.2	40	0	0	0	0	120.6
539	S	27.4	Very low	27.1	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	75%	0.752	S	S	*	*	S	Bend	trans	74	140.2	168.8	-63.8	0	0	0	0	116.5
540	P	38.6	Very low	27	Very low	128 Å²	128	153.5 Å²	153.5	83%	0.831	76%	0.757	S	S	*	*	S	Bend		-124.6	58.4	-126.6	39.9	-25.8	0	0	0	115.3
541	V	36.3	Very low	26.9	Very low	124 Å²	124	151.4 Å²	151.4	75%	0.752	75%	0.747	S	S	*	*			trans	-141.8	110.3	154.7	-175.5	0	0	0	0	108.4	I543	V541-I543 HydrophobicContact CG1-CD1 4.29Å; V541-I543 HydrophobicContact CG1-CG1 4.32Å
542	L	24.2	Very low	27	Very low	146 Å²	146	151.2 Å²	151.2	76%	0.764	75%	0.748	S	S	*	*			trans	-138.9	120.5	177.4	-133.7	166.6	0	0	0	108.8
543	I	28.8	Very low	26.8	Very low	115 Å²	115	155.9 Å²	155.9	59%	0.59	76%	0.761	S	S	*	*			trans	-121.5	123.2	-171.3	-58.7	172.5	0	0	0	108.4	V541 F545	V541-I543 HydrophobicContact CG1-CD1 4.29Å; V541-I543 HydrophobicContact CG1-CG1 4.32Å; I543-F545 HydrophobicContact CB-CE2 4.27Å; I543-F545 HydrophobicContact CG2-CD2 3.83Å; I543-F545 HydrophobicContact CG2-CE2 3.59Å; I543-F545 HydrophobicContact CG2-CZ 4.21Å
544	F	23.7	Very low	26.9	Very low	185 Å²	185	157.4 Å²	157.4	81%	0.811	77%	0.771	S	S	*	*			trans	-92.1	112.5	175.1	-121.9	-91.3	0	0	0	110.8
545	F	24	Very low	27.1	Very low	171 Å²	171	158 Å²	158	75%	0.75	78%	0.776	S	S	*	*			trans	-94.4	112.9	178.1	-84.6	-86.7	0	0	0	111.9	I543 R547	I543-F545 HydrophobicContact CB-CE2 4.27Å; I543-F545 HydrophobicContact CG2-CD2 3.83Å; I543-F545 HydrophobicContact CG2-CE2 3.59Å; I543-F545 HydrophobicContact CG2-CZ 4.21Å; F545-R547 PolarHBondContact O-N 2.82Å
546	C	22.8	Very low	27.2	Very low	130 Å²	130	151 Å²	151	88%	0.878	76%	0.762	S	S	*	*			trans	-79.2	105.8	155.8	-114	0	0	0	0	108.5	F548	C546-F548 PolarHBondContact O-N 3.32Å
547	R	22.6	Very low	27.3	Very low	216 Å²	216	149.5 Å²	149.5	82%	0.815	76%	0.759	S	S	*	*			trans	-76.6	108.8	-173.4	-178.6	171.1	171.1	153.2	-4.8	111.4	F545	F545-R547 PolarHBondContact O-N 2.82Å
548	F	23.8	Very low	27.9	Very low	186 Å²	186	146.6 Å²	146.6	82%	0.816	75%	0.752	S	S	*	*			trans	-63.5	130.1	162.9	-103.4	-98.2	0	0	0	109.7	C546	C546-F548 PolarHBondContact O-N 3.32Å
549	D	23.5	Very low	28.1	Very low	108 Å²	108	145 Å²	145	58%	0.578	75%	0.752	S	S	*	*			trans	-110.3	97.8	170.6	-139.2	-51.6	0	0	0	110.3	N551	D549-N551 PolarHBondContact O-N 3.34Å; D549-N551 PolarHBondContact OD1-ND2 3.33Å
550	M	26.8	Very low	28.6	Very low	154 Å²	154	144.3 Å²	144.3	76%	0.759	74%	0.742	S	S	*	*			trans	-91	90.5	173.2	-88.7	-70.3	-174.1	0	0	109.4
551	N	24.1	Very low	28.5	Very low	120 Å²	120	144.3 Å²	144.3	64%	0.642	73%	0.729	S	S	*	*			trans	-140	45.3	177.3	-95.3	-62.8	0	0	0	113.3	D549 K553	D549-N551 PolarHBondContact O-N 3.34Å; D549-N551 PolarHBondContact OD1-ND2 3.33Å; N551-K553 PolarHBondContact O-N 2.63Å
552	L	29	Very low	28.7	Very low	160 Å²	160	145.3 Å²	145.3	84%	0.838	73%	0.726	S	S	*	*			trans	-70.6	93.2	160.7	-91.2	156.3	0	0	0	109.1	F554	L552-F554 PolarHBondContact O-N 2.9Å; L552-F554 VanDerWaalsContact O-N 3.07Å
553	K	25.5	Very low	29.3	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	71%	0.712	S	S	*	*			trans	-66.5	102.1	169.9	-72.2	179.1	177.1	179	0	109.2	N551	N551-K553 PolarHBondContact O-N 2.63Å
554	F	26.7	Very low	29.9	Very low	195 Å²	195	140.1 Å²	140.1	86%	0.855	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-68.3	137	164.5	-114	-90.7	0	0	0	109.8	L552	L552-F554 PolarHBondContact O-N 2.9Å; L552-F554 VanDerWaalsContact O-N 3.07Å
555	E	28.7	Very low	30.7	Very low	188 Å²	188	136.4 Å²	136.4	88%	0.879	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-72.6	137.2	179.2	-161	158.2	-144.8	0	0	110.3
556	S	26	Very low	31.8	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-80.1	130.4	-159.7	-173.8	0	0	0	0	113.1
557	T	32.9	Very low	32.9	Very low	98 Å²	98	133 Å²	133	60%	0.601	68%	0.676	S	S	*	*			trans	-124.7	130.4	159.7	52.3	0	0	0	0	109.6	A559 V560	T557-A559 PolarHBondContact O-N 3.45Å; T557-V560 PolarHBondContact O-N 3.33Å
558	E	38.8	Very low	33.9	Very low	137 Å²	137	124.9 Å²	124.9	64%	0.64	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-27.2	-165	-120.4	55.1	-146	0	0	115.7	V560 K561	E558-V560 VanDerWaalsContact C-N 3.31Å; E558-V560 PolarHBondContact O-N 2.93Å; E558-K561 PolarHBondContact O-N 3.39Å
559	A	35.2	Very low	35.1	Very low	86 Å²	86	123.9 Å²	123.9	71%	0.711	65%	0.65	S	S	*	*	H	α-helix	trans	-61	-33.1	-178.3	0	0	0	0	0	114.1	T557	T557-A559 PolarHBondContact O-N 3.45Å
560	V	38.8	Very low	36.3	Very low	99 Å²	99	126.1 Å²	126.1	60%	0.6	65%	0.65	S	S	*	*	H	α-helix	trans	-72.9	-31.9	-175.5	-178.3	0	0	0	0	111.9	T557 E558 H562 A563 C564	T557-V560 PolarHBondContact O-N 3.33Å; E558-V560 VanDerWaalsContact C-N 3.31Å; E558-V560 PolarHBondContact O-N 2.93Å; V560-H562 VanDerWaalsContact C-N 3.34Å; V560-H562 PolarHBondContact O-N 2.95Å; V560-A563 PolarHBondContact O-N 3.29Å; V560-C564 PolarHBondContact O-N 3.41Å; V560-C564 VanDerWaalsContact O-N 3.15Å
561	K	36.8	Very low	37.4	Very low	128 Å²	128	120.4 Å²	120.4	56%	0.557	63%	0.631	S	S	*	*	H	α-helix	trans	-61.4	-41.8	-174.4	-160	176	-172.4	176.9	0	112.1	E558 A563 C564 E565	E558-K561 PolarHBondContact O-N 3.39Å; K561-A563 VanDerWaalsContact C-N 3.33Å; K561-A563 PolarHBondContact O-N 2.97Å; K561-C564 PolarHBondContact O-N 3.14Å; K561-E565 PolarHBondContact O-N 2.86Å
562	H	40.1	Very low	38.9	Very low	145 Å²	145	121.9 Å²	121.9	67%	0.671	63%	0.632	S	S	*	*	H	α-helix	trans	-73.7	-22.1	-177.8	-152.3	-60.8	0	0	0	113.4	V560	V560-H562 VanDerWaalsContact C-N 3.34Å; V560-H562 PolarHBondContact O-N 2.95Å
563	A	37.9	Very low	40.4	Very low	59 Å²	59	117.1 Å²	117.1	49%	0.488	62%	0.615	S	S	.	*	H	α-helix	trans	-79.4	-43.6	172.7	0	0	0	0	0	111.6	V560 K561 E565 Q566 D567	V560-A563 PolarHBondContact O-N 3.29Å; K561-A563 VanDerWaalsContact C-N 3.33Å; K561-A563 PolarHBondContact O-N 2.97Å; A563-E565 VanDerWaalsContact C-N 3.32Å; A563-E565 PolarHBondContact O-N 2.83Å; A563-Q566 PolarHBondContact O-N 3.4Å; A563-D567 PolarHBondContact O-N 3.08Å
564	C	39.5	Very low	41.9	Very low	93 Å²	93	113.9 Å²	113.9	63%	0.628	60%	0.603	S	S	*	*	H	α-helix	trans	-61.1	-38.2	-179.5	-168.7	0	0	0	0	112.5	V560 K561 Q566 G568	V560-C564 PolarHBondContact O-N 3.41Å; V560-C564 VanDerWaalsContact O-N 3.15Å; K561-C564 PolarHBondContact O-N 3.14Å; C564-Q566 VanDerWaalsContact C-N 3.29Å; C564-Q566 PolarHBondContact O-N 3.21Å; C564-G568 PolarHBondContact O-N 3Å; C564-G568 VanDerWaalsContact O-N 3.09Å
565	E	41.9	Very low	43.3	Very low	107 Å²	107	110.9 Å²	110.9	50%	0.5	59%	0.592	S	S	.	*	H	α-helix	trans	-66.4	-25.9	174.4	-77.5	-164.4	-151.6	0	0	114.4	K561 A563 R569	K561-E565 PolarHBondContact O-N 2.86Å; A563-E565 VanDerWaalsContact C-N 3.32Å; A563-E565 PolarHBondContact O-N 2.83Å; E565-R569 WeakPolarHBondContact O-CD 3.41Å; E565-R569 VanDerWaalsContact O-CG 3.3Å; E565-R569 WeakPolarHBondContact O-CG 3.32Å; E565-R569 PolarHBondContact O-NE 2.91Å; E565-R569 IonicContact OE2-NH2 3.16Å; E565-R569 PolarHBondContact OE2-NH2 3.44Å
566	Q	45.6	Very low	44.8	Very low	135 Å²	135	107.1 Å²	107.1	63%	0.631	57%	0.574	S	S	*	*	H	α-helix	trans	-76.3	-47.5	177.8	-108.2	179.6	-14	0	0	111.3	A563 C564 G568 R569 R570	A563-Q566 PolarHBondContact O-N 3.4Å; C564-Q566 VanDerWaalsContact C-N 3.29Å; C564-Q566 PolarHBondContact O-N 3.21Å; Q566-G568 VanDerWaalsContact C-N 3.35Å; Q566-G568 PolarHBondContact O-N 2.81Å; Q566-R569 PolarHBondContact O-N 3.15Å; Q566-R570 PolarHBondContact O-N 2.89Å
567	D	45.9	Very low	46.7	Very low	94 Å²	94	108.7 Å²	108.7	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-70.5	-32.4	-179.6	-121.8	-2	0	0	0	112	A563 R569 R570 G571	A563-D567 PolarHBondContact O-N 3.08Å; D567-R569 VanDerWaalsContact C-N 3.26Å; D567-R569 PolarHBondContact O-N 3.24Å; D567-R570 WeakPolarHBondContact O-CB 3.36Å; D567-R570 PolarHBondContact O-N 3.01Å; D567-R570 VanDerWaalsContact O-N 3.12Å; D567-R570 IonicContact OD1-CZ 2.84Å; D567-R570 IonicContact OD1-NH1 2.6Å; D567-R570 PolarHBondContact OD1-NH1 3.26Å; D567-R570 IonicContact OD2-NH1 2.73Å; D567-G571 PolarHBondContact O-N 3.41Å
568	G	44.6	Very low	48	Very low	45 Å²	45	106.8 Å²	106.8	46%	0.464	57%	0.567	S	S	.	*	H	α-helix	trans	-61.3	-29.3	171.9	0	0	0	0	0	114.3	C564 Q566	C564-G568 PolarHBondContact O-N 3Å; C564-G568 VanDerWaalsContact O-N 3.09Å; Q566-G568 VanDerWaalsContact C-N 3.35Å; Q566-G568 PolarHBondContact O-N 2.81Å
569	R	48.4	Very low	49.4	Very low	166 Å²	166	107.9 Å²	107.9	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-78.5	-36	173.1	-66.7	170.6	-157.6	-177	8	111.5	E565 Q566 D567 A573	E565-R569 WeakPolarHBondContact O-CD 3.41Å; E565-R569 VanDerWaalsContact O-CG 3.3Å; E565-R569 WeakPolarHBondContact O-CG 3.32Å; E565-R569 PolarHBondContact O-NE 2.91Å; E565-R569 IonicContact OE2-NH2 3.16Å; E565-R569 PolarHBondContact OE2-NH2 3.44Å; Q566-R569 PolarHBondContact O-N 3.15Å; D567-R569 VanDerWaalsContact C-N 3.26Å; D567-R569 PolarHBondContact O-N 3.24Å; R569-A573 PolarHBondContact O-N 2.96Å
570	R	49.6	Very low	50.8	Low	155 Å²	155	109.6 Å²	109.6	59%	0.585	56%	0.557	S	S	*	*	H	α-helix	trans	-67.2	-41.4	177.4	-178.2	167.4	162.4	-107.4	-0.8	112.3	Q566 D567 A573 Q574	Q566-R570 PolarHBondContact O-N 2.89Å; D567-R570 WeakPolarHBondContact O-CB 3.36Å; D567-R570 PolarHBondContact O-N 3.01Å; D567-R570 VanDerWaalsContact O-N 3.12Å; D567-R570 IonicContact OD1-CZ 2.84Å; D567-R570 IonicContact OD1-NH1 2.6Å; D567-R570 PolarHBondContact OD1-NH1 3.26Å; D567-R570 IonicContact OD2-NH1 2.73Å; R570-A573 PolarHBondContact O-N 3.48Å; R570-Q574 PolarHBondContact O-N 3.48Å
571	G	49.7	Very low	52.2	Low	34 Å²	34	109 Å²	109	35%	0.351	55%	0.549	S	S	.	.	H	α-helix	trans	-57.7	-50.4	173.1	0	0	0	0	0	112.6	D567 A573 Q574 E575	D567-G571 PolarHBondContact O-N 3.41Å; G571-A573 VanDerWaalsContact C-N 3.3Å; G571-A573 PolarHBondContact O-N 2.88Å; G571-Q574 PolarHBondContact O-N 3.31Å; G571-Q574 VanDerWaalsContact O-N 3.09Å; G571-E575 PolarHBondContact O-N 3.23Å
572	K	55	Low	53.3	Low	151 Å²	151	105.3 Å²	105.3	66%	0.657	54%	0.543	S	S	*	.	H	α-helix	trans	-60.1	-35.7	178	-74.8	-170.3	173.9	-171.2	0	113.7	E575 E576	K572-E575 PolarHBondContact O-N 3.23Å; K572-E576 WeakPolarHBondContact O-CB 3.49Å; K572-E576 PolarHBondContact O-N 3.27Å
573	A	61.7	Low	54.5	Low	60 Å²	60	103.7 Å²	103.7	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-67.2	-36.6	175.6	0	0	0	0	0	112.5	R569 R570 G571 M577	R569-A573 PolarHBondContact O-N 2.96Å; R570-A573 PolarHBondContact O-N 3.48Å; G571-A573 VanDerWaalsContact C-N 3.3Å; G571-A573 PolarHBondContact O-N 2.88Å; A573-M577 WeakPolarHBondContact O-CB 3.48Å; A573-M577 PolarHBondContact O-N 3.22Å; A573-M577 VanDerWaalsContact O-N 3.14Å
574	Q	55.5	Low	56.2	Low	124 Å²	124	107.3 Å²	107.3	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-71.7	-37.9	173.2	-67.3	-174.2	-82.6	0	0	112.1	R570 G571 M577 A578	R570-Q574 PolarHBondContact O-N 3.48Å; G571-Q574 PolarHBondContact O-N 3.31Å; G571-Q574 VanDerWaalsContact O-N 3.09Å; Q574-M577 PolarHBondContact O-N 3.46Å; Q574-A578 WeakPolarHBondContact O-CB 3.43Å; Q574-A578 PolarHBondContact O-N 2.96Å
575	E	56.9	Low	57.7	Low	133 Å²	133	107.5 Å²	107.5	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-62.4	-47	175.4	-171.7	179.2	-168.4	0	0	111.7	G571 K572 M577 A578 W579	G571-E575 PolarHBondContact O-N 3.23Å; K572-E575 PolarHBondContact O-N 3.23Å; E575-M577 VanDerWaalsContact C-N 3.34Å; E575-M577 PolarHBondContact O-N 3.16Å; E575-A578 PolarHBondContact O-N 2.98Å; E575-W579 WeakPolarHBondContact O-CB 3.49Å; E575-W579 PolarHBondContact O-N 2.95Å
576	E	60.3	Low	59	Low	108 Å²	108	106.6 Å²	106.6	51%	0.505	54%	0.538	S	S	.	.	H	α-helix	trans	-65.3	-36.8	176.5	-160.8	-160.1	130.7	0	0	112.1	K572 K580	K572-E576 WeakPolarHBondContact O-CB 3.49Å; K572-E576 PolarHBondContact O-N 3.27Å; E576-K580 WeakPolarHBondContact O-CB 3.49Å; E576-K580 WeakPolarHBondContact O-CG 3.29Å; E576-K580 PolarHBondContact O-N 3.45Å; E576-K580 VanDerWaalsContact OE1-CE 3.3Å; E576-K580 WeakPolarHBondContact OE1-CE 3.4Å; E576-K580 IonicContact OE1-NZ 2.6Å; E576-K580 PolarHBondContact OE1-NZ 2.6Å
577	M	66.9	Low	60.1	Low	126 Å²	126	104 Å²	104	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-66.4	-45.1	174.5	-177.7	174.6	-73.8	0	0	111.7	A573 Q574 E575 W579 K580 I581	A573-M577 WeakPolarHBondContact O-CB 3.48Å; A573-M577 PolarHBondContact O-N 3.22Å; A573-M577 VanDerWaalsContact O-N 3.14Å; Q574-M577 PolarHBondContact O-N 3.46Å; E575-M577 VanDerWaalsContact C-N 3.34Å; E575-M577 PolarHBondContact O-N 3.16Å; M577-W579 VanDerWaalsContact C-N 3.34Å; M577-W579 PolarHBondContact O-N 3.35Å; M577-K580 PolarHBondContact O-N 3.35Å; M577-I581 HydrophobicContact CG-CD1 4.02Å; M577-I581 WeakPolarHBondContact O-CG1 3.38Å; M577-I581 PolarHBondContact O-N 3.29Å
578	A	58.6	Low	60.9	Low	58 Å²	58	104 Å²	104	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.8	0	0	0	0	0	111.5	Q574 E575 I581 A582	Q574-A578 WeakPolarHBondContact O-CB 3.43Å; Q574-A578 PolarHBondContact O-N 2.96Å; E575-A578 PolarHBondContact O-N 2.98Å; A578-I581 PolarHBondContact O-N 3.37Å; A578-A582 WeakPolarHBondContact O-CB 3.45Å; A578-A582 PolarHBondContact O-N 3.42Å
579	W	68.9	Low	62	Low	160 Å²	160	105.8 Å²	105.8	61%	0.606	53%	0.53	S	S	*	.	H	α-helix	trans	-63.9	-40.6	175.6	-171	86.6	0	0	0	112.5	E575 M577 A582 K583	E575-W579 WeakPolarHBondContact O-CB 3.49Å; E575-W579 PolarHBondContact O-N 2.95Å; M577-W579 VanDerWaalsContact C-N 3.34Å; M577-W579 PolarHBondContact O-N 3.35Å; W579-A582 PolarHBondContact O-N 3.47Å; W579-K583 HydrophobicContact CH2-CD 3.77Å; W579-K583 HydrophobicContact CZ2-CD 4.3Å; W579-K583 HydrophobicContact CZ3-CD 3.89Å; W579-K583 VanDerWaalsContact O-CB 3.29Å; W579-K583 WeakPolarHBondContact O-CB 3.45Å; W579-K583 PolarHBondContact O-N 2.96Å
580	K	65.3	Low	62.8	Low	121 Å²	121	101.3 Å²	101.3	53%	0.526	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-43.3	173.1	-82.7	168.8	169.9	166.5	0	112.3	E576 M577 K583 M584	E576-K580 WeakPolarHBondContact O-CB 3.49Å; E576-K580 WeakPolarHBondContact O-CG 3.29Å; E576-K580 PolarHBondContact O-N 3.45Å; E576-K580 VanDerWaalsContact OE1-CE 3.3Å; E576-K580 WeakPolarHBondContact OE1-CE 3.4Å; E576-K580 IonicContact OE1-NZ 2.6Å; E576-K580 PolarHBondContact OE1-NZ 2.6Å; M577-K580 PolarHBondContact O-N 3.35Å; K580-K583 PolarHBondContact O-N 2.97Å; K580-M584 WeakPolarHBondContact O-CB 3.4Å; K580-M584 PolarHBondContact O-N 3.42Å
581	I	67.3	Low	63.4	Low	87 Å²	87	99.5 Å²	99.5	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-48.4	176.6	-68.3	164.4	0	0	0	110.5	M577 A578 K583 M584 I585	M577-I581 HydrophobicContact CG-CD1 4.02Å; M577-I581 WeakPolarHBondContact O-CG1 3.38Å; M577-I581 PolarHBondContact O-N 3.29Å; A578-I581 PolarHBondContact O-N 3.37Å; I581-K583 VanDerWaalsContact C-N 3.35Å; I581-K583 PolarHBondContact O-N 3.27Å; I581-M584 WeakPolarHBondContact O-CB 3.3Å; I581-M584 PolarHBondContact O-N 3.25Å; I581-M584 VanDerWaalsContact O-N 3.16Å; I581-I585 HydrophobicContact CG2-CD1 3.85Å; I581-I585 WeakPolarHBondContact O-CG1 3.41Å; I581-I585 PolarHBondContact O-N 3.07Å
582	A	60.1	Low	63.8	Low	51 Å²	51	103.5 Å²	103.5	42%	0.421	53%	0.528	S	S	.	.	H	α-helix	trans	-59.1	-44.5	177.4	0	0	0	0	0	112.1	A578 W579 M584 I585 V586	A578-A582 WeakPolarHBondContact O-CB 3.45Å; A578-A582 PolarHBondContact O-N 3.42Å; W579-A582 PolarHBondContact O-N 3.47Å; A582-M584 VanDerWaalsContact C-N 3.34Å; A582-M584 PolarHBondContact O-N 2.91Å; A582-I585 PolarHBondContact O-N 3.46Å; A582-V586 WeakPolarHBondContact O-CG2 3.39Å; A582-V586 PolarHBondContact O-N 3.35Å
583	K	65.4	Low	63.8	Low	111 Å²	111	100.5 Å²	100.5	48%	0.483	53%	0.526	S	S	.	.	H	α-helix	trans	-64.7	-35.9	176.3	-174.2	170.8	-178.2	174.9	0	112.7	W579 K580 I581 N587	W579-K583 HydrophobicContact CH2-CD 3.77Å; W579-K583 HydrophobicContact CZ2-CD 4.3Å; W579-K583 HydrophobicContact CZ3-CD 3.89Å; W579-K583 VanDerWaalsContact O-CB 3.29Å; W579-K583 WeakPolarHBondContact O-CB 3.45Å; W579-K583 PolarHBondContact O-N 2.96Å; K580-K583 PolarHBondContact O-N 2.97Å; I581-K583 VanDerWaalsContact C-N 3.35Å; I581-K583 PolarHBondContact O-N 3.27Å; K583-N587 WeakPolarHBondContact O-CB 3.37Å; K583-N587 PolarHBondContact O-N 3.01Å
584	M	72.9	Confident	63.4	Low	135 Å²	135	103.6 Å²	103.6	67%	0.665	54%	0.535	S	S	*	.	H	α-helix	trans	-65.8	-45.4	175.4	-165.4	177.3	79.4	0	0	111.3	K580 I581 A582 N587 D588	K580-M584 WeakPolarHBondContact O-CB 3.4Å; K580-M584 PolarHBondContact O-N 3.42Å; I581-M584 WeakPolarHBondContact O-CB 3.3Å; I581-M584 PolarHBondContact O-N 3.25Å; I581-M584 VanDerWaalsContact O-N 3.16Å; A582-M584 VanDerWaalsContact C-N 3.34Å; A582-M584 PolarHBondContact O-N 2.91Å; M584-N587 PolarHBondContact O-N 3.28Å; M584-D588 WeakPolarHBondContact O-CB 3.39Å; M584-D588 PolarHBondContact O-N 2.93Å
585	I	72.3	Confident	63.4	Low	97 Å²	97	105.6 Å²	105.6	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-61.4	-46.1	176.5	-65.9	164.3	0	0	0	111.1	I581 A582 D588 V589	I581-I585 HydrophobicContact CG2-CD1 3.85Å; I581-I585 WeakPolarHBondContact O-CG1 3.41Å; I581-I585 PolarHBondContact O-N 3.07Å; A582-I585 PolarHBondContact O-N 3.46Å; I585-D588 PolarHBondContact O-N 2.96Å; I585-V589 WeakPolarHBondContact O-CG2 3.43Å; I585-V589 PolarHBondContact O-N 3.3Å
586	V	68.3	Low	62.8	Low	88 Å²	88	106 Å²	106	53%	0.533	55%	0.55	S	S	.	*	H	α-helix	trans	-62.6	-44	178.6	170.3	0	0	0	0	111.4	A582 V590	A582-V586 WeakPolarHBondContact O-CG2 3.39Å; A582-V586 PolarHBondContact O-N 3.35Å; V586-V590 WeakPolarHBondContact O-CB 3.38Å; V586-V590 VanDerWaalsContact O-CG2 3.25Å; V586-V590 WeakPolarHBondContact O-CG2 3.25Å; V586-V590 PolarHBondContact O-N 2.85Å
587	N	68.5	Low	62.3	Low	81 Å²	81	106.1 Å²	106.1	43%	0.433	56%	0.563	S	S	.	*	H	α-helix	trans	-62.2	-42.4	175.1	-85.2	22.1	0	0	0	111.9	K583 M584 V590 H591	K583-N587 WeakPolarHBondContact O-CB 3.37Å; K583-N587 PolarHBondContact O-N 3.01Å; M584-N587 PolarHBondContact O-N 3.28Å; N587-V590 PolarHBondContact O-N 2.81Å; N587-H591 PolarHBondContact O-CD2 3.39Å; N587-H591 PolarHBondContact O-N 3.46Å
588	D	63.8	Low	61.1	Low	92 Å²	92	105.4 Å²	105.4	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-42.6	-177.8	-157.8	54.9	0	0	0	111.6	M584 I585 V590 H591 Q592	M584-D588 WeakPolarHBondContact O-CB 3.39Å; M584-D588 PolarHBondContact O-N 2.93Å; I585-D588 PolarHBondContact O-N 2.96Å; D588-V590 PolarHBondContact O-N 2.88Å; D588-H591 PolarHBondContact O-N 3.01Å; D588-Q592 WeakPolarHBondContact O-CB 3.46Å; D588-Q592 VanDerWaalsContact O-CG 3.26Å; D588-Q592 WeakPolarHBondContact O-CG 3.26Å; D588-Q592 PolarHBondContact O-N 2.92Å; D588-Q592 PolarHBondContact OD2-NE2 2.76Å
589	V	66.9	Low	60.4	Low	84 Å²	84	106.4 Å²	106.4	51%	0.509	58%	0.583	S	S	.	*	H	α-helix	trans	-60.7	-42.6	171.9	171.6	0	0	0	0	111.6	I585 H591 Q592 S593	I585-V589 WeakPolarHBondContact O-CG2 3.43Å; I585-V589 PolarHBondContact O-N 3.3Å; V589-H591 VanDerWaalsContact C-N 3.33Å; V589-H591 PolarHBondContact O-N 3.39Å; V589-Q592 PolarHBondContact O-N 3.39Å; V589-S593 WeakPolarHBondContact O-CB 3.49Å; V589-S593 PolarHBondContact O-N 3.48Å; V589-S593 PolarHBondContact O-OG 3.06Å
590	V	65.6	Low	59.1	Low	71 Å²	71	108.5 Å²	108.5	43%	0.43	60%	0.597	S	S	.	*	H	α-helix	trans	-68.7	-29.7	177.4	169.1	0	0	0	0	112.2	V586 N587 D588 S593 N594	V586-V590 WeakPolarHBondContact O-CB 3.38Å; V586-V590 VanDerWaalsContact O-CG2 3.25Å; V586-V590 WeakPolarHBondContact O-CG2 3.25Å; V586-V590 PolarHBondContact O-N 2.85Å; N587-V590 PolarHBondContact O-N 2.81Å; D588-V590 PolarHBondContact O-N 2.88Å; V590-S593 PolarHBondContact O-OG 3.08Å; V590-S593 VanDerWaalsContact O-OG 3.12Å; V590-N594 PolarHBondContact O-ND2 3.22Å
591	H	61.1	Low	58	Low	117 Å²	117	108 Å²	108	54%	0.542	61%	0.609	S	S	.	*	H	α-helix	trans	-76.5	-39.4	173.1	-75.2	-54.8	0	0	0	112.2	N587 D588 V589 N594	N587-H591 PolarHBondContact O-CD2 3.39Å; N587-H591 PolarHBondContact O-N 3.46Å; D588-H591 PolarHBondContact O-N 3.01Å; V589-H591 VanDerWaalsContact C-N 3.33Å; V589-H591 PolarHBondContact O-N 3.39Å; H591-N594 PolarHBondContact O-N 3.25Å
592	Q	59.2	Low	56.8	Low	118 Å²	118	109.9 Å²	109.9	55%	0.551	62%	0.624	S	S	*	*	H	α-helix	trans	-61.5	-44.7	173.3	-69.6	173.3	32.7	0	0	111.3	D588 V589 N594 H595	D588-Q592 WeakPolarHBondContact O-CB 3.46Å; D588-Q592 VanDerWaalsContact O-CG 3.26Å; D588-Q592 WeakPolarHBondContact O-CG 3.26Å; D588-Q592 PolarHBondContact O-N 2.92Å; D588-Q592 PolarHBondContact OD2-NE2 2.76Å; V589-Q592 PolarHBondContact O-N 3.39Å; Q592-N594 PolarHBondContact O-N 3.1Å; Q592-N594 VanDerWaalsContact O-N 3.08Å; Q592-H595 PolarHBondContact O-N 3.12Å; Q592-H595 VanDerWaalsContact O-N 3.1Å
593	S	54.8	Low	56	Low	88 Å²	88	116.2 Å²	116.2	62%	0.615	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-10.5	178.4	72.7	0	0	0	0	114.9	V589 V590	V589-S593 WeakPolarHBondContact O-CB 3.49Å; V589-S593 PolarHBondContact O-N 3.48Å; V589-S593 PolarHBondContact O-OG 3.06Å; V590-S593 PolarHBondContact O-OG 3.08Å; V590-S593 VanDerWaalsContact O-OG 3.12Å
594	N	52.5	Low	54.5	Low	126 Å²	126	120.8 Å²	120.8	67%	0.674	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-0.9	176.3	-83.3	-75.4	0	0	0	113.5	V590 H591 Q592	V590-N594 PolarHBondContact O-ND2 3.22Å; H591-N594 PolarHBondContact O-N 3.25Å; Q592-N594 PolarHBondContact O-N 3.1Å; Q592-N594 VanDerWaalsContact O-N 3.08Å
595	H	55.7	Low	53.6	Low	165 Å²	165	120.1 Å²	120.1	76%	0.764	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-17.2	-174.5	-112.2	-67.3	0	0	0	115.8	Q592 S597	Q592-H595 PolarHBondContact O-N 3.12Å; Q592-H595 VanDerWaalsContact O-N 3.1Å; H595-S597 PolarHBondContact O-N 3.17Å; H595-S597 VanDerWaalsContact O-N 3.17Å
596	D	45.4	Very low	52.6	Low	142 Å²	142	121.3 Å²	121.3	76%	0.759	69%	0.689	S	S	*	*			trans	-82.8	89.4	175.3	-100.4	-45.1	0	0	0	112.1
597	S	48.1	Very low	51.8	Low	111 Å²	111	123.1 Å²	123.1	78%	0.776	70%	0.698	S	S	*	*			trans	-150.7	74.2	166.7	-80.7	0	0	0	0	112.6	H595 G599	H595-S597 PolarHBondContact O-N 3.17Å; H595-S597 VanDerWaalsContact O-N 3.17Å; S597-G599 PolarHBondContact O-N 3.32Å
598	P	43.1	Very low	50.8	Low	110 Å²	110	125.6 Å²	125.6	71%	0.714	71%	0.714	S	S	*	*			trans	-81.7	77.4	175.7	34	-34.6	0	0	0	111.6	K600	P598-K600 PolarHBondContact O-N 3.06Å
599	G	43.7	Very low	50	Low	79 Å²	79	127.7 Å²	127.7	81%	0.814	73%	0.727	S	S	*	*			trans	-62.5	123.9	172.5	0	0	0	0	0	112.2	S597	S597-G599 PolarHBondContact O-N 3.32Å
600	K	40.5	Very low	48.8	Very low	205 Å²	205	130.6 Å²	130.6	89%	0.891	74%	0.742	S	S	*	*			trans	-123.2	106.9	169	-74.6	-170.7	177.7	178.3	0	111.1	P598	P598-K600 PolarHBondContact O-N 3.06Å
601	S	43.3	Very low	47.6	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	76%	0.764	S	S	*	*			trans	-75	-179.3	167	-174.5	0	0	0	0	111
602	T	42.5	Very low	46.6	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	78%	0.781	S	S	*	*			trans	82.4	137.6	175.1	65.9	0	0	0	0	117.5
603	K	41.9	Very low	45.6	Very low	184 Å²	184	137.8 Å²	137.8	80%	0.8	80%	0.8	S	S	*	*			cis	-170	154	-24.1	-141.7	-177.3	-179.6	-177.8	0	110.1
604	V	35.3	Very low	44.7	Very low	207 Å²	207	142.3 Å²	142.3	100%	1.255	82%	0.817	S	S	*	*			trans	63.7	0	166.6	-171.2	0	0	0	0	114.7

Retrieved 604 of 604 residues in 174.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).