A0A087YAJ4_POEFO Loading...

FYVE, RhoGEF and PH domain containing 3

AlphaFold DB , UniProt , Accession A0A087YAJ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 902 aa.

						>A0A087YAJ4_POEFO|A0A087YAJ4
MQGVSATDLPASSLQYSCGSVDYLCSPRLAKKGPTTRPCHDKPAIKPRPQTSTLPRPPTAQKPQVPPKPAHLLALGQDKKPKRIPPAPSRPLPAPPPPPKPKPCLSPTGQGAQPQKEPQKVGQLIERFNNSRVPILGVLPRSQLHLCLRMDTASDLPPSCSADASAKVAGDSSSVDKFALSPSERTDGVSELSRIAAMHIDGSDDGVLDDCVEHDIAQRVGCISDADHEQSSSHKLTDNTDSSQQNGKIPNRDSGIDSPSCATEGEAFPNEDAIDEEDHYDSVTETESVSCCVTLDNKRDSTQDEDSDLDEGSSGEIPSLTDTQTGYLTDAHSDTHKCSEAQKLLNIAKELLHTEEAYVKRLNLLDQVFCTKLTEASIPQDVITGIFSNISSIYLFHDQFLLPELKTRITGEWESNPRIGDILQKLAPFMKMYGEYVKNFDRSMDLVNTWTQRSSQFKSVVQNIQKQEVCGNLTLQHHMLEPVQRIPRYELLLKDYLKKLPDDALDRKDAEKALELISTAANHSNAAIRKMEKMNKLLEVYERLGGEEDIVNPANELIKEGHIKKMSAKNGTAQDRYLYLFNNMVLYCVPKLRLMGQKFSVRERIDIAGMEVQENVKQNVPHTFVIIGKQRSLELQARTAEEKEDWIQVIKATIERHKQNSETFNKAFSSSFSREDDHVPESPGPNSFMDSDGLHERKSSKKKEKEKQTCRGCHESFNFTKRKHHCKSCGVPICAKCSKTLDNKTSRVCPECFEASLSVEMMCGGEQKRKAAPERQLSLTGDSCLLCGYLQVQEKGKSWAKMWVALTKTEPLVLYLQSSGQDLKGSRAVPLPGFEVSMVPSATADKPEVKNVFKLSHSQQTFLLSAQDAELQAKWVEVLSKASRGEAPAEASMSLTEHRKSQ
					

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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	29.1	Very low	34.4	Very low	227 Å²	227	127.1 Å²	127.1	100%	1.118	78%	0.78	S	S	*	*				0	147.5	0	-68.9	-50.5	-172.5	0	0	109.2
2	Q	29.4	Very low	34	Very low	171 Å²	171	126.8 Å²	126.8	80%	0.799	79%	0.786	S	S	*	*			trans	-61	160.7	169.9	-59	90	-34.3	0	0	109.7
3	G	32	Very low	33.5	Very low	66 Å²	66	124.9 Å²	124.9	68%	0.68	78%	0.781	S	S	*	*			cis	107.7	156.4	21.2	0	0	0	0	0	110.5
4	V	35.4	Very low	33.2	Very low	145 Å²	145	126.8 Å²	126.8	88%	0.879	78%	0.782	S	S	*	*			trans	75	144.6	174.2	-171	0	0	0	0	115.4
5	S	38.3	Very low	32.9	Very low	103 Å²	103	127.7 Å²	127.7	72%	0.72	77%	0.774	S	S	*	*			cis	-167.2	172.1	-37.5	66.2	0	0	0	0	110.7
6	A	38.5	Very low	32.6	Very low	86 Å²	86	133.2 Å²	133.2	71%	0.711	78%	0.778	S	S	*	*			trans	68.4	159.9	157.6	0	0	0	0	0	118.2
7	T	34.9	Very low	32.5	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.724	77%	0.774	S	S	*	*			cis	-149	165	1.9	-17.9	0	0	0	0	111.9
8	D	30	Very low	32.3	Very low	128 Å²	128	131.6 Å²	131.6	68%	0.684	78%	0.782	S	S	*	*			trans	61.7	117.1	150.3	-60.5	-36.6	0	0	0	125
9	L	32.5	Very low	32	Very low	152 Å²	152	128.1 Å²	128.1	80%	0.796	78%	0.776	S	S	*	*				43.4	158	116.6	-61.4	172.6	0	0	0	122.4
10	P	49.3	Very low	31.8	Very low	116 Å²	116	127.2 Å²	127.2	75%	0.753	78%	0.776	S	S	*	*			cis	-139.3	-173.9	-29.1	37.5	-18.8	0	0	0	114.6
11	A	29.3	Very low	31.7	Very low	86 Å²	86	127 Å²	127	71%	0.711	78%	0.775	S	S	*	*			trans	124.2	133.9	135	0	0	0	0	0	120.1
12	S	28.8	Very low	31.8	Very low	123 Å²	123	122.2 Å²	122.2	86%	0.86	75%	0.753	S	S	*	*			trans	65.6	163.5	152.1	73.6	0	0	0	0	122
13	S	28.4	Very low	31.7	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	76%	0.756	S	S	*	*			trans	-159.5	177.4	-160.1	-58.3	0	0	0	0	110.2
14	L	29.1	Very low	31.7	Very low	151 Å²	151	128.8 Å²	128.8	79%	0.791	76%	0.763	S	S	*	*			trans	72.7	156.2	172.8	-47.1	173.7	0	0	0	113.5
15	Q	29.1	Very low	31.4	Very low	141 Å²	141	128 Å²	128	66%	0.659	76%	0.762	S	S	*	*			cis	-163.4	159.2	-13.4	-118.6	169.3	-8.8	0	0	108.6
16	Y	28	Very low	31.2	Very low	215 Å²	215	127.9 Å²	127.9	84%	0.843	76%	0.762	S	S	*	*				154.9	164.5	127.6	-97.1	-78.7	0	0	0	113.9
17	S	30.7	Very low	32	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	77%	0.769	S	S	*	*			trans	-149.8	157.6	-167.1	56.5	0	0	0	0	113.4
18	C	28	Very low	32	Very low	135 Å²	135	135.5 Å²	135.5	91%	0.912	78%	0.776	S	S	*	*			trans	69.1	143	158.4	-156.8	0	0	0	0	119.6
19	G	26.8	Very low	32.3	Very low	65 Å²	65	137.3 Å²	137.3	67%	0.67	79%	0.785	S	S	*	*			trans	131.4	80.1	143.3	0	0	0	0	0	121.1
20	S	28.5	Very low	32.3	Very low	111 Å²	111	134 Å²	134	78%	0.776	78%	0.78	S	S	*	*			trans	60.9	150.3	130.4	-146.1	0	0	0	0	124.1
21	V	29.5	Very low	31.6	Very low	124 Å²	124	138.2 Å²	138.2	75%	0.752	79%	0.786	S	S	*	*			trans	53.1	155.6	158.5	-72.2	0	0	0	0	120
22	D	30.1	Very low	31.7	Very low	125 Å²	125	144 Å²	144	67%	0.668	80%	0.795	S	S	*	*			cis	-151.9	176.3	-5.3	-135	-44.3	0	0	0	111.1
23	Y	27.6	Very low	31.8	Very low	219 Å²	219	141.5 Å²	141.5	86%	0.859	79%	0.789	S	S	*	*				150.9	133.2	127.9	-96.1	-83.2	0	0	0	116.8
24	L	32.8	Very low	32.6	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	79%	0.791	S	S	*	*			trans	-93.1	155.6	165.4	-71.6	155.7	0	0	0	110.6
25	C	28.9	Very low	32.9	Very low	128 Å²	128	140.9 Å²	140.9	87%	0.865	79%	0.79	S	S	*	*				175.8	171.2	97.4	-139.9	0	0	0	0	113.9
26	S	33.3	Very low	33	Very low	102 Å²	102	140.2 Å²	140.2	71%	0.713	80%	0.795	S	S	*	*			trans	-114.3	177.5	173.4	-47.5	0	0	0	0	111.5
27	P	56.2	Low	33.4	Very low	134 Å²	134	141 Å²	141	87%	0.87	80%	0.797	S	S	*	*				-142.3	-164.2	111.7	34.1	-16.9	0	0	0	115
28	R	34.8	Very low	34.6	Very low	229 Å²	229	141.2 Å²	141.2	86%	0.864	80%	0.795	S	S	*	*			trans	-123.6	155.7	-160.7	-54.7	167.6	171.9	-179.6	-3.4	113.7
29	L	36.4	Very low	34.7	Very low	166 Å²	166	140.3 Å²	140.3	87%	0.869	79%	0.789	S	S	*	*				164	121.9	114.8	-89.2	164.4	0	0	0	118.4
30	A	32	Very low	35.3	Very low	84 Å²	84	145.3 Å²	145.3	69%	0.694	80%	0.795	S	S	*	*			trans	44.5	128.8	135.3	0	0	0	0	0	126.2
31	K	34.7	Very low	35.6	Very low	203 Å²	203	145 Å²	145	88%	0.883	79%	0.785	S	S	*	*				179.8	126.2	108.7	-100.2	173.8	-178.1	173.6	0	118.2
32	K	32.1	Very low	35.9	Very low	208 Å²	208	148 Å²	148	90%	0.904	79%	0.787	S	S	*	*			trans	30.1	128.6	144.8	-66.5	-170.9	173.6	-173.2	0	126.3
33	G	29.8	Very low	36.8	Very low	70 Å²	70	147.6 Å²	147.6	72%	0.722	79%	0.792	S	S	*	*				91.1	151.8	118.3	0	0	0	0	0	119
34	P	45.6	Very low	36.9	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	79%	0.785	S	S	*	*			cis	-104.5	-170.2	8.4	16	8.6	0	0	0	112.8
35	T	35	Very low	36.8	Very low	125 Å²	125	142 Å²	142	77%	0.767	79%	0.788	S	S	*	*			cis	82.4	135.6	12.5	68.6	0	0	0	0	117.6
36	T	32.7	Very low	36.9	Very low	127 Å²	127	145 Å²	145	78%	0.779	79%	0.786	S	S	*	*			cis	-158.6	-166.3	7.2	-7.4	0	0	0	0	108.9
37	R	36.2	Very low	37.6	Very low	231 Å²	231	145.5 Å²	145.5	87%	0.872	79%	0.787	S	S	*	*			cis	-154.4	-172.6	8.3	-120.2	-170.1	-172.5	-132.1	-0.9	108.7
38	P	55.8	Low	36.2	Very low	106 Å²	106	150.1 Å²	150.1	69%	0.688	79%	0.787	S	S	*	*			trans	-126	172.3	-156.2	45.4	-37.1	0	0	0	119.8
39	C	29.7	Very low	36.5	Very low	116 Å²	116	144.8 Å²	144.8	78%	0.784	78%	0.782	S	S	*	*				173.3	143.4	124.1	-96.4	0	0	0	0	118.2
40	H	39	Very low	36	Very low	171 Å²	171	146.2 Å²	146.2	79%	0.792	78%	0.784	S	S	*	*			trans	76.8	134.6	150.2	-87.4	-90.9	0	0	0	128.2
41	D	35	Very low	35.9	Very low	105 Å²	105	148.7 Å²	148.7	56%	0.561	79%	0.791	S	S	*	*			trans	59.3	110.5	154.2	-84.4	-77.8	0	0	0	127.6
42	K	35.2	Very low	35.5	Very low	185 Å²	185	145 Å²	145	80%	0.804	79%	0.79	S	S	*	*			trans	57.1	165.8	132.2	-76.1	177.7	-170.2	154.7	0	122
43	P	49.4	Very low	35.3	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	78%	0.783	S	S	*	*			cis	-128.5	-166.8	-0.3	43.2	-27.2	0	0	0	115.5
44	A	30.6	Very low	35.4	Very low	86 Å²	86	145.1 Å²	145.1	71%	0.711	79%	0.788	S	S	*	*			trans	59	111.2	160	0	0	0	0	0	118.8
45	I	30.1	Very low	35.1	Very low	173 Å²	173	145 Å²	145	89%	0.887	79%	0.787	S	S	*	*			cis	101.4	120.7	41.4	-66.2	170.9	0	0	0	113.6
46	K	31.9	Very low	35.3	Very low	191 Å²	191	150.5 Å²	150.5	83%	0.83	79%	0.794	S	S	*	*			trans	-100.5	-169.7	-177.2	-86.2	178.6	-179.8	177.2	0	109.9
47	P	47.5	Very low	35.4	Very low	111 Å²	111	150 Å²	150	72%	0.721	79%	0.793	S	S	*	*			cis	-138.1	-171.3	-42.6	38	-19.5	0	0	0	113.8
48	R	27.9	Very low	35.5	Very low	232 Å²	232	145.2 Å²	145.2	88%	0.875	79%	0.792	S	S	*	*			trans	26.3	128.9	137.2	-162.5	-178.3	-158.7	176.9	6.8	120.6
49	P	39.4	Very low	34.6	Very low	116 Å²	116	146.7 Å²	146.7	75%	0.753	80%	0.799	S	S	*	*			trans	-94.7	165	-179.5	38.6	-37.1	0	0	0	115.8
50	Q	27.1	Very low	34.8	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	80%	0.797	S	S	*	*			trans	-141.3	173.1	152.9	-90.8	-167.1	-24.4	0	0	110.8
51	T	29.8	Very low	34.5	Very low	136 Å²	136	146.9 Å²	146.9	83%	0.834	80%	0.804	S	S	*	*			trans	-84.4	142.8	-157.9	47.8	0	0	0	0	117.7
52	S	26.7	Very low	34.7	Very low	125 Å²	125	151.2 Å²	151.2	87%	0.874	82%	0.818	S	S	*	*			trans	-169.5	158.9	135.6	58.6	0	0	0	0	114.6
53	T	27.5	Very low	34.7	Very low	121 Å²	121	148.6 Å²	148.6	74%	0.742	82%	0.82	S	S	*	*			trans	-71.6	144.8	-171	45.6	0	0	0	0	119.4
54	L	31.9	Very low	34	Very low	161 Å²	161	152.3 Å²	152.3	84%	0.843	83%	0.827	S	S	*	*			trans	53.8	163.7	138.8	-72.5	167.8	0	0	0	121.6
55	P	39.8	Very low	34.2	Very low	113 Å²	113	154.7 Å²	154.7	73%	0.734	83%	0.833	S	S	*	*			cis	-132.1	158.4	-12	35.9	-17	0	0	0	118
56	R	38.8	Very low	34.6	Very low	241 Å²	241	151.9 Å²	151.9	91%	0.909	83%	0.826	S	S	*	*			trans	18.3	130.3	149.8	-159	-179.3	-145.6	-143.3	7.1	124.4
57	P	33.6	Very low	35.3	Very low	116 Å²	116	148.8 Å²	148.8	75%	0.753	83%	0.825	S	S	*	*			trans	-114.1	178.2	154.9	33.3	-18	0	0	0	115
58	P	38.4	Very low	34.8	Very low	131 Å²	131	153.1 Å²	153.1	85%	0.851	83%	0.833	S	S	*	*			trans	-110	-166.8	-160.1	42.8	-36.8	0	0	0	118.1
59	T	37.4	Very low	35.1	Very low	137 Å²	137	147.4 Å²	147.4	84%	0.84	83%	0.826	S	S	*	*			trans	-89.2	148.1	-167	48.8	0	0	0	0	117.6
60	A	34.2	Very low	35	Very low	91 Å²	91	147.2 Å²	147.2	75%	0.752	83%	0.833	S	S	*	*			trans	-173.3	135.3	140.8	0	0	0	0	0	117
61	Q	33.3	Very low	35.6	Very low	201 Å²	201	145.1 Å²	145.1	94%	0.939	82%	0.823	S	S	*	*			trans	69.4	166.9	145.2	-64.3	-174.4	15.7	0	0	123.5
62	K	39.2	Very low	36	Very low	196 Å²	196	145.7 Å²	145.7	85%	0.852	82%	0.82	S	S	*	*			trans	-105.2	155.9	-168	-70.7	-179	176	179.5	0	113.5
63	P	35.3	Very low	36.7	Very low	130 Å²	130	148.2 Å²	148.2	84%	0.844	82%	0.823	S	S	*	*			trans	-74.5	157.2	164.9	-13.5	30	0	0	0	114.2
64	Q	32.8	Very low	37.1	Very low	195 Å²	195	146.6 Å²	146.6	91%	0.911	82%	0.822	S	S	*	*			trans	-107.5	170.6	175.1	-75.7	-179	-42.4	0	0	113
65	V	34.8	Very low	37.1	Very low	136 Å²	136	147.8 Å²	147.8	82%	0.824	83%	0.828	S	S	*	*			trans	-105.9	143.7	177.4	179.6	0	0	0	0	110.4
66	P	38.3	Very low	36.7	Very low	114 Å²	114	145.5 Å²	145.5	74%	0.74	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-69.2	154.2	179.9	-20.1	33.5	0	0	0	115.1
67	P	46.7	Very low	36.3	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-84.5	164	-178.5	34.5	-36.4	0	0	0	114.5
68	K	37	Very low	36.2	Very low	202 Å²	202	143.5 Å²	143.5	88%	0.878	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-82.4	153.3	172.5	-82.3	-176.3	173.8	-179.5	0	112.7
69	P	35.1	Very low	36	Very low	112 Å²	112	145 Å²	145	73%	0.727	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.8	146.2	177	-19	32.8	0	0	0	114.2	H71	P69-H71 PolarHBondContact O-N 3.44Å
70	A	36.8	Very low	35.9	Very low	111 Å²	111	148 Å²	148	92%	0.917	81%	0.814	S	S	*	*	S	Bend	trans	-92.2	95	-175.4	0	0	0	0	0	113.2
71	H	39.5	Very low	36.1	Very low	152 Å²	152	149.4 Å²	149.4	70%	0.704	82%	0.816	S	S	*	*			trans	-142.1	14	168.2	67.9	-88.3	0	0	0	114.3	P69	P69-H71 PolarHBondContact O-N 3.44Å
72	L	39.5	Very low	36	Very low	148 Å²	148	149.8 Å²	149.8	78%	0.775	82%	0.815	S	S	*	*	S	Bend	trans	-132	39.8	-176.6	-69.9	175.4	0	0	0	112.7
73	L	41.2	Very low	35.9	Very low	179 Å²	179	152 Å²	152	94%	0.937	82%	0.818	S	S	*	*			trans	-137.1	81.9	173.7	-76.3	177.7	0	0	0	111.3
74	A	34.7	Very low	35.9	Very low	86 Å²	86	153.1 Å²	153.1	71%	0.711	82%	0.815	S	S	*	*			trans	-155.7	127.9	164.8	0	0	0	0	0	110.4
75	L	32.6	Very low	36.3	Very low	186 Å²	186	149.2 Å²	149.2	97%	0.974	81%	0.806	S	S	*	*			trans	64.5	136.3	166.1	-51.2	162.4	0	0	0	116.4
76	G	30.3	Very low	36.5	Very low	66 Å²	66	148.6 Å²	148.6	68%	0.68	81%	0.806	S	S	*	*			cis	156.7	142.6	-11.2	0	0	0	0	0	112.6
77	Q	30.9	Very low	36.3	Very low	199 Å²	199	147.4 Å²	147.4	93%	0.93	81%	0.805	S	S	*	*			trans	67.6	160.6	166.7	-61.1	176.6	6.2	0	0	117.6
78	D	32.2	Very low	35.9	Very low	115 Å²	115	147.3 Å²	147.3	62%	0.615	81%	0.805	S	S	*	*			cis	-159.9	160.8	-41.6	-158.4	-10	0	0	0	110.6
79	K	34.2	Very low	36.3	Very low	162 Å²	162	143.7 Å²	143.7	70%	0.704	81%	0.805	S	S	*	*			trans	39.5	106.6	165.1	-71.7	134	-165.2	158.2	0	122.7
80	K	34.9	Very low	36.7	Very low	200 Å²	200	149.2 Å²	149.2	87%	0.87	81%	0.811	S	S	*	*				42.3	130.9	119.2	-75.2	179.9	179.1	173.5	0	120.1
81	P	39.3	Very low	37	Very low	122 Å²	122	149.5 Å²	149.5	79%	0.792	80%	0.803	S	S	*	*				-133.6	179.4	82	40.4	-30.2	0	0	0	112.8
82	K	31.1	Very low	37	Very low	208 Å²	208	150.1 Å²	150.1	90%	0.904	81%	0.811	S	S	*	*			cis	-139.6	-133.9	-2.3	-142.8	167.8	-172.3	176.2	0	109.5
83	R	35.8	Very low	37.1	Very low	243 Å²	243	148.6 Å²	148.6	92%	0.917	81%	0.81	S	S	*	*			trans	-152.3	143.5	163.8	-142	-173.5	-164.7	-172.3	5.1	109.5
84	I	37.1	Very low	37.7	Very low	154 Å²	154	144.2 Å²	144.2	79%	0.79	80%	0.8	S	S	*	*			trans	-131.9	139.4	168.2	-63.5	-179.8	0	0	0	106.4
85	P	39.9	Very low	38.4	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-72.4	159.3	-176.6	29.7	-36.3	0	0	0	113.2
86	P	39.9	Very low	39.1	Very low	124 Å²	124	142.5 Å²	142.5	81%	0.805	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68	143.6	173.8	29.8	-35.1	0	0	0	111.7
87	A	34.4	Very low	40.2	Very low	89 Å²	89	144.8 Å²	144.8	74%	0.736	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.9	149.6	171.4	0	0	0	0	0	111.3
88	P	37.5	Very low	40.9	Very low	124 Å²	124	140.6 Å²	140.6	81%	0.805	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-68.8	137.5	-175.2	27.6	-35.1	0	0	0	112.6	R90	P88-R90 PolarHBondContact O-N 2.72Å
89	S	45.8	Very low	41.3	Very low	125 Å²	125	141.3 Å²	141.3	87%	0.874	80%	0.796	S	S	*	*			trans	-68.7	95.8	177.6	-51	0	0	0	0	111.5
90	R	42.8	Very low	41.6	Very low	229 Å²	229	142.9 Å²	142.9	86%	0.864	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-98.3	117	170.2	-160.1	178.8	-151.2	-135.2	4.6	109.8	P88 L92	P88-R90 PolarHBondContact O-N 2.72Å; R90-L92 PolarHBondContact O-N 2.93Å
91	P	43.8	Very low	41.7	Very low	116 Å²	116	139.3 Å²	139.3	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.3	137.7	168.3	-22.3	33.7	0	0	0	110.3
92	L	38.7	Very low	41.6	Very low	165 Å²	165	142.9 Å²	142.9	86%	0.864	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.2	145.7	167.6	-70	171.7	0	0	0	109.2	R90	R90-L92 PolarHBondContact O-N 2.93Å
93	P	42.9	Very low	41.8	Very low	117 Å²	117	139 Å²	139	76%	0.76	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-61.2	145.7	178.6	-21.5	33.3	0	0	0	112.1
94	A	52.3	Low	41.4	Very low	87 Å²	87	133.7 Å²	133.7	72%	0.719	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.2	146.3	165.9	0	0	0	0	0	110.1
95	P	50.5	Low	41.1	Very low	116 Å²	116	134.8 Å²	134.8	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.7	147.9	174.8	27.1	-34.7	0	0	0	110.8
96	P	47.2	Very low	40.7	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-64.9	142	-177.9	27.1	-34.6	0	0	0	111.3
97	P	52.2	Low	40.4	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.1	154.4	175.4	29.9	-35.3	0	0	0	111.3
98	P	47.2	Very low	40.1	Very low	111 Å²	111	137.2 Å²	137.2	72%	0.721	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-62	151.8	176.3	27	-35	0	0	0	111.7	K100	P98-K100 PolarHBondContact O-N 2.74Å
99	P	39.8	Very low	39.6	Very low	130 Å²	130	135 Å²	135	84%	0.844	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.7	-176.4	26.2	-34.4	0	0	0	111.5
100	K	40.4	Very low	38.9	Very low	195 Å²	195	138.9 Å²	138.9	85%	0.848	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.2	140.4	171	-64.9	-176.6	179.7	-178.1	0	109.9	P98	P98-K100 PolarHBondContact O-N 2.74Å
101	P	37.2	Very low	38	Very low	125 Å²	125	131.7 Å²	131.7	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-64.9	149	171.5	28.4	-34.4	0	0	0	111.1
102	K	36.8	Very low	37.3	Very low	197 Å²	197	131 Å²	131	86%	0.857	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.2	147.5	170.7	-72.9	-177.8	177	178.9	0	110.3
103	P	35.6	Very low	36.8	Very low	125 Å²	125	132.2 Å²	132.2	81%	0.812	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-78	138.2	175.2	32	-33.7	0	0	0	111.5
104	C	27.7	Very low	36.4	Very low	133 Å²	133	132.6 Å²	132.6	90%	0.899	82%	0.821	S	S	*	*			trans	-118.9	153	159	-78.7	0	0	0	0	109
105	L	31	Very low	35.4	Very low	176 Å²	176	137.3 Å²	137.3	92%	0.921	83%	0.829	S	S	*	*			trans	-76.6	144.1	-169.3	-68.9	145.6	0	0	0	112.3
106	S	30.1	Very low	34.7	Very low	109 Å²	109	141.1 Å²	141.1	76%	0.762	83%	0.833	S	S	*	*			trans	-82.2	154.6	165.6	53.1	0	0	0	0	111.2
107	P	34.2	Very low	34.2	Very low	125 Å²	125	142.1 Å²	142.1	81%	0.812	83%	0.828	S	S	*	*				-118	145.7	123.3	-7.4	26.6	0	0	0	113.9
108	T	28.6	Very low	33.4	Very low	143 Å²	143	141.6 Å²	141.6	88%	0.877	82%	0.824	S	S	*	*			trans	-42	138.8	170.6	46.1	0	0	0	0	117.7
109	G	27.7	Very low	32.8	Very low	77 Å²	77	143.3 Å²	143.3	79%	0.794	82%	0.823	S	S	*	*			trans	179.3	138.3	161.3	0	0	0	0	0	111.1
110	Q	29.2	Very low	32.8	Very low	207 Å²	207	143.8 Å²	143.8	97%	0.967	81%	0.812	S	S	*	*			trans	-121	142.6	-173.6	-66.2	177.7	-11.5	0	0	112.2
111	G	25.8	Very low	32.8	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	79%	0.794	S	S	*	*			trans	173.3	114.2	169	0	0	0	0	0	117
112	A	27.5	Very low	32.8	Very low	102 Å²	102	134.2 Å²	134.2	84%	0.843	78%	0.775	S	S	*	*			trans	60.9	116.1	153.9	0	0	0	0	0	122.9
113	Q	29.7	Very low	33.4	Very low	191 Å²	191	129.5 Å²	129.5	89%	0.893	76%	0.756	S	S	*	*			trans	33.3	133.2	148.3	-62.5	-162.8	-6.4	0	0	124
114	P	33.8	Very low	34.1	Very low	124 Å²	124	124.5 Å²	124.5	81%	0.805	72%	0.722	S	S	*	*			trans	-90.3	149.8	166.2	36.7	-33.5	0	0	0	113.9
115	Q	32.2	Very low	35.2	Very low	186 Å²	186	121.8 Å²	121.8	87%	0.869	70%	0.698	S	S	*	*			trans	-76.9	148.7	175	-71.5	-177.3	-24.5	0	0	113.7	E117	Q115-E117 PolarHBondContact O-N 3.35Å
116	K	35.3	Very low	35.8	Very low	196 Å²	196	119 Å²	119	85%	0.852	68%	0.68	S	S	*	*	S	Bend	trans	-87.3	80.2	-178.3	-70	-179.9	176.9	174.6	0	113.3
117	E	36.8	Very low	36.9	Very low	140 Å²	140	121.3 Å²	121.3	65%	0.654	67%	0.672	S	S	*	*			trans	-141.3	-29.9	167.7	-149.9	137.3	-128.4	0	0	119.1	Q115 Q119	Q115-E117 PolarHBondContact O-N 3.35Å; E117-Q119 PolarHBondContact O-N 2.77Å; E117-Q119 VanDerWaalsContact O-N 3.08Å
118	P	34	Very low	37.4	Very low	104 Å²	104	116.1 Å²	116.1	68%	0.675	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-14.1	-173.3	27.1	-34.3	0	0	0	114.7	K120	P118-K120 PolarHBondContact O-N 2.61Å
119	Q	34.5	Very low	38	Very low	148 Å²	148	113 Å²	113	69%	0.692	62%	0.615	S	S	*	*	H	α-helix	trans	-70	-26.7	-175.4	-70.2	179.8	-29.7	0	0	114.2	E117 Q123	E117-Q119 PolarHBondContact O-N 2.77Å; E117-Q119 VanDerWaalsContact O-N 3.08Å; Q119-Q123 WeakPolarHBondContact O-CG 3.44Å; Q119-Q123 PolarHBondContact O-N 3.29Å
120	K	40.2	Very low	38.8	Very low	140 Å²	140	114.5 Å²	114.5	61%	0.609	61%	0.605	S	S	*	*	H	α-helix	trans	-70	-38.3	-177.4	-69.9	177.4	-178.3	168.2	0	112.8	P118 Q123 L124	P118-K120 PolarHBondContact O-N 2.61Å; K120-Q123 PolarHBondContact O-N 3.22Å; K120-L124 PolarHBondContact O-N 3.35Å; K120-L124 VanDerWaalsContact O-N 3.1Å
121	V	41.9	Very low	39.5	Very low	79 Å²	79	107 Å²	107	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-71.1	-40.5	180	-179.4	0	0	0	0	110.8	Q123 L124 I125	V121-Q123 VanDerWaalsContact C-N 3.34Å; V121-Q123 PolarHBondContact O-N 3.14Å; V121-L124 PolarHBondContact O-N 2.94Å; V121-I125 HydrophobicContact CG1-CD1 3.97Å; V121-I125 WeakPolarHBondContact O-CG1 3.19Å; V121-I125 PolarHBondContact O-N 3.09Å
122	G	37.2	Very low	40	Very low	39 Å²	39	109.3 Å²	109.3	40%	0.402	56%	0.56	S	S	.	*	H	α-helix	trans	-56.7	-45.6	173	0	0	0	0	0	112.4	L124 I125 E126	G122-L124 PolarHBondContact O-N 2.81Å; G122-I125 PolarHBondContact O-N 2.83Å; G122-E126 WeakPolarHBondContact O-CB 3.31Å; G122-E126 PolarHBondContact O-N 2.82Å
123	Q	48.6	Very low	40.1	Very low	99 Å²	99	109.1 Å²	109.1	46%	0.463	55%	0.548	S	S	.	.	H	α-helix	trans	-67.1	-32.2	176.6	-70.9	178.5	8.2	0	0	113.6	Q119 K120 V121 R127	Q119-Q123 WeakPolarHBondContact O-CG 3.44Å; Q119-Q123 PolarHBondContact O-N 3.29Å; K120-Q123 PolarHBondContact O-N 3.22Å; V121-Q123 VanDerWaalsContact C-N 3.34Å; V121-Q123 PolarHBondContact O-N 3.14Å; Q123-R127 WeakPolarHBondContact O-CB 3.23Å; Q123-R127 VanDerWaalsContact O-CG 3.24Å; Q123-R127 WeakPolarHBondContact O-CG 3.33Å; Q123-R127 PolarHBondContact O-N 3.2Å
124	L	50.7	Low	40.2	Very low	19 Å²	19	104.7 Å²	104.7	10%	0.099	54%	0.536	C	S	.	.	H	α-helix	trans	-65.6	-45.7	171.3	-109.3	88	0	0	0	111.3	K120 V121 G122 E126 R127 F128 F400 L426 F429	K120-L124 PolarHBondContact O-N 3.35Å; K120-L124 VanDerWaalsContact O-N 3.1Å; V121-L124 PolarHBondContact O-N 2.94Å; G122-L124 PolarHBondContact O-N 2.81Å; L124-E126 VanDerWaalsContact C-N 3.32Å; L124-E126 PolarHBondContact O-N 3.32Å; L124-R127 PolarHBondContact O-N 3.03Å; L124-F128 VanDerWaalsContact O-CB 3.28Å; L124-F128 WeakPolarHBondContact O-CB 3.39Å; L124-F128 PolarHBondContact O-N 3.1Å; L124-F400 HydrophobicContact CD2-CD1 4Å; L124-F400 HydrophobicContact CD2-CE1 4.48Å; L124-F400 HydrophobicContact CG-CD1 4.08Å; L124-F400 HydrophobicContact CG-CE1 4.12Å; L124-L426 HydrophobicContact CD2-CD2 3.72Å; L124-F429 HydrophobicContact CB-CZ 4.49Å; L124-F429 HydrophobicContact CD2-CE2 4.4Å; L124-F429 HydrophobicContact CD2-CZ 4.48Å
125	I	51.2	Low	40.4	Very low	77 Å²	77	107.2 Å²	107.2	40%	0.395	54%	0.541	S	S	.	.	H	α-helix	trans	-62.5	-41	177.5	-68.3	167.8	0	0	0	110.6	V121 G122 F128 N129 F429	V121-I125 HydrophobicContact CG1-CD1 3.97Å; V121-I125 WeakPolarHBondContact O-CG1 3.19Å; V121-I125 PolarHBondContact O-N 3.09Å; G122-I125 PolarHBondContact O-N 2.83Å; I125-F128 PolarHBondContact O-N 3.22Å; I125-N129 WeakPolarHBondContact CG2-ND2 3.4Å; I125-N129 VanDerWaalsContact O-CB 3.27Å; I125-N129 WeakPolarHBondContact O-CB 3.5Å; I125-N129 PolarHBondContact O-N 2.89Å; I125-N129 PolarHBondContact O-ND2 3.47Å; I125-F429 HydrophobicContact CG1-CZ 4.29Å
126	E	43.1	Very low	40.3	Very low	118 Å²	118	105.8 Å²	105.8	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-66.3	-45.7	176.9	-172.1	171.7	-149.6	0	0	111.9	G122 L124 F128 N129 N130	G122-E126 WeakPolarHBondContact O-CB 3.31Å; G122-E126 PolarHBondContact O-N 2.82Å; L124-E126 VanDerWaalsContact C-N 3.32Å; L124-E126 PolarHBondContact O-N 3.32Å; E126-F128 PolarHBondContact O-N 3.24Å; E126-N129 PolarHBondContact O-N 2.83Å; E126-N130 VanDerWaalsContact O-CB 3.26Å; E126-N130 WeakPolarHBondContact O-CB 3.41Å; E126-N130 PolarHBondContact O-N 2.6Å; E126-N130 PolarHBondContact O-ND2 2.95Å
127	R	51.8	Low	39.9	Very low	156 Å²	156	99.9 Å²	99.9	59%	0.589	53%	0.533	S	S	*	.	H	α-helix	trans	-59.4	-45.3	173	-73.9	173.6	-172.7	-173.1	3.7	112	Q123 L124 N130 S131 F400	Q123-R127 WeakPolarHBondContact O-CB 3.23Å; Q123-R127 VanDerWaalsContact O-CG 3.24Å; Q123-R127 WeakPolarHBondContact O-CG 3.33Å; Q123-R127 PolarHBondContact O-N 3.2Å; L124-R127 PolarHBondContact O-N 3.03Å; R127-N130 PolarHBondContact O-N 3.17Å; R127-S131 PolarHBondContact O-N 3.01Å; R127-S131 PolarHBondContact O-OG 3.14Å; R127-F400 HydrophobicContact CB-CE1 4.45Å; R127-F400 HydrophobicContact CB-CZ 4.28Å
128	F	45.4	Very low	39.6	Very low	16 Å²	16	99.5 Å²	99.5	7%	0.07	54%	0.54	C	S	.	.	H	α-helix	trans	-69	-32.3	179.8	-176	-100.2	0	0	0	113.1	L124 I125 E126 S131 R132 F396 F429 M432	L124-F128 VanDerWaalsContact O-CB 3.28Å; L124-F128 WeakPolarHBondContact O-CB 3.39Å; L124-F128 PolarHBondContact O-N 3.1Å; I125-F128 PolarHBondContact O-N 3.22Å; E126-F128 PolarHBondContact O-N 3.24Å; F128-S131 PolarHBondContact O-OG 3.34Å; F128-S131 VanDerWaalsContact O-OG 3.13Å; F128-R132 WeakPolarHBondContact O-CB 3.43Å; F128-R132 PolarHBondContact O-N 3.34Å; F128-F396 HydrophobicContact CE2-CB 4.34Å; F128-F429 HydrophobicContact CB-CE1 4.12Å; F128-F429 HydrophobicContact CD1-CD1 4.05Å; F128-F429 HydrophobicContact CD1-CE1 4Å; F128-F429 HydrophobicContact CD2-CD1 4.29Å; F128-F429 HydrophobicContact CD2-CE1 4.49Å; F128-F429 HydrophobicContact CE1-CD1 4.18Å; F128-F429 HydrophobicContact CE2-CD1 4.43Å; F128-F429 HydrophobicContact CG-CD1 4.1Å; F128-F429 AromaticContact CG-CE1 3.95Å; F128-F429 HydrophobicContact CG-CE1 3.95Å; F128-F429 HydrophobicContact CZ-CD1 4.37Å; F128-M432 HydrophobicContact CE2-CE 4.09Å; F128-M432 HydrophobicContact CZ-CE 3.77Å; F128-M432 HydrophobicContact CZ-SD 4.38Å
129	N	42.1	Very low	39.2	Very low	78 Å²	78	102.7 Å²	102.7	42%	0.417	55%	0.551	S	S	.	*	H	α-helix	trans	-76.9	-35.3	173.7	-74.2	-26.7	0	0	0	111.9	I125 E126 S131 R132	I125-N129 WeakPolarHBondContact CG2-ND2 3.4Å; I125-N129 VanDerWaalsContact O-CB 3.27Å; I125-N129 WeakPolarHBondContact O-CB 3.5Å; I125-N129 PolarHBondContact O-N 2.89Å; I125-N129 PolarHBondContact O-ND2 3.47Å; E126-N129 PolarHBondContact O-N 2.83Å; N129-S131 VanDerWaalsContact C-N 3.35Å; N129-R132 WeakPolarHBondContact O-CA 3.38Å; N129-R132 VanDerWaalsContact O-CB 3.28Å; N129-R132 WeakPolarHBondContact O-CB 3.22Å; N129-R132 PolarHBondContact O-N 3.44Å
130	N	43.2	Very low	38.9	Very low	108 Å²	108	100.3 Å²	100.3	58%	0.578	55%	0.548	S	S	*	.	H	α-helix	trans	-69.1	-31.2	176.1	-70.9	-17.3	0	0	0	112.2	E126 R127 R132	E126-N130 VanDerWaalsContact O-CB 3.26Å; E126-N130 WeakPolarHBondContact O-CB 3.41Å; E126-N130 PolarHBondContact O-N 2.6Å; E126-N130 PolarHBondContact O-ND2 2.95Å; R127-N130 PolarHBondContact O-N 3.17Å; N130-R132 VanDerWaalsContact C-N 3.25Å; N130-R132 PolarHBondContact O-N 2.89Å
131	S	45.1	Very low	38.4	Very low	51 Å²	51	106.2 Å²	106.2	36%	0.357	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-4.5	167.6	60.2	0	0	0	0	114.1	R127 F128 N129	R127-S131 PolarHBondContact O-N 3.01Å; R127-S131 PolarHBondContact O-OG 3.14Å; F128-S131 PolarHBondContact O-OG 3.34Å; F128-S131 VanDerWaalsContact O-OG 3.13Å; N129-S131 VanDerWaalsContact C-N 3.35Å
132	R	35.7	Very low	37.7	Very low	124 Å²	124	107 Å²	107	47%	0.468	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.4	0.2	177.6	-131.3	170.5	176.2	-172.9	-3	114.2	F128 N129 N130	F128-R132 WeakPolarHBondContact O-CB 3.43Å; F128-R132 PolarHBondContact O-N 3.34Å; N129-R132 WeakPolarHBondContact O-CA 3.38Å; N129-R132 VanDerWaalsContact O-CB 3.28Å; N129-R132 WeakPolarHBondContact O-CB 3.22Å; N129-R132 PolarHBondContact O-N 3.44Å; N130-R132 VanDerWaalsContact C-N 3.25Å; N130-R132 PolarHBondContact O-N 2.89Å
133	V	30.1	Very low	37.5	Very low	99 Å²	99	114.4 Å²	114.4	60%	0.6	60%	0.6	S	S	*	*	S	Bend	trans	-66.6	127.8	174.8	-179.8	0	0	0	0	109	I135	V133-I135 PolarHBondContact O-N 3.13Å
134	P	31.1	Very low	36.5	Very low	98 Å²	98	118.2 Å²	118.2	64%	0.636	62%	0.622	S	S	*	*			trans	-68.4	130.9	-173.9	26.5	-34.7	0	0	0	112.2	L136	P134-L136 VanDerWaalsContact C-N 3.26Å; P134-L136 HydrophobicContact CB-CD1 4.39Å; P134-L136 PolarHBondContact O-N 2.83Å
135	I	37.8	Very low	35.4	Very low	176 Å²	176	125.2 Å²	125.2	90%	0.903	65%	0.654	S	S	*	*			trans	-73.7	82.7	170.3	-56.1	179.1	0	0	0	108.9	V133	V133-I135 PolarHBondContact O-N 3.13Å
136	L	31	Very low	34.2	Very low	156 Å²	156	129.4 Å²	129.4	82%	0.817	68%	0.677	S	S	*	*			trans	-136.6	84.7	175.8	-80	173.3	0	0	0	110	P134	P134-L136 VanDerWaalsContact C-N 3.26Å; P134-L136 HydrophobicContact CB-CD1 4.39Å; P134-L136 PolarHBondContact O-N 2.83Å
137	G	27.4	Very low	33.3	Very low	72 Å²	72	128.5 Å²	128.5	74%	0.742	68%	0.682	S	S	*	*	S	Bend	trans	158	73.1	174.2	0	0	0	0	0	117
138	V	28.8	Very low	32	Very low	133 Å²	133	129.2 Å²	129.2	81%	0.806	70%	0.697	S	S	*	*			trans	20.6	115.3	150.1	-173.6	0	0	0	0	118.6	P140	V138-P140 HydrophobicContact CG1-CG 4.2Å
139	L	26.4	Very low	31	Very low	170 Å²	170	139.7 Å²	139.7	89%	0.89	74%	0.736	S	S	*	*			trans	-125.2	117.8	149.3	-106.4	169.3	0	0	0	109.2	R141	L139-R141 PolarHBondContact O-N 3.21Å
140	P	29.2	Very low	30.2	Very low	98 Å²	98	144 Å²	144	64%	0.636	76%	0.755	S	S	*	*			trans	-70.6	125	-177.6	-18.7	32.8	0	0	0	111.9	V138 S142	V138-P140 HydrophobicContact CG1-CG 4.2Å; P140-S142 PolarHBondContact O-N 2.96Å; P140-S142 VanDerWaalsContact O-N 3.09Å
141	R	28.2	Very low	29.4	Very low	264 Å²	264	146.3 Å²	146.3	100%	0.996	77%	0.768	S	S	*	*			trans	-85.8	79.3	-178.9	-150.1	174.3	-168.4	162.2	2.8	111.3	L139	L139-R141 PolarHBondContact O-N 3.21Å
142	S	28.6	Very low	28.4	Very low	97 Å²	97	150.7 Å²	150.7	68%	0.678	79%	0.793	S	S	*	*			trans	-135.5	138.4	166.7	61.1	0	0	0	0	110.3	P140	P140-S142 PolarHBondContact O-N 2.96Å; P140-S142 VanDerWaalsContact O-N 3.09Å
143	Q	32.5	Very low	27.9	Very low	193 Å²	193	149.5 Å²	149.5	90%	0.902	81%	0.809	S	S	*	*			trans	64.9	91.6	-165.9	-52.1	-172.5	18	0	0	115.3
144	L	28	Very low	27.7	Very low	179 Å²	179	149.9 Å²	149.9	94%	0.937	82%	0.816	S	S	*	*				-157.8	112.4	120.8	-103.9	175.9	0	0	0	107.4
145	H	26.2	Very low	27.4	Very low	167 Å²	167	152.9 Å²	152.9	77%	0.773	83%	0.827	S	S	*	*			trans	-110.7	98.7	-178.8	179.9	-82.1	0	0	0	108.5	C147	H145-C147 PolarHBondContact CE1-SG 3.14Å
146	L	25.9	Very low	26.8	Very low	165 Å²	165	152.5 Å²	152.5	86%	0.864	83%	0.826	S	S	*	*			trans	-110.4	107	178.8	-161	71.8	0	0	0	109.3
147	C	25.7	Very low	27.1	Very low	98 Å²	98	150.5 Å²	150.5	66%	0.662	82%	0.822	S	S	*	*			trans	-69.6	140.8	171.8	-74.5	0	0	0	0	110.5	H145	H145-C147 PolarHBondContact CE1-SG 3.14Å
148	L	23.8	Very low	28.1	Very low	172 Å²	172	152.3 Å²	152.3	90%	0.901	82%	0.821	S	S	*	*			trans	-66.3	131.1	165.4	-66.5	166.1	0	0	0	110
149	R	23.6	Very low	27.9	Very low	235 Å²	235	151.8 Å²	151.8	89%	0.887	82%	0.823	S	S	*	*			trans	-137.7	128.1	143.2	-82.5	-162.6	173.7	179.9	-3.3	108.7
150	M	26.1	Very low	27.7	Very low	169 Å²	169	149.9 Å²	149.9	83%	0.833	82%	0.823	S	S	*	*			trans	-77.3	164.7	152.3	-58	177.7	-66.1	0	0	107.4
151	D	25.7	Very low	27.6	Very low	157 Å²	157	151.2 Å²	151.2	84%	0.84	83%	0.834	S	S	*	*				-164.7	157.1	123.2	-90.9	-30.9	0	0	0	109.8
152	T	25	Very low	27.6	Very low	143 Å²	143	143.1 Å²	143.1	88%	0.877	82%	0.824	S	S	*	*			trans	-86.6	165.1	178.4	45.8	0	0	0	0	111.5
153	A	24.8	Very low	27.5	Very low	98 Å²	98	145.9 Å²	145.9	81%	0.81	83%	0.831	S	S	*	*			trans	-125.7	129	177.8	0	0	0	0	0	111.5
154	S	26.8	Very low	27.4	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	83%	0.828	S	S	*	*			trans	-146.6	153.1	165.5	-72.5	0	0	0	0	110.6
155	D	23.5	Very low	27.3	Very low	161 Å²	161	138.1 Å²	138.1	86%	0.861	82%	0.82	S	S	*	*			trans	80.6	151.1	158.5	-55.3	-39	0	0	0	121.7
156	L	26.1	Very low	27.4	Very low	167 Å²	167	134.6 Å²	134.6	87%	0.874	82%	0.819	S	S	*	*			trans	-109.4	-164.1	-163.4	-70.8	154.2	0	0	0	109.1
157	P	37	Very low	27.5	Very low	114 Å²	114	136.1 Å²	136.1	74%	0.74	82%	0.819	S	S	*	*			cis	-138.3	-144.5	2.1	38.3	-13.5	0	0	0	112.3
158	P	47.3	Very low	27.6	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	83%	0.828	S	S	*	*				-123.3	170.6	-61.2	28.2	-10.3	0	0	0	113.6
159	S	24.9	Very low	27.7	Very low	122 Å²	122	135 Å²	135	85%	0.853	83%	0.826	S	S	*	*				174.3	163.7	124.1	43.2	0	0	0	0	112.1
160	C	23.1	Very low	27.8	Very low	130 Å²	130	127.3 Å²	127.3	88%	0.878	82%	0.82	S	S	*	*			trans	-122.4	147.2	-167.4	-50.3	0	0	0	0	112.7
161	S	26.7	Very low	27.8	Very low	125 Å²	125	126.5 Å²	126.5	87%	0.874	82%	0.819	S	S	*	*			trans	-166.2	142.4	145.2	54.6	0	0	0	0	110.5
162	A	28.8	Very low	27.9	Very low	95 Å²	95	123.6 Å²	123.6	79%	0.785	81%	0.811	S	S	*	*			trans	-114.6	145.8	168.2	0	0	0	0	0	109.1
163	D	25.6	Very low	27.9	Very low	154 Å²	154	122.3 Å²	122.3	82%	0.824	81%	0.808	S	S	*	*			trans	-177.1	144.1	133.9	-118.5	-38.6	0	0	0	112.5
164	A	30.1	Very low	28.1	Very low	102 Å²	102	122.5 Å²	122.5	84%	0.843	80%	0.803	S	S	*	*			trans	-165.7	100.8	161.9	0	0	0	0	0	110
165	S	26.1	Very low	28.1	Very low	108 Å²	108	123.4 Å²	123.4	76%	0.755	80%	0.804	S	S	*	*			trans	-125.4	147.8	-173.7	-79	0	0	0	0	114.9
166	A	29.7	Very low	28.3	Very low	92 Å²	92	121.2 Å²	121.2	76%	0.76	79%	0.792	S	S	*	*			trans	91.5	152.3	145	0	0	0	0	0	122.5
167	K	26.2	Very low	28.5	Very low	197 Å²	197	119.7 Å²	119.7	86%	0.857	78%	0.779	S	S	*	*			trans	83.9	109	170.2	-55.2	-174.3	-178.5	-178.8	0	116.1
168	V	27.8	Very low	27.9	Very low	143 Å²	143	123.1 Å²	123.1	87%	0.867	78%	0.782	S	S	*	*			cis	92	127.8	18	-171.3	0	0	0	0	116
169	A	27.7	Very low	27	Very low	104 Å²	104	122.1 Å²	122.1	86%	0.86	78%	0.783	S	S	*	*			trans	71.3	142.7	172.7	0	0	0	0	0	118
170	G	25.9	Very low	27	Very low	73 Å²	73	124.6 Å²	124.6	75%	0.753	79%	0.786	S	S	*	*			cis	-179.6	173.7	-4.4	0	0	0	0	0	115.6
171	D	25.1	Very low	27	Very low	152 Å²	152	123.3 Å²	123.3	81%	0.813	78%	0.779	S	S	*	*			trans	50.6	106.6	160.6	-90.9	-62.5	0	0	0	125.4
172	S	28.2	Very low	27.7	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	77%	0.771	S	S	*	*				52	150.8	116.8	73.3	0	0	0	0	125.9
173	S	25.5	Very low	27.6	Very low	116 Å²	116	122.1 Å²	122.1	81%	0.811	76%	0.762	S	S	*	*			trans	81.8	151.9	164	81.3	0	0	0	0	119.9
174	S	27.4	Very low	27.6	Very low	101 Å²	101	120.9 Å²	120.9	71%	0.706	75%	0.751	S	S	*	*			cis	-168.8	161.6	-33	58.8	0	0	0	0	113.9
175	V	28.3	Very low	27.5	Very low	127 Å²	127	125.7 Å²	125.7	77%	0.77	75%	0.748	S	S	*	*			trans	64.9	146.9	158.6	-103.8	0	0	0	0	125.6
176	D	26.1	Very low	27.5	Very low	115 Å²	115	125.5 Å²	125.5	62%	0.615	74%	0.742	S	S	*	*			trans	76.8	138.3	147.3	-83.7	11.7	0	0	0	122
177	K	31.9	Very low	27.3	Very low	136 Å²	136	128.5 Å²	128.5	59%	0.591	75%	0.745	S	S	*	*			cis	-167.5	176.1	-16.6	-140.8	-172.7	-150.1	80.1	0	112.3
178	F	24.5	Very low	27.3	Very low	185 Å²	185	122.1 Å²	122.1	81%	0.811	74%	0.736	S	S	*	*			trans	67.6	110.6	171.2	-54.5	-73.1	0	0	0	115.5
179	A	26.5	Very low	27.2	Very low	90 Å²	90	122.3 Å²	122.3	74%	0.744	74%	0.736	S	S	*	*			cis	82.5	115	18.1	0	0	0	0	0	117.2
180	L	26	Very low	27.1	Very low	174 Å²	174	121.7 Å²	121.7	91%	0.911	73%	0.726	S	S	*	*			trans	-156.8	149.4	141.7	-107	171.2	0	0	0	109.4
181	S	22.6	Very low	27.2	Very low	104 Å²	104	125.8 Å²	125.8	73%	0.727	73%	0.725	S	S	*	*			trans	-145.6	-163.1	-169.6	-41.9	0	0	0	0	108
182	P	41.9	Very low	27.2	Very low	109 Å²	109	125.2 Å²	125.2	71%	0.708	72%	0.722	S	S	*	*			cis	-137.5	-163.8	-12.8	36.8	-15	0	0	0	113.7
183	S	25.8	Very low	27.1	Very low	85 Å²	85	125.4 Å²	125.4	59%	0.594	72%	0.723	S	S	*	*			trans	78	147.1	140	-71.2	0	0	0	0	121.8
184	E	26.2	Very low	27.3	Very low	128 Å²	128	131.6 Å²	131.6	60%	0.598	73%	0.729	S	S	*	*			cis	-166.6	151.4	-14.4	-115.8	168.5	124.9	0	0	111.9
185	R	28.1	Very low	27.2	Very low	204 Å²	204	134.6 Å²	134.6	77%	0.77	74%	0.735	S	S	*	*			trans	53.6	163.4	143.1	-71.2	-176	-139.5	-137.2	7.8	120.1
186	T	26	Very low	27	Very low	103 Å²	103	133.4 Å²	133.4	63%	0.632	74%	0.739	S	S	*	*			cis	-155	169.3	-4.6	5.4	0	0	0	0	108.9
187	D	25.6	Very low	27	Very low	155 Å²	155	131.5 Å²	131.5	83%	0.829	74%	0.739	S	S	*	*			trans	23	150.7	144.7	-42.8	-27.3	0	0	0	121.8
188	G	26	Very low	26.7	Very low	64 Å²	64	133.4 Å²	133.4	66%	0.66	75%	0.752	S	S	*	*			cis	156.1	149.6	-3.1	0	0	0	0	0	113.4
189	V	25.7	Very low	26.8	Very low	146 Å²	146	132.1 Å²	132.1	89%	0.885	75%	0.748	S	S	*	*			trans	59.7	136.4	152.3	-154.2	0	0	0	0	121.8
190	S	26.9	Very low	27	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	75%	0.748	S	S	*	*			trans	72.3	112.7	153.1	-89.7	0	0	0	0	124.2
191	E	26.6	Very low	26.9	Very low	158 Å²	158	133.3 Å²	133.3	74%	0.738	74%	0.741	S	S	*	*				95.1	121.4	99	-161.4	165.2	175.8	0	0	123.5
192	L	26.2	Very low	27.1	Very low	141 Å²	141	131.4 Å²	131.4	74%	0.738	74%	0.738	S	S	*	*			trans	36.5	123.1	147.9	-64.5	170.7	0	0	0	123.6
193	S	26.2	Very low	26.6	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	74%	0.743	S	S	*	*			trans	67.1	125.1	131.6	-58.8	0	0	0	0	121.2
194	R	28.1	Very low	26.9	Very low	246 Å²	246	134.9 Å²	134.9	93%	0.928	75%	0.753	S	S	*	*				-177.2	159.7	105.6	-98.8	166.5	-170.6	-166.1	3.2	115.9
195	I	25.5	Very low	27.1	Very low	165 Å²	165	136 Å²	136	85%	0.846	76%	0.763	S	S	*	*			trans	-69.3	143.7	178.1	-62.8	149.8	0	0	0	112.5
196	A	24.9	Very low	27.2	Very low	102 Å²	102	128.9 Å²	128.9	84%	0.843	75%	0.753	S	S	*	*			trans	-158.3	153.8	145.6	0	0	0	0	0	110.3
197	A	26.5	Very low	27.4	Very low	74 Å²	74	130.1 Å²	130.1	61%	0.612	76%	0.76	S	S	*	*			trans	-134.9	169.6	-177.3	0	0	0	0	0	111.8
198	M	25.8	Very low	27.7	Very low	176 Å²	176	130 Å²	130	87%	0.867	76%	0.759	S	S	*	*			trans	-142.7	155.5	166.8	-74.1	-153.8	74.7	0	0	112
199	H	26.3	Very low	27.9	Very low	159 Å²	159	134 Å²	134	74%	0.736	77%	0.765	S	S	*	*			trans	-145.4	-177.7	-173.2	-50.5	-82.2	0	0	0	108.3
200	I	29.9	Very low	28	Very low	143 Å²	143	133.6 Å²	133.6	73%	0.733	76%	0.758	S	S	*	*			cis	-153.9	-163.9	13.8	-146.4	-65.4	0	0	0	108.2
201	D	24.8	Very low	28	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	76%	0.761	S	S	*	*			trans	70.3	140.1	172.2	-66.6	-25	0	0	0	119.8
202	G	26.9	Very low	28.1	Very low	64 Å²	64	132.6 Å²	132.6	66%	0.66	76%	0.762	S	S	*	*			cis	171.4	156.4	-8.2	0	0	0	0	0	115.4
203	S	31.1	Very low	28.1	Very low	116 Å²	116	135 Å²	135	81%	0.811	77%	0.769	S	S	*	*			trans	67.2	128.9	175.2	-78.1	0	0	0	0	117.6
204	D	32.6	Very low	28.3	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	77%	0.771	S	S	*	*				85.3	140	65.3	-101.9	5.7	0	0	0	112.5
205	D	30.5	Very low	28.4	Very low	150 Å²	150	132.3 Å²	132.3	80%	0.802	76%	0.76	S	S	*	*			cis	-160.8	171.5	1.3	-176.8	15.7	0	0	0	109.2
206	G	29.8	Very low	28.7	Very low	55 Å²	55	131.1 Å²	131.1	57%	0.567	75%	0.754	S	S	*	*			trans	102.1	91.6	147.7	0	0	0	0	0	123.4
207	V	30.7	Very low	28.9	Very low	129 Å²	129	130 Å²	130	78%	0.782	75%	0.745	S	S	*	*				60.9	124.1	114.4	175.4	0	0	0	0	124
208	L	31.3	Very low	28.9	Very low	152 Å²	152	134.9 Å²	134.9	80%	0.796	76%	0.755	S	S	*	*			trans	66.2	115.8	149.5	-70.4	167.8	0	0	0	125.6
209	D	29.4	Very low	29.2	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	75%	0.754	S	S	*	*				73.7	152.8	110.3	-146.2	23.8	0	0	0	126.3
210	D	28.2	Very low	29.4	Very low	138 Å²	138	136 Å²	136	74%	0.738	76%	0.757	S	S	*	*			trans	72.8	174.1	161.6	-144.3	12.3	0	0	0	122.2
211	C	27.6	Very low	29.3	Very low	102 Å²	102	132 Å²	132	69%	0.689	75%	0.751	S	S	*	*			trans	-116.3	-172.9	-142.3	-64.9	0	0	0	0	116.9
212	V	28.4	Very low	29.6	Very low	127 Å²	127	130.8 Å²	130.8	77%	0.77	75%	0.753	S	S	*	*			trans	93.7	122.4	156	-169	0	0	0	0	117.6
213	E	26.5	Very low	29.5	Very low	191 Å²	191	136.2 Å²	136.2	89%	0.893	77%	0.765	S	S	*	*			trans	-124.3	155.1	144.5	-89.1	-160.4	139.7	0	0	110.3
214	H	30.5	Very low	29.5	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.736	76%	0.757	S	S	*	*			trans	-150.3	171	176.5	-128.4	57.7	0	0	0	109.1
215	D	29.5	Very low	29.2	Very low	130 Å²	130	135 Å²	135	70%	0.695	76%	0.757	S	S	*	*			trans	70.6	148.2	154.6	-75.1	-0.5	0	0	0	120.4
216	I	31.3	Very low	29.5	Very low	141 Å²	141	131.3 Å²	131.3	72%	0.723	75%	0.747	S	S	*	*			cis	-157.6	153.3	-27.2	-137.6	171	0	0	0	113
217	A	29.7	Very low	29.6	Very low	78 Å²	78	135 Å²	135	65%	0.645	75%	0.754	S	S	*	*			trans	21.2	148.3	154	0	0	0	0	0	124.7
218	Q	27	Very low	29.5	Very low	176 Å²	176	136 Å²	136	82%	0.822	75%	0.75	S	S	*	*				-159.3	122.5	110.7	-102.8	173.4	48.1	0	0	110.9
219	R	31	Very low	29.6	Very low	227 Å²	227	135.2 Å²	135.2	86%	0.857	74%	0.742	S	S	*	*				66.4	136	99.8	-77.8	-170.1	171.3	-176.1	-3.6	114.9
220	V	31.5	Very low	29.4	Very low	131 Å²	131	135.4 Å²	135.4	79%	0.794	74%	0.738	S	S	*	*			cis	-163.9	167.6	-3.8	100.7	0	0	0	0	106.4
221	G	27.2	Very low	29.3	Very low	59 Å²	59	134.3 Å²	134.3	61%	0.608	74%	0.741	S	S	*	*			cis	111	157.1	16.6	0	0	0	0	0	111.5
222	C	30.6	Very low	29.2	Very low	120 Å²	120	134.5 Å²	134.5	81%	0.811	74%	0.744	S	S	*	*			cis	-162.8	160.7	-15.7	-78.1	0	0	0	0	107.5
223	I	24.5	Very low	29.2	Very low	178 Å²	178	133.7 Å²	133.7	91%	0.913	74%	0.744	S	S	*	*			trans	-167.1	151	151	-99.9	152.6	0	0	0	110.2
224	S	30.7	Very low	29.3	Very low	94 Å²	94	133.5 Å²	133.5	66%	0.657	74%	0.742	S	S	*	*			trans	-143	-172.6	-160.1	46.9	0	0	0	0	113
225	D	28.2	Very low	29.2	Very low	149 Å²	149	135.1 Å²	135.1	80%	0.797	75%	0.748	S	S	*	*				150.6	151.4	128.5	-70.8	-7.3	0	0	0	112.7
226	A	35.1	Very low	29	Very low	73 Å²	73	137.4 Å²	137.4	60%	0.603	76%	0.759	S	S	*	*			cis	-169.4	175	-26.2	0	0	0	0	0	111.4
227	D	31.6	Very low	28.7	Very low	132 Å²	132	136.3 Å²	136.3	71%	0.706	76%	0.759	S	S	*	*			trans	72.1	143.7	151.4	-57.5	-17.9	0	0	0	122.4
228	H	30.3	Very low	28.4	Very low	150 Å²	150	139.2 Å²	139.2	69%	0.694	76%	0.763	S	S	*	*			cis	-166	148.1	-11	-117.1	-11.6	0	0	0	114.2
229	E	31.8	Very low	28.4	Very low	135 Å²	135	138.8 Å²	138.8	63%	0.631	77%	0.767	S	S	*	*			trans	55.9	158.9	142.2	-59	-61.9	77.3	0	0	122.6
230	Q	27	Very low	28.1	Very low	153 Å²	153	133.6 Å²	133.6	72%	0.715	76%	0.761	S	S	*	*			cis	-151.7	135.9	-0.2	-125.8	148.1	38.7	0	0	109
231	S	26	Very low	27.8	Very low	115 Å²	115	134.9 Å²	134.9	80%	0.804	76%	0.763	S	S	*	*				72.4	146.3	91.9	-150	0	0	0	0	116
232	S	25.5	Very low	27.8	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	77%	0.765	S	S	*	*			cis	-148	-178.9	6.2	84.2	0	0	0	0	112.4
233	S	27.6	Very low	27.8	Very low	110 Å²	110	136 Å²	136	77%	0.769	76%	0.763	S	S	*	*			trans	-152.3	141.8	167.1	-178.7	0	0	0	0	111.7
234	H	27.9	Very low	28	Very low	186 Å²	186	137.1 Å²	137.1	86%	0.861	76%	0.764	S	S	*	*			trans	-148	142.4	173	-103.4	-93.3	0	0	0	112
235	K	28.4	Very low	28	Very low	194 Å²	194	141.1 Å²	141.1	84%	0.843	77%	0.773	S	S	*	*			trans	-94.7	150.8	167.8	-77	-175.9	174.3	-177.6	0	110.9
236	L	26.1	Very low	28	Very low	177 Å²	177	142.2 Å²	142.2	93%	0.927	78%	0.778	S	S	*	*			trans	-137.5	162.2	152.2	-87.5	174.4	0	0	0	109.6
237	T	25.1	Very low	27.8	Very low	119 Å²	119	141.5 Å²	141.5	73%	0.73	78%	0.779	S	S	*	*			trans	-124.2	153.7	-171.2	46	0	0	0	0	112
238	D	24.3	Very low	27.8	Very low	138 Å²	138	145.3 Å²	145.3	74%	0.738	79%	0.789	S	S	*	*			trans	55.2	126.5	165	-81.7	-53	0	0	0	120.5
239	N	25.3	Very low	28.2	Very low	167 Å²	167	145.5 Å²	145.5	89%	0.893	79%	0.793	S	S	*	*				-154.9	137.1	125.8	-104.7	-49.6	0	0	0	109.2
240	T	26.6	Very low	28.6	Very low	119 Å²	119	145 Å²	145	73%	0.73	80%	0.801	S	S	*	*			trans	-121.4	131.8	175.5	-66.4	0	0	0	0	108.8
241	D	23.9	Very low	29	Very low	157 Å²	157	145 Å²	145	84%	0.84	81%	0.807	S	S	*	*			trans	-145.9	157.9	150.2	-156.5	-3.6	0	0	0	109.8
242	S	28.3	Very low	29.5	Very low	95 Å²	95	151 Å²	151	66%	0.664	81%	0.811	S	S	*	*			trans	-154.7	141.3	-162.8	66	0	0	0	0	113.1
243	S	29.4	Very low	29.7	Very low	109 Å²	109	152.5 Å²	152.5	76%	0.762	81%	0.811	S	S	*	*			trans	-169.1	115	153.7	37.9	0	0	0	0	113.1
244	Q	29	Very low	30.1	Very low	200 Å²	200	152.5 Å²	152.5	94%	0.935	81%	0.811	S	S	*	*				-155	157.6	107.9	-105.5	178.5	29.7	0	0	110.3
245	Q	31.5	Very low	30.1	Very low	179 Å²	179	146.6 Å²	146.6	84%	0.836	80%	0.801	S	S	*	*			trans	-115.2	133.2	-157.9	-61	165.4	-11	0	0	112
246	N	28.1	Very low	30.1	Very low	171 Å²	171	144.9 Å²	144.9	91%	0.914	80%	0.8	S	S	*	*				-168.3	155.4	116.5	-117.9	-46	0	0	0	110.9
247	G	30.7	Very low	30.2	Very low	59 Å²	59	143.3 Å²	143.3	61%	0.608	79%	0.792	S	S	*	*			trans	-157.7	162.6	179.2	0	0	0	0	0	114
248	K	32.1	Very low	30.7	Very low	212 Å²	212	142.7 Å²	142.7	92%	0.922	79%	0.792	S	S	*	*			trans	-166	151.9	161.6	-104.2	144.4	-173.9	173.7	0	110
249	I	37.3	Very low	31.2	Very low	154 Å²	154	142.1 Å²	142.1	79%	0.79	80%	0.796	S	S	*	*			trans	-107.9	148.5	-175.1	-31.7	176.1	0	0	0	107.9
250	P	41.2	Very low	31.3	Very low	123 Å²	123	139.5 Å²	139.5	80%	0.799	79%	0.791	S	S	*	*				-147.4	166.8	102.5	38.8	-23.7	0	0	0	115.1
251	N	35.7	Very low	31.5	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	80%	0.797	S	S	*	*			trans	-81.9	138.9	170	-71.3	-10.7	0	0	0	112.3
252	R	36.1	Very low	31.7	Very low	239 Å²	239	137 Å²	137	90%	0.902	80%	0.795	S	S	*	*			trans	-173.4	124.3	147.5	-109.3	173.2	162.8	155.2	-2.8	107.4
253	D	30.3	Very low	31.6	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	80%	0.8	S	S	*	*			cis	100	129.6	30.7	-174	23.5	0	0	0	113.4
254	S	34.9	Very low	31.6	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	81%	0.806	S	S	*	*			trans	64.6	126.9	164	-69.9	0	0	0	0	121.4
255	G	26.9	Very low	31.5	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	80%	0.799	S	S	*	*				129.7	106.2	114.1	0	0	0	0	0	120.1
256	I	29	Very low	31.3	Very low	158 Å²	158	137.7 Å²	137.7	81%	0.81	81%	0.805	S	S	*	*			trans	59.8	136.6	131.9	68.1	166.7	0	0	0	124.5
257	D	27.7	Very low	31.2	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	80%	0.795	S	S	*	*			trans	83.3	159.5	134.5	-87.5	-53.1	0	0	0	125.3
258	S	36	Very low	30.9	Very low	105 Å²	105	140.2 Å²	140.2	73%	0.734	81%	0.807	S	S	*	*			trans	-80.3	168.5	-169.8	-52	0	0	0	0	113.6
259	P	34.5	Very low	31.9	Very low	127 Å²	127	134.7 Å²	134.7	83%	0.825	79%	0.793	S	S	*	*				-147.5	179.3	114	39.4	-25.4	0	0	0	115.2
260	S	28.7	Very low	31.5	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	79%	0.789	S	S	*	*			trans	-136.8	147.2	170.1	-76	0	0	0	0	112.3
261	C	30.1	Very low	31.4	Very low	125 Å²	125	135 Å²	135	85%	0.845	79%	0.785	S	S	*	*			trans	73.4	133.5	154.4	-65.7	0	0	0	0	122.6
262	A	28.3	Very low	31.2	Very low	97 Å²	97	134.9 Å²	134.9	80%	0.802	78%	0.784	S	S	*	*			trans	70.7	154.7	154.1	0	0	0	0	0	117.8
263	T	27.1	Very low	31.2	Very low	127 Å²	127	126.7 Å²	126.7	78%	0.779	77%	0.768	S	S	*	*			cis	-130.6	-179.3	9.7	48.9	0	0	0	0	113.9
264	E	27.9	Very low	31.5	Very low	190 Å²	190	126.8 Å²	126.8	89%	0.888	77%	0.766	S	S	*	*			trans	-32.5	158.8	160.6	-61.2	151.5	-159.3	0	0	116.4
265	G	26.5	Very low	31.4	Very low	75 Å²	75	127.8 Å²	127.8	77%	0.773	76%	0.763	S	S	*	*			cis	155.3	150.3	-2.1	0	0	0	0	0	111.7
266	E	27.9	Very low	32	Very low	206 Å²	206	131.7 Å²	131.7	96%	0.963	76%	0.764	S	S	*	*			trans	-158.9	171.5	172.2	-139	173.4	-141.5	0	0	112.8
267	A	26.1	Very low	32.5	Very low	85 Å²	85	131.1 Å²	131.1	70%	0.702	76%	0.759	S	S	*	*			trans	-150.7	-179.6	-160.5	0	0	0	0	0	112.5
268	F	24.3	Very low	32.7	Very low	199 Å²	199	130.8 Å²	130.8	87%	0.873	76%	0.757	S	S	*	*			cis	-146.1	-69.5	8.2	-147.4	-37.7	0	0	0	115.3
269	P	53.8	Low	32.7	Very low	96 Å²	96	133.1 Å²	133.1	62%	0.623	76%	0.756	S	S	*	*			trans	-137.7	158.5	-134.8	42.9	-25.9	0	0	0	118.4
270	N	27.9	Very low	32.6	Very low	134 Å²	134	135.7 Å²	135.7	72%	0.717	75%	0.75	S	S	*	*				174.5	131.4	106.6	-102.6	25.8	0	0	0	113.6
271	E	39	Very low	32.7	Very low	150 Å²	150	135.5 Å²	135.5	70%	0.701	74%	0.74	S	S	*	*			trans	56.7	151.3	131.9	-43.9	-60	64.7	0	0	120.2
272	D	31.3	Very low	32.8	Very low	151 Å²	151	134 Å²	134	81%	0.807	73%	0.731	S	S	*	*			cis	-152	167.6	27.7	-101.5	-53.3	0	0	0	108.7
273	A	36.5	Very low	32.7	Very low	68 Å²	68	135 Å²	135	56%	0.562	73%	0.727	S	S	*	*			cis	-170.1	143.7	1.8	0	0	0	0	0	112.1
274	I	37.3	Very low	32.8	Very low	140 Å²	140	134.2 Å²	134.2	72%	0.718	72%	0.722	S	S	*	*			trans	33.8	166.4	152	40.9	59.1	0	0	0	124.3
275	D	32.1	Very low	32.7	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	72%	0.716	S	S	*	*			cis	-138.1	136.4	17.9	-85.5	-51.7	0	0	0	112
276	E	40.9	Very low	32.8	Very low	145 Å²	145	134.4 Å²	134.4	68%	0.678	71%	0.71	S	S	*	*				81.4	144.6	95.8	-57.7	-73.9	78.4	0	0	116.6
277	E	37.7	Very low	32.8	Very low	147 Å²	147	132.5 Å²	132.5	69%	0.687	70%	0.702	S	S	*	*			cis	-158.2	-169.1	-9.2	-135.1	-162.6	146.8	0	0	113.5
278	D	33.2	Very low	32.7	Very low	137 Å²	137	133 Å²	133	73%	0.733	70%	0.7	S	S	*	*			trans	96.2	76	156.1	-90.1	-27.4	0	0	0	123.7
279	H	35.6	Very low	32.6	Very low	153 Å²	153	130.3 Å²	130.3	71%	0.708	70%	0.699	S	S	*	*				67	116.4	115.4	-118.4	74.1	0	0	0	125.2
280	Y	32.2	Very low	31.1	Very low	181 Å²	181	131.1 Å²	131.1	71%	0.71	71%	0.707	S	S	*	*				161.2	128.6	94.8	-170.1	-128.3	0	0	0	115
281	D	30.6	Very low	30.8	Very low	108 Å²	108	130 Å²	130	58%	0.578	71%	0.709	S	S	*	*			trans	36	147.1	154.8	-80.1	22.8	0	0	0	123.3
282	S	31.9	Very low	29.9	Very low	94 Å²	94	128.1 Å²	128.1	66%	0.657	71%	0.711	S	S	*	*			cis	-168.1	167.4	20.4	-143.5	0	0	0	0	115.1
283	V	27.3	Very low	29.5	Very low	117 Å²	117	127 Å²	127	71%	0.709	71%	0.709	S	S	*	*			trans	51.1	111.8	158.8	-87.5	0	0	0	0	124.8
284	T	28.1	Very low	28.9	Very low	111 Å²	111	129.5 Å²	129.5	68%	0.681	72%	0.718	S	S	*	*				50.3	150.5	120.5	61.1	0	0	0	0	122.7
285	E	27.3	Very low	28.3	Very low	163 Å²	163	129.9 Å²	129.9	76%	0.762	72%	0.721	S	S	*	*			cis	-158.6	154.8	6.3	-126.2	161.6	-160.1	0	0	114.8
286	T	28.6	Very low	28	Very low	106 Å²	106	129.3 Å²	129.3	65%	0.65	72%	0.718	S	S	*	*			trans	7.5	136.7	153.6	52.8	0	0	0	0	125.9
287	E	26.4	Very low	27.3	Very low	167 Å²	167	128.9 Å²	128.9	78%	0.78	72%	0.72	S	S	*	*				82	113.7	125.1	-71.2	-170	-155.4	0	0	125.5
288	S	25.1	Very low	26.9	Very low	95 Å²	95	129.8 Å²	129.8	66%	0.664	72%	0.721	S	S	*	*				72.8	143.5	107.8	-49.5	0	0	0	0	125.1
289	V	22.8	Very low	26.8	Very low	142 Å²	142	133.4 Å²	133.4	86%	0.861	73%	0.725	S	S	*	*			trans	61.7	125.1	157.7	-140.4	0	0	0	0	120.2
290	S	21.4	Very low	26.2	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	72%	0.724	S	S	*	*				153.2	164.1	113.5	-160.8	0	0	0	0	113.9
291	C	20.7	Very low	26	Very low	110 Å²	110	127.6 Å²	127.6	74%	0.743	72%	0.718	S	S	*	*			trans	-108.5	174.7	-171.1	-64.7	0	0	0	0	113.4
292	C	21.6	Very low	26.2	Very low	111 Å²	111	127.2 Å²	127.2	75%	0.75	72%	0.72	S	S	*	*			trans	73.4	122.2	138.2	71.2	0	0	0	0	122.8
293	V	21.6	Very low	26.3	Very low	127 Å²	127	130 Å²	130	77%	0.77	72%	0.722	S	S	*	*				98.6	149.8	122.3	158.5	0	0	0	0	120.5
294	T	25.3	Very low	26.4	Very low	121 Å²	121	129.8 Å²	129.8	74%	0.742	72%	0.717	S	S	*	*			trans	65.6	125.2	-174.6	47.1	0	0	0	0	115.7
295	L	24.7	Very low	26.7	Very low	149 Å²	149	132.4 Å²	132.4	78%	0.78	72%	0.722	S	S	*	*			cis	87.3	126.6	33.2	-68.2	173.5	0	0	0	116
296	D	24.5	Very low	26.9	Very low	119 Å²	119	130.6 Å²	130.6	64%	0.636	72%	0.717	S	S	*	*			trans	71.6	110.8	144.4	-79.9	-55.1	0	0	0	121.9
297	N	27.7	Very low	27.3	Very low	136 Å²	136	129.6 Å²	129.6	73%	0.727	72%	0.715	S	S	*	*				48.8	120.3	118.3	-81.3	-53.3	0	0	0	119.2
298	K	28.1	Very low	27.6	Very low	165 Å²	165	128.4 Å²	128.4	72%	0.717	71%	0.713	S	S	*	*				179.4	144.2	100.7	-101.8	171.5	-175.9	157.6	0	114.6
299	R	30.6	Very low	28.2	Very low	214 Å²	214	131.7 Å²	131.7	81%	0.808	72%	0.723	S	S	*	*			trans	68.9	159.3	137.5	-74.7	-173.4	-179.5	169.4	-2.6	118
300	D	23.6	Very low	28.8	Very low	128 Å²	128	132.1 Å²	132.1	68%	0.684	72%	0.72	S	S	*	*			cis	-171.4	170.9	-17.8	174.2	49.3	0	0	0	107.3
301	S	28.8	Very low	29.4	Very low	83 Å²	83	135.7 Å²	135.7	58%	0.58	73%	0.725	S	S	*	*			trans	69.5	145.8	157.3	-80.3	0	0	0	0	117.4
302	T	33.8	Very low	29.8	Very low	101 Å²	101	133.9 Å²	133.9	62%	0.62	72%	0.724	S	S	*	*			cis	-169.3	150.4	-22.8	13.6	0	0	0	0	107.7
303	Q	34.2	Very low	30.4	Very low	152 Å²	152	134.4 Å²	134.4	71%	0.71	73%	0.729	S	S	*	*			trans	62.1	163.5	142.9	-62.8	-179.2	-87.5	0	0	119.5
304	D	29.6	Very low	31	Very low	112 Å²	112	133.7 Å²	133.7	60%	0.599	73%	0.73	S	S	*	*			cis	-164.6	175.9	-28.5	-92.6	-14.3	0	0	0	107.1
305	E	35.1	Very low	31.1	Very low	167 Å²	167	131.3 Å²	131.3	78%	0.78	73%	0.729	S	S	*	*			trans	66.1	153.9	161.3	-50.9	-46.7	64.7	0	0	120.2
306	D	31.5	Very low	31.3	Very low	124 Å²	124	132.6 Å²	132.6	66%	0.663	73%	0.731	S	S	*	*			cis	-169.9	176.6	-27.8	-177.4	40.9	0	0	0	109.7
307	S	35.6	Very low	31.7	Very low	86 Å²	86	134.1 Å²	134.1	60%	0.601	74%	0.738	S	S	*	*			trans	83.5	96.4	152.5	-55.6	0	0	0	0	120.5
308	D	34.7	Very low	32.2	Very low	141 Å²	141	133 Å²	133	75%	0.754	74%	0.738	S	S	*	*				43.5	133.4	118.1	-56.1	-16.6	0	0	0	123.5
309	L	37.3	Very low	32.3	Very low	165 Å²	165	129.7 Å²	129.7	86%	0.864	74%	0.736	S	S	*	*				-176.1	163.3	95	-93.3	175.6	0	0	0	114.6
310	D	34.1	Very low	32.3	Very low	150 Å²	150	126.6 Å²	126.6	80%	0.802	73%	0.734	S	S	*	*			trans	-52.2	164	-176.9	-94.1	-59.1	0	0	0	117.4
311	E	34.4	Very low	32.6	Very low	189 Å²	189	125.5 Å²	125.5	88%	0.883	73%	0.733	S	S	*	*				-170.3	126.1	60	-176	-177.6	177.3	0	0	115.2
312	G	30	Very low	32.7	Very low	71 Å²	71	128.1 Å²	128.1	73%	0.732	74%	0.74	S	S	*	*			trans	64	175.3	151.8	0	0	0	0	0	120.6
313	S	34	Very low	32.4	Very low	123 Å²	123	128.7 Å²	128.7	86%	0.86	74%	0.744	S	S	*	*			cis	179.1	141.3	-23	178.9	0	0	0	0	108.4
314	S	34.1	Very low	32.3	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	75%	0.746	S	S	*	*			cis	-165.4	169.9	-21.4	-174.1	0	0	0	0	108.3
315	G	27.3	Very low	32.2	Very low	71 Å²	71	130.5 Å²	130.5	73%	0.732	76%	0.758	S	S	*	*			trans	172.4	112.2	176.3	0	0	0	0	0	115.6
316	E	28.3	Very low	31.8	Very low	177 Å²	177	125.6 Å²	125.6	83%	0.827	75%	0.752	S	S	*	*			trans	-82.1	149.1	-173.3	-66.9	170.1	170.8	0	0	112.5
317	I	32.3	Very low	31.8	Very low	150 Å²	150	131 Å²	131	77%	0.769	77%	0.765	S	S	*	*				68.3	140.4	52.5	-65.9	177.5	0	0	0	111.4
318	P	40.1	Very low	31.8	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	78%	0.779	S	S	*	*			cis	-118.3	176.6	14	23.5	0.6	0	0	0	115
319	S	29.1	Very low	31.5	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	78%	0.783	S	S	*	*			cis	90	175.2	19.1	-154.8	0	0	0	0	116.8
320	L	29.8	Very low	31.4	Very low	149 Å²	149	134.2 Å²	134.2	78%	0.78	78%	0.78	S	S	*	*			trans	90.2	115	-164.1	-55	-169.8	0	0	0	113.8
321	T	30	Very low	31.2	Very low	105 Å²	105	131.9 Å²	131.9	64%	0.644	78%	0.781	S	S	*	*			cis	66.2	140.9	17.6	89.7	0	0	0	0	114.7
322	D	30.8	Very low	31.3	Very low	138 Å²	138	131.7 Å²	131.7	74%	0.738	78%	0.78	S	S	*	*			cis	-149	-144.8	-1.6	-137.8	-42.1	0	0	0	109.1
323	T	28.7	Very low	31.6	Very low	113 Å²	113	133.5 Å²	133.5	69%	0.693	78%	0.781	S	S	*	*			cis	-155.8	134.5	8.5	-15.3	0	0	0	0	113.4
324	Q	31.8	Very low	31.7	Very low	165 Å²	165	135.3 Å²	135.3	77%	0.771	78%	0.781	S	S	*	*			trans	73.6	143.8	135	-139.6	167.8	52.9	0	0	125.4
325	T	26.8	Very low	31.9	Very low	137 Å²	137	136.1 Å²	136.1	84%	0.84	78%	0.782	S	S	*	*			trans	79.6	141.8	156.1	0.8	0	0	0	0	118.9
326	G	26.5	Very low	32.8	Very low	63 Å²	63	139.9 Å²	139.9	65%	0.649	78%	0.78	S	S	*	*			trans	-154.5	-176.4	-176.9	0	0	0	0	0	113.7
327	Y	31.5	Very low	33.3	Very low	239 Å²	239	140.8 Å²	140.8	94%	0.937	78%	0.782	S	S	*	*			trans	-139.1	144.8	175.4	-98	-91	0	0	0	110.3
328	L	35.9	Very low	33.9	Very low	173 Å²	173	137.6 Å²	137.6	91%	0.906	77%	0.771	S	S	*	*			trans	-90.6	114.5	176	-70.5	168.5	0	0	0	110.9
329	T	29.8	Very low	35.4	Very low	135 Å²	135	135.4 Å²	135.4	83%	0.828	76%	0.759	S	S	*	*			trans	-154.2	116.6	152.4	30.8	0	0	0	0	111
330	D	33.7	Very low	37.7	Very low	151 Å²	151	135 Å²	135	81%	0.807	75%	0.746	S	S	*	*			trans	28.2	109	151	-157.1	4.8	0	0	0	120.1
331	A	30.7	Very low	40.1	Very low	100 Å²	100	130.6 Å²	130.6	83%	0.826	73%	0.731	S	S	*	*			trans	-146.5	32.1	167.7	0	0	0	0	0	112.5
332	H	35.3	Very low	42.7	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.856	72%	0.717	S	S	*	*			trans	-108.4	63.9	-175.4	-100.3	-59.9	0	0	0	113.3
333	S	36.5	Very low	45.1	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	70%	0.698	S	S	*	*			trans	-150.1	36.8	175.7	-173.1	0	0	0	0	115.9
334	D	36.8	Very low	47.9	Very low	161 Å²	161	121.5 Å²	121.5	86%	0.861	67%	0.668	S	S	*	*	S	Bend	trans	-145.1	63.6	175.9	-104.3	-37.1	0	0	0	114.4
335	T	37.4	Very low	50.5	Low	128 Å²	128	114.7 Å²	114.7	79%	0.785	64%	0.637	S	S	*	*	S	Bend	trans	-150	1.1	173.4	-23.1	0	0	0	0	116.2
336	H	45.9	Very low	53.3	Low	151 Å²	151	112 Å²	112	70%	0.699	62%	0.618	S	S	*	*	S	Bend	trans	-126	26	-176.6	-80.1	-77.1	0	0	0	115.3
337	K	39.5	Very low	55.9	Low	196 Å²	196	109.9 Å²	109.9	85%	0.852	59%	0.591	S	S	*	*			trans	-128.8	106.4	167.6	-74	-179.2	-178.8	171.6	0	111.4	S339	K337-S339 PolarHBondContact O-N 3.43Å
338	C	44.9	Very low	58.7	Low	82 Å²	82	98.5 Å²	98.5	55%	0.554	55%	0.546	S	S	*	.			trans	-68.6	97.9	157.8	-178.2	0	0	0	0	107.8	K343	C338-K343 WeakPolarHBondContact O-CE 3.44Å
339	S	72.7	Confident	61	Low	67 Å²	67	95.1 Å²	95.1	47%	0.469	52%	0.524	S	S	.	.			trans	-54.2	146.7	-174.7	179.8	0	0	0	0	112.3	K337 A341 Q342 K343	K337-S339 PolarHBondContact O-N 3.43Å; S339-A341 PolarHBondContact O-N 2.9Å; S339-A341 VanDerWaalsContact O-N 3.16Å; S339-A341 PolarHBondContact OG-N 2.92Å; S339-Q342 WeakPolarHBondContact O-CA 3.29Å; S339-Q342 WeakPolarHBondContact O-CB 3.38Å; S339-Q342 PolarHBondContact O-N 2.85Å; S339-K343 PolarHBondContact O-N 2.76Å
340	E	75.7	Confident	63.6	Low	88 Å²	88	93.7 Å²	93.7	41%	0.411	51%	0.509	S	S	.	.	H	α-helix	trans	-56.6	-31.1	173.6	-60.8	-53.9	128.9	0	0	111.5	Q342 K343 L344	E340-Q342 VanDerWaalsContact C-N 3.27Å; E340-Q342 PolarHBondContact O-N 2.91Å; E340-K343 WeakPolarHBondContact O-CB 3.44Å; E340-K343 PolarHBondContact O-N 3.1Å; E340-K343 IonicContact OE1-NZ 2.59Å; E340-K343 PolarHBondContact OE1-NZ 3.19Å; E340-K343 WeakPolarHBondContact OE2-CD 3.43Å; E340-K343 IonicContact OE2-NZ 3.39Å; E340-L344 WeakPolarHBondContact O-CG 3.33Å; E340-L344 PolarHBondContact O-N 3.27Å
341	A	81.7	Confident	66	Low	56 Å²	56	86.8 Å²	86.8	46%	0.463	47%	0.471	S	S	.	.	H	α-helix	trans	-59	-35	172.3	0	0	0	0	0	113.2	S339 L345	S339-A341 PolarHBondContact O-N 2.9Å; S339-A341 VanDerWaalsContact O-N 3.16Å; S339-A341 PolarHBondContact OG-N 2.92Å; A341-L345 WeakPolarHBondContact O-CB 3.27Å; A341-L345 PolarHBondContact O-N 3.14Å
342	Q	83	Confident	68.8	Low	75 Å²	75	82.6 Å²	82.6	35%	0.35	44%	0.435	S	S	.	.	H	α-helix	trans	-73	-33.2	175	-175.3	57.6	64.8	0	0	111.6	S339 E340 L345 N346	S339-Q342 WeakPolarHBondContact O-CA 3.29Å; S339-Q342 WeakPolarHBondContact O-CB 3.38Å; S339-Q342 PolarHBondContact O-N 2.85Å; E340-Q342 VanDerWaalsContact C-N 3.27Å; E340-Q342 PolarHBondContact O-N 2.91Å; Q342-L345 PolarHBondContact O-N 3.49Å; Q342-N346 PolarHBondContact NE2-OD1 3Å; Q342-N346 PolarHBondContact O-N 3.31Å; Q342-N346 PolarHBondContact O-OD1 3.2Å; Q342-N346 VanDerWaalsContact O-OD1 3.14Å
343	K	82.6	Confident	70.9	Confident	76 Å²	76	80 Å²	80	33%	0.33	42%	0.423	S	S	.	.	H	α-helix	trans	-69.6	-42.7	175.1	-58.7	176	-165.2	167.4	0	111	C338 S339 E340 N346 I347	C338-K343 WeakPolarHBondContact O-CE 3.44Å; S339-K343 PolarHBondContact O-N 2.76Å; E340-K343 WeakPolarHBondContact O-CB 3.44Å; E340-K343 PolarHBondContact O-N 3.1Å; E340-K343 IonicContact OE1-NZ 2.59Å; E340-K343 PolarHBondContact OE1-NZ 3.19Å; E340-K343 WeakPolarHBondContact OE2-CD 3.43Å; E340-K343 IonicContact OE2-NZ 3.39Å; K343-N346 WeakPolarHBondContact O-CB 3.49Å; K343-N346 PolarHBondContact O-N 2.99Å; K343-N346 VanDerWaalsContact O-N 3.16Å; K343-I347 WeakPolarHBondContact O-CG1 3.42Å; K343-I347 PolarHBondContact O-N 3.47Å
344	L	86.7	Confident	73.2	Confident	14 Å²	14	76.9 Å²	76.9	7%	0.073	40%	0.399	C	S	.	.	H	α-helix	trans	-58.8	-45	171.4	-72.4	165.9	0	0	0	111.9	E340 N346 I347 A348 Y496 K499 L500	E340-L344 WeakPolarHBondContact O-CG 3.33Å; E340-L344 PolarHBondContact O-N 3.27Å; L344-N346 VanDerWaalsContact C-N 3.3Å; L344-N346 PolarHBondContact O-N 2.96Å; L344-I347 PolarHBondContact O-N 3.14Å; L344-A348 WeakPolarHBondContact O-CB 3.31Å; L344-A348 PolarHBondContact O-N 3.28Å; L344-Y496 HydrophobicContact CB-CE2 4.2Å; L344-Y496 HydrophobicContact CD2-CD2 3.62Å; L344-Y496 HydrophobicContact CD2-CE2 3.47Å; L344-Y496 VanDerWaalsContact CD2-CE2 3.47Å; L344-Y496 HydrophobicContact CD2-CG 4.26Å; L344-Y496 HydrophobicContact CG-CE2 4.43Å; L344-K499 HydrophobicContact CD2-CB 3.72Å; L344-K499 HydrophobicContact CG-CB 4.06Å; L344-L500 HydrophobicContact CD1-CD1 3.91Å; L344-L500 HydrophobicContact CD2-CB 4.24Å; L344-L500 HydrophobicContact CD2-CD1 3.92Å
345	L	87.8	Confident	75.7	Confident	22 Å²	22	69.2 Å²	69.2	12%	0.115	36%	0.358	C	S	.	.	H	α-helix	trans	-62.3	-35.5	174.5	178.2	54.1	0	0	0	112.4	A341 Q342 A348 K349 I409 W413	A341-L345 WeakPolarHBondContact O-CB 3.27Å; A341-L345 PolarHBondContact O-N 3.14Å; Q342-L345 PolarHBondContact O-N 3.49Å; L345-A348 PolarHBondContact O-N 2.93Å; L345-K349 HydrophobicContact CD1-CD 4.1Å; L345-K349 HydrophobicContact CD1-CG 4.13Å; L345-K349 HydrophobicContact CG-CD 4.09Å; L345-K349 WeakPolarHBondContact O-CB 3.44Å; L345-K349 VanDerWaalsContact O-CG 3.29Å; L345-K349 WeakPolarHBondContact O-CG 3.46Å; L345-K349 PolarHBondContact O-N 3.45Å; L345-I409 HydrophobicContact CD1-CG2 4.45Å; L345-W413 HydrophobicContact CB-CZ2 4.15Å; L345-W413 HydrophobicContact CD1-CD2 3.76Å; L345-W413 HydrophobicContact CD1-CE3 4.44Å; L345-W413 HydrophobicContact CD1-CG 3.81Å; L345-W413 HydrophobicContact CD1-CZ2 4.35Å
346	N	84.4	Confident	78.2	Confident	82 Å²	82	65.1 Å²	65.1	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-67.2	-43.6	176.1	-68.2	-6.9	0	0	0	111.6	Q342 K343 L344 A348 K349 E350	Q342-N346 PolarHBondContact NE2-OD1 3Å; Q342-N346 PolarHBondContact O-N 3.31Å; Q342-N346 PolarHBondContact O-OD1 3.2Å; Q342-N346 VanDerWaalsContact O-OD1 3.14Å; K343-N346 WeakPolarHBondContact O-CB 3.49Å; K343-N346 PolarHBondContact O-N 2.99Å; K343-N346 VanDerWaalsContact O-N 3.16Å; L344-N346 VanDerWaalsContact C-N 3.3Å; L344-N346 PolarHBondContact O-N 2.96Å; N346-A348 VanDerWaalsContact C-N 3.35Å; N346-A348 PolarHBondContact O-N 3.27Å; N346-K349 PolarHBondContact O-N 2.86Å; N346-E350 PolarHBondContact O-N 3.28Å
347	I	82	Confident	80	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.087	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-41.6	175	-63.1	167	0	0	0	110.8	K343 L344 E350 L351 Y496 K499	K343-I347 WeakPolarHBondContact O-CG1 3.42Å; K343-I347 PolarHBondContact O-N 3.47Å; L344-I347 PolarHBondContact O-N 3.14Å; I347-E350 PolarHBondContact O-N 3.07Å; I347-L351 PolarHBondContact O-N 3.47Å; I347-Y496 HydrophobicContact CG2-CD2 4.23Å; I347-K499 HydrophobicContact CD1-CB 4.34Å; I347-K499 HydrophobicContact CD1-CG 3.69Å
348	A	88.8	Confident	82.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-42.3	175	0	0	0	0	0	112.1	L344 L345 N346 E350 L351 L352 I409 W413 I419	L344-A348 WeakPolarHBondContact O-CB 3.31Å; L344-A348 PolarHBondContact O-N 3.28Å; L345-A348 PolarHBondContact O-N 2.93Å; N346-A348 VanDerWaalsContact C-N 3.35Å; N346-A348 PolarHBondContact O-N 3.27Å; A348-E350 PolarHBondContact O-N 2.91Å; A348-L351 WeakPolarHBondContact O-CB 3.39Å; A348-L351 PolarHBondContact O-N 3.12Å; A348-L352 PolarHBondContact O-N 3.16Å; A348-I409 HydrophobicContact CB-CD1 3.98Å; A348-I409 HydrophobicContact CB-CG1 4.11Å; A348-I409 HydrophobicContact CB-CG2 4.43Å; A348-I409 WeakPolarHBondContact O-CD1 3.17Å; A348-W413 HydrophobicContact CB-CH2 3.59Å; A348-W413 HydrophobicContact CB-CZ2 4.39Å; A348-W413 HydrophobicContact CB-CZ3 3.71Å; A348-I419 HydrophobicContact CB-CG2 4.27Å
349	K	84	Confident	84.8	Confident	102 Å²	102	47.8 Å²	47.8	44%	0.443	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-36.9	174	-78	171	175.2	171.9	0	112.5	L345 N346 L352 H353 I409	L345-K349 HydrophobicContact CD1-CD 4.1Å; L345-K349 HydrophobicContact CD1-CG 4.13Å; L345-K349 HydrophobicContact CG-CD 4.09Å; L345-K349 WeakPolarHBondContact O-CB 3.44Å; L345-K349 VanDerWaalsContact O-CG 3.29Å; L345-K349 WeakPolarHBondContact O-CG 3.46Å; L345-K349 PolarHBondContact O-N 3.45Å; N346-K349 PolarHBondContact O-N 2.86Å; K349-L352 PolarHBondContact O-N 3.49Å; K349-H353 VanDerWaalsContact O-CB 3.31Å; K349-H353 WeakPolarHBondContact O-CB 3.26Å; K349-H353 PolarHBondContact O-N 3.49Å; K349-I409 HydrophobicContact CG-CG2 4.03Å
350	E	84.8	Confident	85.6	Confident	106 Å²	106	50.8 Å²	50.8	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-65	-46.1	172.9	-172.2	-175	156.3	0	0	111.4	N346 I347 A348 L352 H353 T354 L492	N346-E350 PolarHBondContact O-N 3.28Å; I347-E350 PolarHBondContact O-N 3.07Å; A348-E350 PolarHBondContact O-N 2.91Å; E350-L352 VanDerWaalsContact C-N 3.33Å; E350-L352 PolarHBondContact O-N 2.7Å; E350-H353 PolarHBondContact O-N 3.04Å; E350-T354 HydrophobicContact CG-CG2 4.18Å; E350-T354 WeakPolarHBondContact O-CB 3.28Å; E350-T354 VanDerWaalsContact O-CG2 3.3Å; E350-T354 WeakPolarHBondContact O-CG2 3.49Å; E350-T354 PolarHBondContact O-N 3.28Å; E350-T354 PolarHBondContact O-OG1 3.5Å; E350-L492 HydrophobicContact CG-CD2 4.29Å
351	L	85	Confident	86.3	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-55.3	-48.7	174.7	175.6	64.4	0	0	0	111	I347 A348 T354 E355 L405 I419 L423 R485 Y489 L492	I347-L351 PolarHBondContact O-N 3.47Å; A348-L351 WeakPolarHBondContact O-CB 3.39Å; A348-L351 PolarHBondContact O-N 3.12Å; L351-T354 PolarHBondContact O-OG1 2.87Å; L351-E355 VanDerWaalsContact O-CB 3.24Å; L351-E355 WeakPolarHBondContact O-CB 3.46Å; L351-E355 PolarHBondContact O-N 2.95Å; L351-L405 HydrophobicContact CD2-CD1 4.25Å; L351-L405 HydrophobicContact CD2-CD2 3.97Å; L351-L405 HydrophobicContact CG-CD1 4.17Å; L351-I419 HydrophobicContact CD2-CD1 3.9Å; L351-L423 HydrophobicContact CD2-CD1 4.11Å; L351-L423 HydrophobicContact CD2-CD2 4.49Å; L351-R485 PolarHBondContact O-NH2 3.3Å; L351-Y489 HydrophobicContact CD1-CD1 3.8Å; L351-Y489 HydrophobicContact CD1-CE1 3.9Å; L351-L492 HydrophobicContact CB-CD1 4.36Å; L351-L492 HydrophobicContact CD1-CD1 3.89Å
352	L	89.7	Confident	86.9	Confident	13 Å²	13	47.6 Å²	47.6	7%	0.068	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-47.8	178	175.8	61	0	0	0	112.8	A348 K349 E350 E355 E356 L402 L405 K406 I409 T410	A348-L352 PolarHBondContact O-N 3.16Å; K349-L352 PolarHBondContact O-N 3.49Å; E350-L352 VanDerWaalsContact C-N 3.33Å; E350-L352 PolarHBondContact O-N 2.7Å; L352-E355 WeakPolarHBondContact O-CB 3.46Å; L352-E355 PolarHBondContact O-N 2.9Å; L352-E355 VanDerWaalsContact O-N 3.14Å; L352-E356 HydrophobicContact CD1-CG 4.49Å; L352-E356 PolarHBondContact O-N 3.46Å; L352-L402 HydrophobicContact CD1-CD1 3.58Å; L352-L405 HydrophobicContact CD1-CB 4.3Å; L352-K406 HydrophobicContact CD1-CB 3.87Å; L352-K406 HydrophobicContact CD1-CG 4.38Å; L352-I409 HydrophobicContact CB-CD1 4.04Å; L352-I409 HydrophobicContact CD2-CB 4.07Å; L352-I409 HydrophobicContact CD2-CG2 3.96Å; L352-T410 HydrophobicContact CD2-CG2 3.78Å
353	H	79.1	Confident	87.4	Confident	131 Å²	131	46.7 Å²	46.7	61%	0.606	23%	0.227	S	C	*	.	H	α-helix	trans	-66	-42	-177.9	-177.1	69.9	0	0	0	111.8	K349 E350 E355 E356 A357	K349-H353 VanDerWaalsContact O-CB 3.31Å; K349-H353 WeakPolarHBondContact O-CB 3.26Å; K349-H353 PolarHBondContact O-N 3.49Å; E350-H353 PolarHBondContact O-N 3.04Å; H353-E355 VanDerWaalsContact C-N 3.25Å; H353-E355 PolarHBondContact O-N 3.48Å; H353-E356 PolarHBondContact O-N 3.08Å; H353-A357 PolarHBondContact O-N 2.91Å
354	T	83.6	Confident	87.9	Confident	42 Å²	42	43.3 Å²	43.3	26%	0.258	21%	0.213	S	C	.	.	H	α-helix	trans	-69.1	-24.6	174.2	62	0	0	0	0	112.3	E350 L351 Y358 R485	E350-T354 HydrophobicContact CG-CG2 4.18Å; E350-T354 WeakPolarHBondContact O-CB 3.28Å; E350-T354 VanDerWaalsContact O-CG2 3.3Å; E350-T354 WeakPolarHBondContact O-CG2 3.49Å; E350-T354 PolarHBondContact O-N 3.28Å; E350-T354 PolarHBondContact O-OG1 3.5Å; L351-T354 PolarHBondContact O-OG1 2.87Å; T354-Y358 VanDerWaalsContact O-CB 3.25Å; T354-Y358 WeakPolarHBondContact O-CB 3.4Å; T354-Y358 PolarHBondContact O-N 3.27Å; T354-R485 VanDerWaalsContact CB-NH1 3.3Å; T354-R485 PolarHBondContact OG1-NH1 3.09Å; T354-R485 PolarHBondContact OG1-NH2 3.21Å
355	E	90.9	Very high	88.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-73	-45.9	171.7	-169.8	63.7	-171.3	0	0	112	L351 L352 H353 A357 Y358 V359 H397 L402 L405 R485 Y489	L351-E355 VanDerWaalsContact O-CB 3.24Å; L351-E355 WeakPolarHBondContact O-CB 3.46Å; L351-E355 PolarHBondContact O-N 2.95Å; L352-E355 WeakPolarHBondContact O-CB 3.46Å; L352-E355 PolarHBondContact O-N 2.9Å; L352-E355 VanDerWaalsContact O-N 3.14Å; H353-E355 VanDerWaalsContact C-N 3.25Å; H353-E355 PolarHBondContact O-N 3.48Å; E355-A357 PolarHBondContact O-N 2.72Å; E355-Y358 PolarHBondContact O-N 2.74Å; E355-Y358 VanDerWaalsContact O-N 3.09Å; E355-V359 HydrophobicContact CG-CG2 4.44Å; E355-V359 WeakPolarHBondContact O-CG2 3.22Å; E355-V359 PolarHBondContact O-N 3.16Å; E355-H397 IonicContact OE1-CE1 2.88Å; E355-H397 IonicContact OE1-CG 2.68Å; E355-H397 IonicContact OE1-ND1 2.66Å; E355-H397 PolarHBondContact OE1-ND1 2.98Å; E355-L402 HydrophobicContact CB-CD1 4.29Å; E355-L402 HydrophobicContact CG-CB 4.02Å; E355-L402 HydrophobicContact CG-CD1 4.01Å; E355-L405 HydrophobicContact CG-CD1 4.34Å; E355-R485 VanDerWaalsContact CA-NH2 3.34Å; E355-R485 VanDerWaalsContact N-NH2 3.2Å; E355-R485 IonicContact OE2-CZ 3.92Å; E355-R485 VanDerWaalsContact OE2-CZ 3.23Å; E355-R485 IonicContact OE2-NE 3.82Å; E355-R485 PolarHBondContact OE2-NE 3.29Å; E355-R485 IonicContact OE2-NH2 3.2Å; E355-R485 PolarHBondContact OE2-NH2 3.02Å; E355-Y489 PolarHBondContact OE2-OH 2.97Å
356	E	89.1	Confident	88.4	Confident	42 Å²	42	42.2 Å²	42.2	20%	0.196	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-37.4	173.4	-75	-162.5	165.3	0	0	112.2	L352 H353 K360 L402 K406	L352-E356 HydrophobicContact CD1-CG 4.49Å; L352-E356 PolarHBondContact O-N 3.46Å; H353-E356 PolarHBondContact O-N 3.08Å; E356-K360 WeakPolarHBondContact O-CD 3.41Å; E356-K360 WeakPolarHBondContact O-CE 3.47Å; E356-K360 WeakPolarHBondContact O-CG 3.29Å; E356-K360 PolarHBondContact O-N 3.42Å; E356-K360 IonicContact OE2-NZ 2.66Å; E356-L402 HydrophobicContact CG-CD1 3.63Å; E356-L402 HydrophobicContact CG-CD2 4.22Å; E356-K406 IonicContact OE1-NZ 2.78Å; E356-K406 PolarHBondContact OE1-NZ 2.88Å
357	A	85	Confident	88.7	Confident	47 Å²	47	42.9 Å²	42.9	39%	0.388	21%	0.208	S	C	.	.	H	α-helix	trans	-66.3	-43.7	173.5	0	0	0	0	0	111.6	H353 E355 K360 R361	H353-A357 PolarHBondContact O-N 2.91Å; E355-A357 PolarHBondContact O-N 2.72Å; A357-K360 PolarHBondContact O-N 2.78Å; A357-R361 VanDerWaalsContact O-CG 3.3Å; A357-R361 WeakPolarHBondContact O-CG 3.42Å; A357-R361 PolarHBondContact O-N 2.88Å
358	Y	89.4	Confident	89.3	Confident	10 Å²	10	43.7 Å²	43.7	4%	0.039	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-42.1	-179.3	178.2	-122.5	0	0	0	113.1	T354 E355 K360 R361 L362 H397 Y433 P482 R485	T354-Y358 VanDerWaalsContact O-CB 3.25Å; T354-Y358 WeakPolarHBondContact O-CB 3.4Å; T354-Y358 PolarHBondContact O-N 3.27Å; E355-Y358 PolarHBondContact O-N 2.74Å; E355-Y358 VanDerWaalsContact O-N 3.09Å; Y358-K360 VanDerWaalsContact C-N 3.32Å; Y358-K360 PolarHBondContact O-N 3.09Å; Y358-R361 WeakPolarHBondContact O-CA 3.24Å; Y358-R361 WeakPolarHBondContact O-CB 3.38Å; Y358-R361 PolarHBondContact O-N 2.69Å; Y358-L362 HydrophobicContact CD1-CD1 4.01Å; Y358-L362 HydrophobicContact CD2-CG 4.4Å; Y358-L362 HydrophobicContact CE1-CD1 3.48Å; Y358-L362 VanDerWaalsContact CE1-CD1 3.48Å; Y358-L362 HydrophobicContact CE1-CG 4.12Å; Y358-L362 HydrophobicContact CE2-CD1 4.21Å; Y358-L362 HydrophobicContact CE2-CD2 4.09Å; Y358-L362 HydrophobicContact CE2-CG 3.92Å; Y358-L362 PolarHBondContact O-N 3.41Å; Y358-H397 AromaticContact CE1-CG 3.92Å; Y358-H397 AromaticContact CE1-ND1 3.94Å; Y358-Y433 WeakPolarHBondContact CE1-OH 3.48Å; Y358-Y433 WeakPolarHBondContact OH-CE1 3.46Å; Y358-Y433 PolarHBondContact OH-OH 3.05Å; Y358-P482 HydrophobicContact CE2-CG 4.48Å; Y358-P482 VanDerWaalsContact OH-CA 3.28Å; Y358-P482 WeakPolarHBondContact OH-CA 3.44Å; Y358-P482 WeakPolarHBondContact OH-CB 3.38Å; Y358-R485 HydrophobicContact CD1-CB 4.35Å; Y358-R485 HydrophobicContact CD1-CG 3.65Å; Y358-R485 HydrophobicContact CD2-CB 4.32Å; Y358-R485 HydrophobicContact CD2-CG 4.34Å; Y358-R485 HydrophobicContact CE1-CB 3.94Å; Y358-R485 HydrophobicContact CE1-CG 3.56Å; Y358-R485 HydrophobicContact CE2-CB 3.93Å; Y358-R485 HydrophobicContact CE2-CG 4.29Å; Y358-R485 HydrophobicContact CG-CG 4.05Å
359	V	94.8	Very high	89.5	Confident	9 Å²	9	43.7 Å²	43.7	6%	0.055	21%	0.213	C	C	.	.	H	α-helix	trans	-60.9	-39.7	175.3	170.9	0	0	0	0	111.4	E355 R361 L362 N363 Y394 H397 D398 L402	E355-V359 HydrophobicContact CG-CG2 4.44Å; E355-V359 WeakPolarHBondContact O-CG2 3.22Å; E355-V359 PolarHBondContact O-N 3.16Å; V359-R361 PolarHBondContact O-N 3.01Å; V359-L362 PolarHBondContact O-N 3.25Å; V359-N363 WeakPolarHBondContact O-CB 3.45Å; V359-N363 PolarHBondContact O-N 3.16Å; V359-Y394 HydrophobicContact CG1-CE2 4.01Å; V359-H397 HydrophobicContact CG2-CB 3.86Å; V359-D398 HydrophobicContact CG1-CB 4.03Å; V359-D398 WeakPolarHBondContact CG1-OD1 3.49Å; V359-L402 HydrophobicContact CB-CD2 4Å; V359-L402 HydrophobicContact CG1-CD2 4.09Å; V359-L402 HydrophobicContact CG2-CB 4.11Å; V359-L402 HydrophobicContact CG2-CD2 3.87Å
360	K	90.6	Very high	89.9	Confident	129 Å²	129	39.6 Å²	39.6	56%	0.561	20%	0.198	S	C	*	.	H	α-helix	trans	-62.2	-29.3	173.6	-68.8	161.2	-165.5	158.6	0	112.6	E356 A357 Y358 L364	E356-K360 WeakPolarHBondContact O-CD 3.41Å; E356-K360 WeakPolarHBondContact O-CE 3.47Å; E356-K360 WeakPolarHBondContact O-CG 3.29Å; E356-K360 PolarHBondContact O-N 3.42Å; E356-K360 IonicContact OE2-NZ 2.66Å; A357-K360 PolarHBondContact O-N 2.78Å; Y358-K360 VanDerWaalsContact C-N 3.32Å; Y358-K360 PolarHBondContact O-N 3.09Å; K360-L364 PolarHBondContact O-N 3.42Å; K360-L364 VanDerWaalsContact O-N 3.12Å
361	R	89.6	Confident	90.2	Very high	76 Å²	76	37 Å²	37	29%	0.287	19%	0.189	S	C	.	.	H	α-helix	trans	-82.8	-36.7	178.5	-66.1	-78.7	-171.6	-133.5	-4.1	112.6	A357 Y358 V359 L364 L365 V469 E481	A357-R361 VanDerWaalsContact O-CG 3.3Å; A357-R361 WeakPolarHBondContact O-CG 3.42Å; A357-R361 PolarHBondContact O-N 2.88Å; Y358-R361 WeakPolarHBondContact O-CA 3.24Å; Y358-R361 WeakPolarHBondContact O-CB 3.38Å; Y358-R361 PolarHBondContact O-N 2.69Å; V359-R361 PolarHBondContact O-N 3.01Å; R361-L364 WeakPolarHBondContact O-CB 3.3Å; R361-L364 PolarHBondContact O-N 3.48Å; R361-L365 PolarHBondContact O-N 3.37Å; R361-L365 VanDerWaalsContact O-N 3.1Å; R361-V469 PolarHBondContact NH1-O 2.98Å; R361-E481 VanDerWaalsContact CB-OE2 3.25Å; R361-E481 WeakPolarHBondContact CB-OE2 3.49Å; R361-E481 WeakPolarHBondContact CD-OE1 3.06Å; R361-E481 WeakPolarHBondContact CD-OE2 3.45Å; R361-E481 WeakPolarHBondContact CG-OE2 3.49Å; R361-E481 IonicContact NE-OE1 3.16Å; R361-E481 IonicContact NE-OE2 3.56Å
362	L	93.6	Very high	90.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-43.7	167.1	-71.3	176	0	0	0	111.5	Y358 V359 L364 L365 D366 I390 I393 Y394 H397 P482	Y358-L362 HydrophobicContact CD1-CD1 4.01Å; Y358-L362 HydrophobicContact CD2-CG 4.4Å; Y358-L362 HydrophobicContact CE1-CD1 3.48Å; Y358-L362 VanDerWaalsContact CE1-CD1 3.48Å; Y358-L362 HydrophobicContact CE1-CG 4.12Å; Y358-L362 HydrophobicContact CE2-CD1 4.21Å; Y358-L362 HydrophobicContact CE2-CD2 4.09Å; Y358-L362 HydrophobicContact CE2-CG 3.92Å; Y358-L362 PolarHBondContact O-N 3.41Å; V359-L362 PolarHBondContact O-N 3.25Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 2.88Å; L362-L365 PolarHBondContact O-N 3.03Å; L362-D366 WeakPolarHBondContact O-CB 3.36Å; L362-D366 PolarHBondContact O-N 2.89Å; L362-I390 HydrophobicContact CD2-CD1 3.52Å; L362-I390 HydrophobicContact CD2-CG1 4.19Å; L362-I393 HydrophobicContact CD1-CG2 3.96Å; L362-I393 HydrophobicContact CD2-CG2 3.89Å; L362-Y394 HydrophobicContact CB-CD2 3.66Å; L362-Y394 HydrophobicContact CB-CG 4.21Å; L362-H397 HydrophobicContact CD1-CB 3.82Å; L362-P482 HydrophobicContact CD2-CG 3.98Å
363	N	94.2	Very high	90.7	Very high	56 Å²	56	40.3 Å²	40.3	30%	0.299	20%	0.202	S	C	.	.	H	α-helix	trans	-59.7	-40.7	173.7	-176.9	-83	0	0	0	112	V359 D366 Q367 V368 Y394	V359-N363 WeakPolarHBondContact O-CB 3.45Å; V359-N363 PolarHBondContact O-N 3.16Å; N363-D366 PolarHBondContact O-N 3.49Å; N363-Q367 WeakPolarHBondContact O-CA 3.41Å; N363-Q367 WeakPolarHBondContact O-CB 3.37Å; N363-Q367 PolarHBondContact O-N 3.09Å; N363-V368 PolarHBondContact O-N 3.02Å; N363-Y394 HydrophobicContact CB-CD2 4.41Å; N363-Y394 HydrophobicContact CB-CE2 3.77Å; N363-Y394 PolarHBondContact ND2-OH 2.86Å
364	L	93.3	Very high	91.3	Very high	6 Å²	6	37 Å²	37	3%	0.031	19%	0.191	C	C	.	.	I	π-helix	trans	-60.6	-44.5	173.9	-179.8	68.7	0	0	0	112.3	K360 R361 L362 V368 F369 I464 V469 H478	K360-L364 PolarHBondContact O-N 3.42Å; K360-L364 VanDerWaalsContact O-N 3.12Å; R361-L364 WeakPolarHBondContact O-CB 3.3Å; R361-L364 PolarHBondContact O-N 3.48Å; L362-L364 VanDerWaalsContact C-N 3.33Å; L362-L364 PolarHBondContact O-N 2.88Å; L364-V368 HydrophobicContact CD1-CB 4.1Å; L364-V368 HydrophobicContact CD1-CG1 4.39Å; L364-V368 HydrophobicContact CD1-CG2 4.17Å; L364-V368 WeakPolarHBondContact O-CB 3.28Å; L364-F369 HydrophobicContact CD1-CD2 4.5Å; L364-F369 HydrophobicContact CD1-CE2 4.32Å; L364-F369 HydrophobicContact CD2-CE2 4.37Å; L364-F369 HydrophobicContact CG-CD2 4.15Å; L364-F369 HydrophobicContact CG-CE2 4.02Å; L364-F369 WeakPolarHBondContact O-CD2 3.37Å; L364-F369 PolarHBondContact O-N 3.36Å; L364-I464 HydrophobicContact CD1-CG2 4.49Å; L364-V469 HydrophobicContact CD1-CB 4.4Å; L364-V469 HydrophobicContact CD1-CG2 3.91Å; L364-H478 WeakPolarHBondContact CD2-NE2 3.37Å
365	L	93.3	Very high	91.7	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.205	C	C	.	.	I	π-helix	trans	-65.3	-46.3	177.2	-72.5	173.2	0	0	0	112.5	R361 L362 F369 C370 F387 I390 L475 H478 M479 P482	R361-L365 PolarHBondContact O-N 3.37Å; R361-L365 VanDerWaalsContact O-N 3.1Å; L362-L365 PolarHBondContact O-N 3.03Å; L365-F369 WeakPolarHBondContact O-CB 3.39Å; L365-C370 PolarHBondContact O-N 3.47Å; L365-F387 HydrophobicContact CD2-CE1 4.4Å; L365-I390 HydrophobicContact CB-CG1 4.15Å; L365-I390 HydrophobicContact CD1-CD1 3.98Å; L365-I390 HydrophobicContact CD1-CG1 4.08Å; L365-L475 HydrophobicContact CD2-CD1 3.91Å; L365-H478 HydrophobicContact CD2-CB 3.74Å; L365-H478 HydrophobicContact CG-CB 4.23Å; L365-M479 HydrophobicContact CD2-CG 3.71Å; L365-P482 HydrophobicContact CD1-CG 4.28Å
366	D	92.4	Very high	91.6	Very high	10 Å²	10	41.1 Å²	41.1	5%	0.053	21%	0.21	C	C	.	.	I	π-helix	trans	-85.9	-63.8	-172.5	-169.7	59.1	0	0	0	111.9	L362 N363 V368 C370 T371 I390 S391 Y394	L362-D366 WeakPolarHBondContact O-CB 3.36Å; L362-D366 PolarHBondContact O-N 2.89Å; N363-D366 PolarHBondContact O-N 3.49Å; D366-V368 PolarHBondContact O-N 2.87Å; D366-C370 VanDerWaalsContact O-CB 3.22Å; D366-C370 WeakPolarHBondContact O-CB 3.36Å; D366-C370 PolarHBondContact O-N 2.93Å; D366-T371 PolarHBondContact O-N 3.21Å; D366-T371 PolarHBondContact O-OG1 3.03Å; D366-I390 HydrophobicContact CB-CG2 4.4Å; D366-S391 WeakPolarHBondContact OD1-CA 3.15Å; D366-S391 WeakPolarHBondContact OD1-CB 3.39Å; D366-S391 PolarHBondContact OD1-OG 3.44Å; D366-Y394 HydrophobicContact CB-CD1 4.15Å; D366-Y394 HydrophobicContact CB-CG 4.41Å; D366-Y394 WeakPolarHBondContact OD2-CD1 3.31Å
367	Q	90.5	Very high	91.7	Very high	97 Å²	97	43.9 Å²	43.9	45%	0.453	23%	0.234	S	C	.	.	I	π-helix	trans	-76	-22.2	-172	-60.5	-62.5	-54.8	0	0	113.6	N363 T371 Y394	N363-Q367 WeakPolarHBondContact O-CA 3.41Å; N363-Q367 WeakPolarHBondContact O-CB 3.37Å; N363-Q367 PolarHBondContact O-N 3.09Å; Q367-T371 WeakPolarHBondContact O-CB 3.42Å; Q367-T371 PolarHBondContact O-OG1 2.89Å; Q367-Y394 HydrophobicContact CG-CD1 4.25Å; Q367-Y394 HydrophobicContact CG-CE1 3.64Å
368	V	92.9	Very high	92	Very high	33 Å²	33	42 Å²	42	20%	0.2	22%	0.218	C	C	.	.	I	π-helix	trans	-101.4	-64.1	174.4	-169.7	0	0	0	0	112.1	N363 L364 D366 K372 I464	N363-V368 PolarHBondContact O-N 3.02Å; L364-V368 HydrophobicContact CD1-CB 4.1Å; L364-V368 HydrophobicContact CD1-CG1 4.39Å; L364-V368 HydrophobicContact CD1-CG2 4.17Å; L364-V368 WeakPolarHBondContact O-CB 3.28Å; D366-V368 PolarHBondContact O-N 2.87Å; V368-K372 WeakPolarHBondContact O-CB 3.25Å; V368-K372 WeakPolarHBondContact O-CG 3.25Å; V368-K372 PolarHBondContact O-N 3.32Å; V368-I464 HydrophobicContact CG1-CD1 4.42Å; V368-I464 HydrophobicContact CG1-CG1 4.37Å; V368-I464 HydrophobicContact CG1-CG2 3.88Å
369	F	93.6	Very high	92.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-67.1	-52.7	-174.5	-80.7	-76.7	0	0	0	113.2	L364 L365 K372 L373 F387 V461 I464 L475	L364-F369 HydrophobicContact CD1-CD2 4.5Å; L364-F369 HydrophobicContact CD1-CE2 4.32Å; L364-F369 HydrophobicContact CD2-CE2 4.37Å; L364-F369 HydrophobicContact CG-CD2 4.15Å; L364-F369 HydrophobicContact CG-CE2 4.02Å; L364-F369 WeakPolarHBondContact O-CD2 3.37Å; L364-F369 PolarHBondContact O-N 3.36Å; L365-F369 WeakPolarHBondContact O-CB 3.39Å; F369-K372 PolarHBondContact O-N 2.72Å; F369-L373 WeakPolarHBondContact O-CB 3.43Å; F369-L373 WeakPolarHBondContact O-CD1 3.45Å; F369-L373 VanDerWaalsContact O-CG 3.28Å; F369-L373 WeakPolarHBondContact O-CG 3.42Å; F369-L373 PolarHBondContact O-N 2.97Å; F369-F387 HydrophobicContact CB-CE1 4.11Å; F369-F387 HydrophobicContact CB-CZ 3.81Å; F369-V461 HydrophobicContact CE1-CG1 4.18Å; F369-I464 HydrophobicContact CD1-CB 4.14Å; F369-I464 HydrophobicContact CD1-CD1 3.53Å; F369-I464 HydrophobicContact CD1-CG1 4.45Å; F369-I464 HydrophobicContact CD1-CG2 3.98Å; F369-I464 HydrophobicContact CD2-CG2 4.15Å; F369-I464 HydrophobicContact CE1-CB 3.64Å; F369-I464 HydrophobicContact CE1-CD1 3.92Å; F369-I464 HydrophobicContact CE1-CG1 4.4Å; F369-I464 HydrophobicContact CE1-CG2 3.56Å; F369-I464 HydrophobicContact CE2-CG2 3.74Å; F369-I464 HydrophobicContact CG-CD1 4.17Å; F369-I464 HydrophobicContact CG-CG2 4.26Å; F369-I464 HydrophobicContact CZ-CB 3.95Å; F369-I464 HydrophobicContact CZ-CG2 3.43Å; F369-I464 VanDerWaalsContact CZ-CG2 3.43Å; F369-L475 HydrophobicContact CB-CD1 4.26Å; F369-L475 HydrophobicContact CD1-CD1 3.92Å; F369-L475 HydrophobicContact CD1-CD2 4.3Å; F369-L475 HydrophobicContact CD2-CD1 3.92Å; F369-L475 HydrophobicContact CE1-CB 4.1Å; F369-L475 HydrophobicContact CE1-CD1 4.15Å; F369-L475 HydrophobicContact CE1-CD2 4.49Å; F369-L475 HydrophobicContact CE1-CG 4.48Å; F369-L475 HydrophobicContact CE2-CD1 4.16Å; F369-L475 HydrophobicContact CG-CD1 3.8Å; F369-L475 HydrophobicContact CZ-CB 4.19Å; F369-L475 HydrophobicContact CZ-CD1 4.27Å
370	C	92.2	Very high	92	Very high	17 Å²	17	48.4 Å²	48.4	12%	0.115	25%	0.252	C	S	.	.	I	π-helix	trans	-62.4	-46.7	-179.2	-174.1	0	0	0	0	111.4	L365 D366 K372 L373 T374 I383 F387	L365-C370 PolarHBondContact O-N 3.47Å; D366-C370 VanDerWaalsContact O-CB 3.22Å; D366-C370 WeakPolarHBondContact O-CB 3.36Å; D366-C370 PolarHBondContact O-N 2.93Å; C370-K372 PolarHBondContact O-N 3.27Å; C370-L373 PolarHBondContact O-N 3.36Å; C370-T374 PolarHBondContact O-N 3.5Å; C370-T374 PolarHBondContact O-OG1 3.4Å; C370-I383 WeakPolarHBondContact SG-CG2 3.46Å; C370-F387 HydrophobicContact CB-CD2 3.89Å; C370-F387 HydrophobicContact CB-CE2 4.06Å; C370-F387 HydrophobicContact CB-CG 4.19Å; C370-F387 HydrophobicContact CB-CZ 4.48Å
371	T	90.7	Very high	92.1	Very high	50 Å²	50	47.5 Å²	47.5	31%	0.307	25%	0.253	S	S	.	.	H	α-helix	trans	-56.4	-50.6	174.6	-51.8	0	0	0	0	112.6	D366 Q367 L373 T374 E375	D366-T371 PolarHBondContact O-N 3.21Å; D366-T371 PolarHBondContact O-OG1 3.03Å; Q367-T371 WeakPolarHBondContact O-CB 3.42Å; Q367-T371 PolarHBondContact O-OG1 2.89Å; T371-L373 VanDerWaalsContact C-N 3.33Å; T371-L373 PolarHBondContact O-N 3.43Å; T371-T374 WeakPolarHBondContact O-CB 3.22Å; T371-T374 PolarHBondContact O-N 2.97Å; T371-T374 VanDerWaalsContact O-N 3.12Å; T371-E375 PolarHBondContact O-N 2.77Å
372	K	92.4	Very high	92.2	Very high	87 Å²	87	44.2 Å²	44.2	38%	0.378	24%	0.241	S	C	.	.	H	α-helix	trans	-69.9	-28.2	-176.6	-69	-71.1	165.8	-134.7	0	113.5	V368 F369 C370 E375 A376 V460 I464	V368-K372 WeakPolarHBondContact O-CB 3.25Å; V368-K372 WeakPolarHBondContact O-CG 3.25Å; V368-K372 PolarHBondContact O-N 3.32Å; F369-K372 PolarHBondContact O-N 2.72Å; C370-K372 PolarHBondContact O-N 3.27Å; K372-E375 WeakPolarHBondContact CD-OE2 3.41Å; K372-E375 IonicContact NZ-OE1 2.81Å; K372-E375 PolarHBondContact NZ-OE1 2.71Å; K372-E375 IonicContact NZ-OE2 3.97Å; K372-E375 PolarHBondContact NZ-OE2 3.42Å; K372-A376 VanDerWaalsContact O-CB 3.28Å; K372-A376 WeakPolarHBondContact O-CB 3.44Å; K372-A376 PolarHBondContact O-N 2.69Å; K372-A376 VanDerWaalsContact O-N 3.11Å; K372-V460 HydrophobicContact CB-CG1 3.95Å; K372-I464 HydrophobicContact CB-CD1 3.85Å; K372-I464 HydrophobicContact CG-CD1 4.25Å
373	L	93.3	Very high	92.2	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-73.4	-32.7	171.2	-69.7	167.1	0	0	0	111.7	F369 C370 T371 A376 I378 I383 F387 F457 V460 V461	F369-L373 WeakPolarHBondContact O-CB 3.43Å; F369-L373 WeakPolarHBondContact O-CD1 3.45Å; F369-L373 VanDerWaalsContact O-CG 3.28Å; F369-L373 WeakPolarHBondContact O-CG 3.42Å; F369-L373 PolarHBondContact O-N 2.97Å; C370-L373 PolarHBondContact O-N 3.36Å; T371-L373 VanDerWaalsContact C-N 3.33Å; T371-L373 PolarHBondContact O-N 3.43Å; L373-A376 PolarHBondContact O-N 3.21Å; L373-I378 HydrophobicContact CB-CG1 4.37Å; L373-I378 HydrophobicContact CD2-CG1 4.06Å; L373-I378 WeakPolarHBondContact O-CB 3.3Å; L373-I378 WeakPolarHBondContact O-CG1 3.28Å; L373-I378 PolarHBondContact O-N 3.04Å; L373-I383 HydrophobicContact CB-CD1 4.22Å; L373-I383 HydrophobicContact CB-CG1 4.4Å; L373-F387 HydrophobicContact CD1-CE2 3.73Å; L373-F387 HydrophobicContact CD1-CZ 3.92Å; L373-F457 HydrophobicContact CD1-CE2 3.89Å; L373-F457 HydrophobicContact CD1-CZ 4.44Å; L373-F457 HydrophobicContact CD2-CD2 3.58Å; L373-F457 HydrophobicContact CD2-CE2 3.79Å; L373-F457 HydrophobicContact CD2-CG 4.25Å; L373-F457 HydrophobicContact CG-CE2 4.49Å; L373-V460 HydrophobicContact CD2-CB 4.06Å; L373-V460 HydrophobicContact CD2-CG1 3.78Å; L373-V460 HydrophobicContact CG-CG1 4.14Å; L373-V461 HydrophobicContact CD2-CG2 4.24Å
374	T	91.4	Very high	92.1	Very high	61 Å²	61	45.2 Å²	45.2	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-67.9	-46.9	172.9	-50.9	0	0	0	0	111.3	C370 T371 A376 S377 I383	C370-T374 PolarHBondContact O-N 3.5Å; C370-T374 PolarHBondContact O-OG1 3.4Å; T371-T374 WeakPolarHBondContact O-CB 3.22Å; T371-T374 PolarHBondContact O-N 2.97Å; T371-T374 VanDerWaalsContact O-N 3.12Å; T374-A376 PolarHBondContact O-N 2.84Å; T374-S377 PolarHBondContact O-N 3.12Å; T374-I383 WeakPolarHBondContact OG1-CD1 3.45Å
375	E	92.1	Very high	92	Very high	116 Å²	116	45.5 Å²	45.5	54%	0.542	25%	0.254	S	S	.	.	H	α-helix	trans	-57	-35	172.3	-74	174.9	-152.2	0	0	112.4	T371 K372 S377	T371-E375 PolarHBondContact O-N 2.77Å; K372-E375 WeakPolarHBondContact CD-OE2 3.41Å; K372-E375 IonicContact NZ-OE1 2.81Å; K372-E375 PolarHBondContact NZ-OE1 2.71Å; K372-E375 IonicContact NZ-OE2 3.97Å; K372-E375 PolarHBondContact NZ-OE2 3.42Å; E375-S377 PolarHBondContact O-N 2.9Å
376	A	89.5	Confident	92	Very high	13 Å²	13	45.4 Å²	45.4	11%	0.107	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	12.8	177.2	0	0	0	0	0	114.1	K372 L373 T374 I378 Q456 V460	K372-A376 VanDerWaalsContact O-CB 3.28Å; K372-A376 WeakPolarHBondContact O-CB 3.44Å; K372-A376 PolarHBondContact O-N 2.69Å; K372-A376 VanDerWaalsContact O-N 3.11Å; L373-A376 PolarHBondContact O-N 3.21Å; T374-A376 PolarHBondContact O-N 2.84Å; A376-I378 HydrophobicContact CB-CG1 4.41Å; A376-I378 PolarHBondContact O-N 2.87Å; A376-I378 VanDerWaalsContact O-N 3.16Å; A376-Q456 HydrophobicContact CB-CG 4.35Å; A376-Q456 PolarHBondContact O-NE2 2.97Å; A376-Q456 PolarHBondContact O-OE1 3.28Å; A376-V460 HydrophobicContact CB-CG2 3.64Å
377	S	90.5	Very high	92	Very high	100 Å²	100	45.1 Å²	45.1	70%	0.699	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	28.4	177.1	-54.1	0	0	0	0	114.5	T374 E375	T374-S377 PolarHBondContact O-N 3.12Å; E375-S377 PolarHBondContact O-N 2.9Å
378	I	92.6	Very high	92.1	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.046	24%	0.238	C	C	.	.			trans	-68.7	138.3	169.2	-56.8	-58.7	0	0	0	108.1	L373 A376 Q380 V382 I383 W450 F457	L373-I378 HydrophobicContact CB-CG1 4.37Å; L373-I378 HydrophobicContact CD2-CG1 4.06Å; L373-I378 WeakPolarHBondContact O-CB 3.3Å; L373-I378 WeakPolarHBondContact O-CG1 3.28Å; L373-I378 PolarHBondContact O-N 3.04Å; A376-I378 HydrophobicContact CB-CG1 4.41Å; A376-I378 PolarHBondContact O-N 2.87Å; A376-I378 VanDerWaalsContact O-N 3.16Å; I378-Q380 PolarHBondContact O-N 2.98Å; I378-V382 HydrophobicContact CG2-CB 4.26Å; I378-V382 HydrophobicContact CG2-CG1 4.06Å; I378-I383 HydrophobicContact CB-CD1 4.13Å; I378-I383 HydrophobicContact CB-CG1 4.16Å; I378-I383 HydrophobicContact CG2-CD1 4.5Å; I378-I383 HydrophobicContact CG2-CG1 3.98Å; I378-I383 WeakPolarHBondContact O-CD1 3.31Å; I378-W450 HydrophobicContact CD1-CZ3 4.49Å; I378-W450 HydrophobicContact CG2-CE3 4.4Å; I378-W450 HydrophobicContact CG2-CZ3 4.48Å; I378-F457 HydrophobicContact CD1-CB 3.95Å; I378-F457 HydrophobicContact CD1-CD2 4.34Å; I378-F457 HydrophobicContact CG1-CD2 4.26Å; I378-F457 HydrophobicContact CG2-CD2 4.24Å
379	P	92.8	Very high	92.1	Very high	53 Å²	53	40.6 Å²	40.6	34%	0.344	23%	0.232	S	C	.	.			trans	-58.5	136	-175.2	-26.6	35.8	0	0	0	113.3	D381 V382 I383 W450	P379-D381 WeakPolarHBondContact CB-OD1 3.43Å; P379-D381 PolarHBondContact O-N 3.02Å; P379-V382 HydrophobicContact CB-CB 4.46Å; P379-V382 HydrophobicContact CB-CG2 4.02Å; P379-V382 HydrophobicContact CG-CG2 4.35Å; P379-V382 WeakPolarHBondContact O-CA 3.48Å; P379-V382 VanDerWaalsContact O-CB 3.3Å; P379-V382 WeakPolarHBondContact O-CB 3.39Å; P379-V382 PolarHBondContact O-N 3.41Å; P379-I383 PolarHBondContact O-N 3.38Å; P379-W450 HydrophobicContact CG-CH2 3.94Å
380	Q	90.9	Very high	92.1	Very high	99 Å²	99	40.6 Å²	40.6	46%	0.463	23%	0.232	S	C	.	.	H	α-helix	trans	-63.7	-28.7	-172.5	-165.8	63.2	27.5	0	0	113.2	I378 V382 I383 T384	I378-Q380 PolarHBondContact O-N 2.98Å; Q380-V382 VanDerWaalsContact C-N 3.31Å; Q380-I383 PolarHBondContact O-N 3.11Å; Q380-T384 HydrophobicContact CG-CG2 4.5Å; Q380-T384 WeakPolarHBondContact O-CB 3.39Å; Q380-T384 WeakPolarHBondContact O-CG2 3.43Å; Q380-T384 PolarHBondContact O-N 3.42Å; Q380-T384 PolarHBondContact O-OG1 3.18Å
381	D	91.6	Very high	92.1	Very high	110 Å²	110	42 Å²	42	59%	0.588	24%	0.241	S	C	*	.	H	α-helix	trans	-66.7	-32	172.8	62.9	-63.8	0	0	0	112.4	P379 T384 G385	P379-D381 WeakPolarHBondContact CB-OD1 3.43Å; P379-D381 PolarHBondContact O-N 3.02Å; D381-T384 WeakPolarHBondContact CA-OG1 3.5Å; D381-T384 PolarHBondContact O-OG1 3.21Å; D381-G385 WeakPolarHBondContact O-CA 3.32Å; D381-G385 PolarHBondContact O-N 2.91Å
382	V	92.9	Very high	92.3	Very high	7 Å²	7	41 Å²	41	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-74.8	-43.5	173.7	176.8	0	0	0	0	110.1	I378 P379 Q380 G385 I386 W450	I378-V382 HydrophobicContact CG2-CB 4.26Å; I378-V382 HydrophobicContact CG2-CG1 4.06Å; P379-V382 HydrophobicContact CB-CB 4.46Å; P379-V382 HydrophobicContact CB-CG2 4.02Å; P379-V382 HydrophobicContact CG-CG2 4.35Å; P379-V382 WeakPolarHBondContact O-CA 3.48Å; P379-V382 VanDerWaalsContact O-CB 3.3Å; P379-V382 WeakPolarHBondContact O-CB 3.39Å; P379-V382 PolarHBondContact O-N 3.41Å; Q380-V382 VanDerWaalsContact C-N 3.31Å; V382-G385 CarbonylContact O-C 3.53Å; V382-G385 PolarHBondContact O-N 3.38Å; V382-I386 HydrophobicContact CG1-CD1 3.86Å; V382-I386 WeakPolarHBondContact O-CB 3.47Å; V382-I386 VanDerWaalsContact O-CG1 3.31Å; V382-I386 WeakPolarHBondContact O-CG1 3.32Å; V382-I386 PolarHBondContact O-N 3.28Å; V382-W450 HydrophobicContact CB-CZ2 4.45Å; V382-W450 HydrophobicContact CG1-CD2 3.85Å; V382-W450 HydrophobicContact CG1-CG 3.88Å; V382-W450 HydrophobicContact CG1-CZ2 4.32Å; V382-W450 HydrophobicContact CG2-CH2 4.3Å; V382-W450 HydrophobicContact CG2-CZ2 3.49Å; V382-W450 VanDerWaalsContact CG2-CZ2 3.49Å
383	I	93.4	Very high	92.4	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-51.5	177.4	-62.3	179.2	0	0	0	110	C370 L373 T374 I378 P379 Q380 G385 I386 F387	C370-I383 WeakPolarHBondContact SG-CG2 3.46Å; L373-I383 HydrophobicContact CB-CD1 4.22Å; L373-I383 HydrophobicContact CB-CG1 4.4Å; T374-I383 WeakPolarHBondContact OG1-CD1 3.45Å; I378-I383 HydrophobicContact CB-CD1 4.13Å; I378-I383 HydrophobicContact CB-CG1 4.16Å; I378-I383 HydrophobicContact CG2-CD1 4.5Å; I378-I383 HydrophobicContact CG2-CG1 3.98Å; I378-I383 WeakPolarHBondContact O-CD1 3.31Å; P379-I383 PolarHBondContact O-N 3.38Å; Q380-I383 PolarHBondContact O-N 3.11Å; I383-G385 VanDerWaalsContact C-N 3.29Å; I383-G385 PolarHBondContact O-N 2.98Å; I383-I386 PolarHBondContact O-N 2.99Å; I383-I386 VanDerWaalsContact O-N 3.16Å; I383-F387 HydrophobicContact CG2-CD2 3.85Å; I383-F387 HydrophobicContact CG2-CE2 4.35Å; I383-F387 VanDerWaalsContact O-CD2 3.29Å; I383-F387 WeakPolarHBondContact O-CD2 2.99Å; I383-F387 PolarHBondContact O-N 3.39Å
384	T	92.2	Very high	92.5	Very high	76 Å²	76	37.8 Å²	37.8	47%	0.466	22%	0.222	S	C	.	.	H	α-helix	trans	-65.4	-29.9	174.8	53.9	0	0	0	0	112.7	Q380 D381 S388	Q380-T384 HydrophobicContact CG-CG2 4.5Å; Q380-T384 WeakPolarHBondContact O-CB 3.39Å; Q380-T384 WeakPolarHBondContact O-CG2 3.43Å; Q380-T384 PolarHBondContact O-N 3.42Å; Q380-T384 PolarHBondContact O-OG1 3.18Å; D381-T384 WeakPolarHBondContact CA-OG1 3.5Å; D381-T384 PolarHBondContact O-OG1 3.21Å; T384-S388 WeakPolarHBondContact O-CA 3.43Å; T384-S388 PolarHBondContact O-N 2.9Å
385	G	91.8	Very high	92.6	Very high	12 Å²	12	37.1 Å²	37.1	12%	0.124	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-31.3	171.9	0	0	0	0	0	114.4	D381 V382 I383 S443 L446	D381-G385 WeakPolarHBondContact O-CA 3.32Å; D381-G385 PolarHBondContact O-N 2.91Å; V382-G385 CarbonylContact O-C 3.53Å; V382-G385 PolarHBondContact O-N 3.38Å; I383-G385 VanDerWaalsContact C-N 3.29Å; I383-G385 PolarHBondContact O-N 2.98Å; G385-S443 WeakPolarHBondContact O-CA 3.49Å; G385-S443 WeakPolarHBondContact O-CB 3.48Å; G385-S443 PolarHBondContact O-OG 3.49Å; G385-L446 VanDerWaalsContact C-CD1 3.5Å
386	I	92.4	Very high	92.8	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-81.4	-47.5	175.9	-71.9	170	0	0	0	110.8	V382 I383 S443 L446 V447 F457 M479	V382-I386 HydrophobicContact CG1-CD1 3.86Å; V382-I386 WeakPolarHBondContact O-CB 3.47Å; V382-I386 VanDerWaalsContact O-CG1 3.31Å; V382-I386 WeakPolarHBondContact O-CG1 3.32Å; V382-I386 PolarHBondContact O-N 3.28Å; I383-I386 PolarHBondContact O-N 2.99Å; I383-I386 VanDerWaalsContact O-N 3.16Å; I386-S443 WeakPolarHBondContact O-CB 3.32Å; I386-S443 PolarHBondContact O-OG 3Å; I386-L446 HydrophobicContact CD1-CB 4.23Å; I386-L446 HydrophobicContact CG1-CB 3.58Å; I386-L446 HydrophobicContact CG1-CD1 4.42Å; I386-V447 HydrophobicContact CB-CG2 4.35Å; I386-V447 HydrophobicContact CD1-CG2 4.03Å; I386-V447 HydrophobicContact CG1-CG2 3.95Å; I386-V447 HydrophobicContact CG2-CG2 3.54Å; I386-F457 HydrophobicContact CD1-CE2 3.58Å; I386-F457 HydrophobicContact CD1-CZ 3.74Å; I386-M479 HydrophobicContact CG2-CE 3.94Å; I386-M479 HydrophobicContact CG2-SD 4.21Å; I386-M479 WeakPolarHBondContact O-CE 3.3Å
387	F	93.4	Very high	93	Very high	3 Å²	3	31.1 Å²	31.1	1%	0.013	19%	0.185	C	C	.	.	H	α-helix	trans	-91.6	-9.3	-172.4	-68.2	-69.8	0	0	0	113.8	L365 F369 C370 L373 I383 N389 I390 L475	L365-F387 HydrophobicContact CD2-CE1 4.4Å; F369-F387 HydrophobicContact CB-CE1 4.11Å; F369-F387 HydrophobicContact CB-CZ 3.81Å; C370-F387 HydrophobicContact CB-CD2 3.89Å; C370-F387 HydrophobicContact CB-CE2 4.06Å; C370-F387 HydrophobicContact CB-CG 4.19Å; C370-F387 HydrophobicContact CB-CZ 4.48Å; L373-F387 HydrophobicContact CD1-CE2 3.73Å; L373-F387 HydrophobicContact CD1-CZ 3.92Å; I383-F387 HydrophobicContact CG2-CD2 3.85Å; I383-F387 HydrophobicContact CG2-CE2 4.35Å; I383-F387 VanDerWaalsContact O-CD2 3.29Å; I383-F387 WeakPolarHBondContact O-CD2 2.99Å; I383-F387 PolarHBondContact O-N 3.39Å; F387-N389 PolarHBondContact O-N 2.88Å; F387-I390 HydrophobicContact CB-CG2 3.7Å; F387-I390 HydrophobicContact CD1-CG2 4.15Å; F387-I390 HydrophobicContact CG-CG2 4.29Å; F387-I390 VanDerWaalsContact O-CB 3.29Å; F387-I390 WeakPolarHBondContact O-CB 3.2Å; F387-I390 PolarHBondContact O-N 3.42Å; F387-L475 HydrophobicContact CE1-CD1 4.05Å; F387-L475 HydrophobicContact CZ-CD1 4.21Å
388	S	91.8	Very high	93.3	Very high	24 Å²	24	28.8 Å²	28.8	17%	0.168	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	-122.1	-178.9	-169.7	0	0	0	0	110.3	T384 E435 N439	T384-S388 WeakPolarHBondContact O-CA 3.43Å; T384-S388 PolarHBondContact O-N 2.9Å; S388-E435 PolarHBondContact OG-O 2.77Å; S388-N439 PolarHBondContact OG-ND2 2.68Å
389	N	92.6	Very high	93.3	Very high	12 Å²	12	33.2 Å²	33.2	6%	0.064	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	23.4	176.7	67.5	-7.2	0	0	0	114	F387 S391 S392 I393 M432 E435 Y436	F387-N389 PolarHBondContact O-N 2.88Å; N389-S391 PolarHBondContact O-N 2.86Å; N389-S391 VanDerWaalsContact O-N 3.12Å; N389-S392 WeakPolarHBondContact O-CA 3.22Å; N389-S392 VanDerWaalsContact O-CB 3.29Å; N389-S392 WeakPolarHBondContact O-CB 3.39Å; N389-S392 PolarHBondContact O-N 3Å; N389-I393 PolarHBondContact O-N 2.85Å; N389-M432 PolarHBondContact ND2-O 2.87Å; N389-E435 HydrophobicContact CB-CG 4.45Å; N389-E435 WeakPolarHBondContact ND2-CB 3.44Å; N389-E435 WeakPolarHBondContact ND2-CG 3.23Å; N389-E435 PolarHBondContact ND2-OE2 3.32Å; N389-Y436 VanDerWaalsContact OD1-CB 3.31Å; N389-Y436 WeakPolarHBondContact OD1-CB 3.45Å; N389-Y436 PolarHBondContact OD1-N 2.79Å
390	I	94.3	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-53.3	-36.8	-174.9	-161	63.6	0	0	0	113.4	L362 L365 D366 F387 S392 I393 Y394 Y436 P482	L362-I390 HydrophobicContact CD2-CD1 3.52Å; L362-I390 HydrophobicContact CD2-CG1 4.19Å; L365-I390 HydrophobicContact CB-CG1 4.15Å; L365-I390 HydrophobicContact CD1-CD1 3.98Å; L365-I390 HydrophobicContact CD1-CG1 4.08Å; D366-I390 HydrophobicContact CB-CG2 4.4Å; F387-I390 HydrophobicContact CB-CG2 3.7Å; F387-I390 HydrophobicContact CD1-CG2 4.15Å; F387-I390 HydrophobicContact CG-CG2 4.29Å; F387-I390 VanDerWaalsContact O-CB 3.29Å; F387-I390 WeakPolarHBondContact O-CB 3.2Å; F387-I390 PolarHBondContact O-N 3.42Å; I390-S392 VanDerWaalsContact C-N 3.25Å; I390-S392 PolarHBondContact O-N 3.25Å; I390-I393 HydrophobicContact CD1-CB 4.5Å; I390-I393 CarbonylContact O-C 3.51Å; I390-I393 WeakPolarHBondContact O-CA 3.47Å; I390-I393 WeakPolarHBondContact O-CB 3.28Å; I390-I393 PolarHBondContact O-N 3.3Å; I390-Y394 PolarHBondContact O-N 3.48Å; I390-Y436 HydrophobicContact CB-CE2 4.06Å; I390-Y436 HydrophobicContact CD1-CD2 4.31Å; I390-Y436 HydrophobicContact CD1-CE2 3.78Å; I390-Y436 HydrophobicContact CG1-CE2 4.39Å; I390-P482 HydrophobicContact CD1-CB 4.35Å; I390-P482 HydrophobicContact CD1-CG 3.59Å
391	S	92.8	Very high	93.5	Very high	45 Å²	45	27 Å²	27	32%	0.315	15%	0.152	S	C	.	.	H	α-helix	trans	-62	-35.7	178.8	-38.6	0	0	0	0	111.5	D366 N389 L395	D366-S391 WeakPolarHBondContact OD1-CA 3.15Å; D366-S391 WeakPolarHBondContact OD1-CB 3.39Å; D366-S391 PolarHBondContact OD1-OG 3.44Å; N389-S391 PolarHBondContact O-N 2.86Å; N389-S391 VanDerWaalsContact O-N 3.12Å; S391-L395 WeakPolarHBondContact O-CB 3.2Å; S391-L395 WeakPolarHBondContact O-CD1 3.22Å; S391-L395 WeakPolarHBondContact O-CG 3.15Å; S391-L395 PolarHBondContact O-N 3.24Å
392	S	93.9	Very high	93.7	Very high	30 Å²	30	23 Å²	23	21%	0.21	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-39.5	174.6	-51.1	0	0	0	0	110.9	N389 I390 F396 M432	N389-S392 WeakPolarHBondContact O-CA 3.22Å; N389-S392 VanDerWaalsContact O-CB 3.29Å; N389-S392 WeakPolarHBondContact O-CB 3.39Å; N389-S392 PolarHBondContact O-N 3Å; I390-S392 VanDerWaalsContact C-N 3.25Å; I390-S392 PolarHBondContact O-N 3.25Å; S392-F396 WeakPolarHBondContact O-CB 3.36Å; S392-F396 PolarHBondContact O-N 3.35Å; S392-M432 VanDerWaalsContact O-CE 3.3Å; S392-M432 WeakPolarHBondContact O-CE 3.22Å
393	I	94.1	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.1	-47.1	177.1	-63.9	176	0	0	0	109.6	L362 N389 I390 L395 F396 H397 M432 Y433 Y436	L362-I393 HydrophobicContact CD1-CG2 3.96Å; L362-I393 HydrophobicContact CD2-CG2 3.89Å; N389-I393 PolarHBondContact O-N 2.85Å; I390-I393 HydrophobicContact CD1-CB 4.5Å; I390-I393 CarbonylContact O-C 3.51Å; I390-I393 WeakPolarHBondContact O-CA 3.47Å; I390-I393 WeakPolarHBondContact O-CB 3.28Å; I390-I393 PolarHBondContact O-N 3.3Å; I393-L395 PolarHBondContact O-N 2.91Å; I393-F396 PolarHBondContact O-N 2.93Å; I393-H397 PolarHBondContact O-CD2 3.18Å; I393-H397 VanDerWaalsContact O-CD2 3.25Å; I393-H397 PolarHBondContact O-N 3.4Å; I393-M432 HydrophobicContact CG1-CE 3.96Å; I393-M432 HydrophobicContact CG1-CG 4.06Å; I393-M432 HydrophobicContact CG1-SD 4.26Å; I393-Y433 HydrophobicContact CD1-CD1 4.15Å; I393-Y433 HydrophobicContact CD1-CD2 4.35Å; I393-Y433 HydrophobicContact CD1-CE1 4.22Å; I393-Y433 HydrophobicContact CD1-CE2 4.43Å; I393-Y433 HydrophobicContact CD1-CG 4.24Å; I393-Y433 HydrophobicContact CG1-CE2 4.36Å; I393-Y433 HydrophobicContact CG2-CE1 4.07Å; I393-Y433 HydrophobicContact CG2-CE2 3.93Å; I393-Y433 WeakPolarHBondContact CG2-OH 3.29Å; I393-Y436 HydrophobicContact CD1-CD2 4.17Å; I393-Y436 HydrophobicContact CD1-CG 4.03Å
394	Y	95.7	Very high	93.9	Very high	21 Å²	21	27.5 Å²	27.5	8%	0.082	16%	0.155	C	C	.	.	H	α-helix	trans	-54.4	-53.6	175.2	177.2	-129.7	0	0	0	111.4	V359 L362 N363 D366 Q367 I390 F396 H397 D398	V359-Y394 HydrophobicContact CG1-CE2 4.01Å; L362-Y394 HydrophobicContact CB-CD2 3.66Å; L362-Y394 HydrophobicContact CB-CG 4.21Å; N363-Y394 HydrophobicContact CB-CD2 4.41Å; N363-Y394 HydrophobicContact CB-CE2 3.77Å; N363-Y394 PolarHBondContact ND2-OH 2.86Å; D366-Y394 HydrophobicContact CB-CD1 4.15Å; D366-Y394 HydrophobicContact CB-CG 4.41Å; D366-Y394 WeakPolarHBondContact OD2-CD1 3.31Å; Q367-Y394 HydrophobicContact CG-CD1 4.25Å; Q367-Y394 HydrophobicContact CG-CE1 3.64Å; I390-Y394 PolarHBondContact O-N 3.48Å; Y394-F396 VanDerWaalsContact C-N 3.33Å; Y394-F396 PolarHBondContact O-N 3.36Å; Y394-H397 PolarHBondContact O-N 2.9Å; Y394-D398 HydrophobicContact CD2-CB 3.95Å; Y394-D398 HydrophobicContact CE2-CB 3.52Å; Y394-D398 WeakPolarHBondContact CE2-OD1 3.42Å; Y394-D398 VanDerWaalsContact CZ-OD1 3.22Å; Y394-D398 WeakPolarHBondContact O-CB 3.46Å; Y394-D398 PolarHBondContact O-N 3.49Å; Y394-D398 VanDerWaalsContact OH-CG 3.31Å; Y394-D398 PolarHBondContact OH-OD1 2.93Å
395	L	94.1	Very high	94	Very high	47 Å²	47	23.9 Å²	23.9	25%	0.246	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-39.1	179.1	-68.7	167.6	0	0	0	113.2	S391 I393 Q399	S391-L395 WeakPolarHBondContact O-CB 3.2Å; S391-L395 WeakPolarHBondContact O-CD1 3.22Å; S391-L395 WeakPolarHBondContact O-CG 3.15Å; S391-L395 PolarHBondContact O-N 3.24Å; I393-L395 PolarHBondContact O-N 2.91Å; L395-Q399 HydrophobicContact CD2-CG 4.49Å; L395-Q399 VanDerWaalsContact CD2-NE2 3.34Å; L395-Q399 VanDerWaalsContact O-CB 3.26Å; L395-Q399 WeakPolarHBondContact O-CB 3.41Å; L395-Q399 WeakPolarHBondContact O-CG 3.39Å; L395-Q399 PolarHBondContact O-N 3.08Å
396	F	95.1	Very high	94.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-45.5	176.5	168.7	-117.8	0	0	0	112.4	F128 S392 I393 Y394 F400 L401 L426 F429 M430 M432	F128-F396 HydrophobicContact CE2-CB 4.34Å; S392-F396 WeakPolarHBondContact O-CB 3.36Å; S392-F396 PolarHBondContact O-N 3.35Å; I393-F396 PolarHBondContact O-N 2.93Å; Y394-F396 VanDerWaalsContact C-N 3.33Å; Y394-F396 PolarHBondContact O-N 3.36Å; F396-F400 HydrophobicContact CD2-CB 4.4Å; F396-F400 WeakPolarHBondContact O-CB 3.46Å; F396-F400 PolarHBondContact O-N 3.03Å; F396-L401 PolarHBondContact O-N 3.41Å; F396-L401 VanDerWaalsContact O-N 3.15Å; F396-L426 HydrophobicContact CE2-CB 4.08Å; F396-L426 HydrophobicContact CE2-CD2 4.21Å; F396-L426 HydrophobicContact CZ-CB 3.99Å; F396-L426 WeakPolarHBondContact CZ-O 3.19Å; F396-F429 HydrophobicContact CD2-CB 3.9Å; F396-F429 HydrophobicContact CD2-CG 4.27Å; F396-F429 HydrophobicContact CE1-CB 4.31Å; F396-F429 HydrophobicContact CE2-CB 3.55Å; F396-F429 HydrophobicContact CE2-CD2 4.13Å; F396-F429 AromaticContact CE2-CG 3.95Å; F396-F429 HydrophobicContact CE2-CG 3.95Å; F396-F429 HydrophobicContact CG-CB 4.42Å; F396-F429 HydrophobicContact CZ-CB 3.79Å; F396-M430 HydrophobicContact CE1-CG 4.07Å; F396-M430 HydrophobicContact CZ-CG 4.42Å; F396-M432 HydrophobicContact CB-CE 4.49Å; F396-M432 HydrophobicContact CB-SD 4.14Å; F396-M432 HydrophobicContact CD1-SD 4.05Å; F396-M432 HydrophobicContact CG-SD 4.23Å
397	H	95.3	Very high	94.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.168	C	C	.	.	I	π-helix	trans	-74.9	-41.8	-178.7	-76.4	-79.8	0	0	0	112.7	E355 Y358 V359 L362 I393 Y394 L402 Y433 Y489	E355-H397 IonicContact OE1-CE1 2.88Å; E355-H397 IonicContact OE1-CG 2.68Å; E355-H397 IonicContact OE1-ND1 2.66Å; E355-H397 PolarHBondContact OE1-ND1 2.98Å; Y358-H397 AromaticContact CE1-CG 3.92Å; Y358-H397 AromaticContact CE1-ND1 3.94Å; V359-H397 HydrophobicContact CG2-CB 3.86Å; L362-H397 HydrophobicContact CD1-CB 3.82Å; I393-H397 PolarHBondContact O-CD2 3.18Å; I393-H397 VanDerWaalsContact O-CD2 3.25Å; I393-H397 PolarHBondContact O-N 3.4Å; Y394-H397 PolarHBondContact O-N 2.9Å; H397-L402 VanDerWaalsContact O-CB 3.24Å; H397-L402 WeakPolarHBondContact O-CB 3.37Å; H397-L402 PolarHBondContact O-N 3.46Å; H397-Y433 PolarHBondContact CD2-OH 2.68Å; H397-Y433 VanDerWaalsContact CD2-OH 3.24Å; H397-Y433 AromaticContact NE2-CE2 3.62Å; H397-Y433 AromaticContact NE2-CZ 3.59Å; H397-Y433 PolarHBondContact NE2-OH 3.37Å; H397-Y489 AromaticContact CE1-CZ 3.93Å; H397-Y489 PolarHBondContact CE1-OH 2.73Å; H397-Y489 PolarHBondContact ND1-OH 3.39Å
398	D	95.5	Very high	94.2	Very high	52 Å²	52	32.2 Å²	32.2	28%	0.278	17%	0.172	S	C	.	.	I	π-helix	trans	-70.1	-42.6	-178.9	-173.8	95.3	0	0	0	113.2	V359 Y394 P403	V359-D398 HydrophobicContact CG1-CB 4.03Å; V359-D398 WeakPolarHBondContact CG1-OD1 3.49Å; Y394-D398 HydrophobicContact CD2-CB 3.95Å; Y394-D398 HydrophobicContact CE2-CB 3.52Å; Y394-D398 WeakPolarHBondContact CE2-OD1 3.42Å; Y394-D398 VanDerWaalsContact CZ-OD1 3.22Å; Y394-D398 WeakPolarHBondContact O-CB 3.46Å; Y394-D398 PolarHBondContact O-N 3.49Å; Y394-D398 VanDerWaalsContact OH-CG 3.31Å; Y394-D398 PolarHBondContact OH-OD1 2.93Å; D398-P403 VanDerWaalsContact O-CD 3.27Å; D398-P403 WeakPolarHBondContact O-CD 3.44Å; D398-P403 VanDerWaalsContact O-CG 3.24Å; D398-P403 WeakPolarHBondContact O-CG 3.3Å
399	Q	93.4	Very high	94.2	Very high	102 Å²	102	31.5 Å²	31.5	48%	0.477	17%	0.166	S	C	.	.	I	π-helix	trans	-101.3	-15.8	-170.5	-54.6	-173.9	-14	0	0	114.8	L395	L395-Q399 HydrophobicContact CD2-CG 4.49Å; L395-Q399 VanDerWaalsContact CD2-NE2 3.34Å; L395-Q399 VanDerWaalsContact O-CB 3.26Å; L395-Q399 WeakPolarHBondContact O-CB 3.41Å; L395-Q399 WeakPolarHBondContact O-CG 3.39Å; L395-Q399 PolarHBondContact O-N 3.08Å
400	F	94	Very high	94.1	Very high	21 Å²	21	35.6 Å²	35.6	9%	0.092	19%	0.192	C	C	.	.	I	π-helix	trans	-125.3	-59.2	-176.3	-55.6	-97.5	0	0	0	112.5	L124 R127 F396 E404 L426	L124-F400 HydrophobicContact CD2-CD1 4Å; L124-F400 HydrophobicContact CD2-CE1 4.48Å; L124-F400 HydrophobicContact CG-CD1 4.08Å; L124-F400 HydrophobicContact CG-CE1 4.12Å; R127-F400 HydrophobicContact CB-CE1 4.45Å; R127-F400 HydrophobicContact CB-CZ 4.28Å; F396-F400 HydrophobicContact CD2-CB 4.4Å; F396-F400 WeakPolarHBondContact O-CB 3.46Å; F396-F400 PolarHBondContact O-N 3.03Å; F400-E404 WeakPolarHBondContact O-CB 3.3Å; F400-E404 WeakPolarHBondContact O-CG 3.44Å; F400-E404 PolarHBondContact O-N 3.38Å; F400-L426 HydrophobicContact CB-CD2 4.49Å
401	L	93.6	Very high	93.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.224	C	C	.	.	I	π-helix	trans	-70.9	-52.2	-173	-174.2	60.3	0	0	0	113	F396 E404 L405 I422 L423 L426 M430 Y489	F396-L401 PolarHBondContact O-N 3.41Å; F396-L401 VanDerWaalsContact O-N 3.15Å; L401-E404 PolarHBondContact O-N 3.2Å; L401-L405 HydrophobicContact CD1-CD1 3.83Å; L401-L405 HydrophobicContact CD1-CG 4Å; L401-L405 HydrophobicContact CG-CD1 3.83Å; L401-L405 HydrophobicContact CG-CG 4.39Å; L401-L405 WeakPolarHBondContact O-CB 3.42Å; L401-L405 WeakPolarHBondContact O-CG 3.33Å; L401-L405 PolarHBondContact O-N 2.93Å; L401-I422 HydrophobicContact CD1-CG2 4.16Å; L401-L423 HydrophobicContact CD1-CD2 4.23Å; L401-L426 HydrophobicContact CB-CD1 4.19Å; L401-L426 HydrophobicContact CD1-CB 4.39Å; L401-L426 HydrophobicContact CD1-CD1 3.57Å; L401-L426 HydrophobicContact CG-CD1 4.49Å; L401-M430 HydrophobicContact CD2-CE 4.26Å; L401-Y489 HydrophobicContact CD2-CE1 4.33Å
402	L	95.2	Very high	93.8	Very high	25 Å²	25	40 Å²	40	13%	0.131	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-44.8	-178.9	175.5	60.8	0	0	0	112.9	L352 E355 E356 V359 H397 E404 K406	L352-L402 HydrophobicContact CD1-CD1 3.58Å; E355-L402 HydrophobicContact CB-CD1 4.29Å; E355-L402 HydrophobicContact CG-CB 4.02Å; E355-L402 HydrophobicContact CG-CD1 4.01Å; E356-L402 HydrophobicContact CG-CD1 3.63Å; E356-L402 HydrophobicContact CG-CD2 4.22Å; V359-L402 HydrophobicContact CB-CD2 4Å; V359-L402 HydrophobicContact CG1-CD2 4.09Å; V359-L402 HydrophobicContact CG2-CB 4.11Å; V359-L402 HydrophobicContact CG2-CD2 3.87Å; H397-L402 VanDerWaalsContact O-CB 3.24Å; H397-L402 WeakPolarHBondContact O-CB 3.37Å; H397-L402 PolarHBondContact O-N 3.46Å; L402-E404 PolarHBondContact O-N 3.02Å; L402-K406 WeakPolarHBondContact O-CB 3.23Å; L402-K406 PolarHBondContact O-N 2.95Å
403	P	95.9	Very high	93.6	Very high	53 Å²	53	40 Å²	40	34%	0.344	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-39.3	178.6	-25.8	37	0	0	0	114	D398 T407	D398-P403 VanDerWaalsContact O-CD 3.27Å; D398-P403 WeakPolarHBondContact O-CD 3.44Å; D398-P403 VanDerWaalsContact O-CG 3.24Å; D398-P403 WeakPolarHBondContact O-CG 3.3Å; P403-T407 WeakPolarHBondContact O-CB 3.36Å; P403-T407 PolarHBondContact O-N 3.47Å; P403-T407 PolarHBondContact O-OG1 2.98Å
404	E	94.9	Very high	93.1	Very high	51 Å²	51	49.5 Å²	49.5	24%	0.238	27%	0.265	C	S	.	.	H	α-helix	trans	-70	-45.2	178.5	-70.7	-172.6	-161.4	0	0	111.5	F400 L401 L402 K406 R408 I422 K425	F400-E404 WeakPolarHBondContact O-CB 3.3Å; F400-E404 WeakPolarHBondContact O-CG 3.44Å; F400-E404 PolarHBondContact O-N 3.38Å; L401-E404 PolarHBondContact O-N 3.2Å; L402-E404 PolarHBondContact O-N 3.02Å; E404-K406 PolarHBondContact O-N 2.66Å; E404-R408 WeakPolarHBondContact O-CB 3.49Å; E404-R408 PolarHBondContact O-N 2.83Å; E404-R408 VanDerWaalsContact O-N 3.11Å; E404-I422 HydrophobicContact CB-CD1 4.41Å; E404-I422 HydrophobicContact CB-CG1 4.47Å; E404-I422 HydrophobicContact CB-CG2 4.05Å; E404-K425 IonicContact OE1-NZ 2.71Å; E404-K425 PolarHBondContact OE1-NZ 3.5Å; E404-K425 IonicContact OE2-NZ 2.73Å; E404-K425 PolarHBondContact OE2-NZ 2.86Å
405	L	93.7	Very high	92.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-44.6	173.2	-72.6	176.1	0	0	0	111.7	L351 L352 E355 L401 R408 I409 I422	L351-L405 HydrophobicContact CD2-CD1 4.25Å; L351-L405 HydrophobicContact CD2-CD2 3.97Å; L351-L405 HydrophobicContact CG-CD1 4.17Å; L352-L405 HydrophobicContact CD1-CB 4.3Å; E355-L405 HydrophobicContact CG-CD1 4.34Å; L401-L405 HydrophobicContact CD1-CD1 3.83Å; L401-L405 HydrophobicContact CD1-CG 4Å; L401-L405 HydrophobicContact CG-CD1 3.83Å; L401-L405 HydrophobicContact CG-CG 4.39Å; L401-L405 WeakPolarHBondContact O-CB 3.42Å; L401-L405 WeakPolarHBondContact O-CG 3.33Å; L401-L405 PolarHBondContact O-N 2.93Å; L405-R408 PolarHBondContact O-N 2.7Å; L405-I409 HydrophobicContact CB-CD1 4.23Å; L405-I409 HydrophobicContact CD2-CD1 4.21Å; L405-I409 VanDerWaalsContact O-CB 3.29Å; L405-I409 WeakPolarHBondContact O-CB 3.22Å; L405-I409 WeakPolarHBondContact O-CD1 3.32Å; L405-I409 VanDerWaalsContact O-CG1 3.24Å; L405-I409 WeakPolarHBondContact O-CG1 3.48Å; L405-I409 PolarHBondContact O-N 2.9Å; L405-I422 HydrophobicContact CD2-CG2 4.11Å; L405-I422 HydrophobicContact CG-CG2 4.36Å
406	K	94.7	Very high	92.3	Very high	91 Å²	91	53.2 Å²	53.2	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-50.7	-177.5	-172	160.7	-174.6	157.7	0	111.7	L352 E356 L402 E404 R408 I409 T410	L352-K406 HydrophobicContact CD1-CB 3.87Å; L352-K406 HydrophobicContact CD1-CG 4.38Å; E356-K406 IonicContact OE1-NZ 2.78Å; E356-K406 PolarHBondContact OE1-NZ 2.88Å; L402-K406 WeakPolarHBondContact O-CB 3.23Å; L402-K406 PolarHBondContact O-N 2.95Å; E404-K406 PolarHBondContact O-N 2.66Å; K406-R408 VanDerWaalsContact C-N 3.31Å; K406-R408 PolarHBondContact O-N 3.38Å; K406-I409 PolarHBondContact O-N 3.29Å; K406-T410 HydrophobicContact CG-CG2 4.45Å; K406-T410 PolarHBondContact O-N 2.95Å; K406-T410 PolarHBondContact O-OG1 3.01Å
407	T	93.9	Very high	91.9	Very high	77 Å²	77	56.6 Å²	56.6	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-55.3	-47.9	176.9	-57.4	0	0	0	0	111	P403 G411 E412	P403-T407 WeakPolarHBondContact O-CB 3.36Å; P403-T407 PolarHBondContact O-N 3.47Å; P403-T407 PolarHBondContact O-OG1 2.98Å; T407-G411 WeakPolarHBondContact O-CA 3.39Å; T407-G411 PolarHBondContact O-N 3.42Å; T407-E412 HydrophobicContact CG2-CG 4.28Å; T407-E412 PolarHBondContact O-N 3.42Å; T407-E412 VanDerWaalsContact O-N 3.16Å
408	R	93.6	Very high	91.7	Very high	24 Å²	24	60.4 Å²	60.4	9%	0.091	33%	0.331	C	S	.	.	I	π-helix	trans	-60.7	-48.4	179.5	-178	60.5	57.4	75.9	-1.9	113	E404 L405 K406 E412 W413 N416 R418 D421 I422	E404-R408 WeakPolarHBondContact O-CB 3.49Å; E404-R408 PolarHBondContact O-N 2.83Å; E404-R408 VanDerWaalsContact O-N 3.11Å; L405-R408 PolarHBondContact O-N 2.7Å; K406-R408 VanDerWaalsContact C-N 3.31Å; K406-R408 PolarHBondContact O-N 3.38Å; R408-E412 IonicContact CZ-OE2 3.55Å; R408-E412 IonicContact NE-OE2 3.99Å; R408-E412 PolarHBondContact NE-OE2 3.38Å; R408-E412 IonicContact NH2-OE2 3.82Å; R408-E412 CarbonylContact O-C 3.53Å; R408-E412 PolarHBondContact O-N 3.29Å; R408-W413 WeakPolarHBondContact O-CA 3.4Å; R408-W413 PolarHBondContact O-N 3.06Å; R408-N416 WeakPolarHBondContact CD-O 3.46Å; R408-N416 PolarHBondContact NE-ND2 3.17Å; R408-N416 PolarHBondContact NH2-ND2 3.13Å; R408-R418 WeakPolarHBondContact CD-O 3.41Å; R408-R418 VanDerWaalsContact CG-O 3.27Å; R408-R418 WeakPolarHBondContact CG-O 3.35Å; R408-R418 PolarHBondContact NH1-O 3.22Å; R408-D421 IonicContact CZ-OD1 3.88Å; R408-D421 IonicContact CZ-OD2 2.87Å; R408-D421 IonicContact NH1-OD1 2.62Å; R408-D421 PolarHBondContact NH1-OD1 3.39Å; R408-D421 IonicContact NH1-OD2 2.64Å; R408-D421 PolarHBondContact NH1-OD2 3.14Å; R408-D421 IonicContact NH2-OD1 2.83Å; R408-D421 IonicContact NH2-OD2 2.63Å; R408-D421 PolarHBondContact NH2-OD2 3.43Å; R408-I422 HydrophobicContact CB-CD1 3.68Å; R408-I422 HydrophobicContact CG-CD1 3.88Å
409	I	91.8	Very high	91.6	Very high	8 Å²	8	58 Å²	58	4%	0.041	32%	0.319	C	S	.	.	I	π-helix	trans	-86.5	-25	-167.7	-63.7	162.5	0	0	0	112.6	L345 A348 K349 L352 L405 K406 W413 I419	L345-I409 HydrophobicContact CD1-CG2 4.45Å; A348-I409 HydrophobicContact CB-CD1 3.98Å; A348-I409 HydrophobicContact CB-CG1 4.11Å; A348-I409 HydrophobicContact CB-CG2 4.43Å; A348-I409 WeakPolarHBondContact O-CD1 3.17Å; K349-I409 HydrophobicContact CG-CG2 4.03Å; L352-I409 HydrophobicContact CB-CD1 4.04Å; L352-I409 HydrophobicContact CD2-CB 4.07Å; L352-I409 HydrophobicContact CD2-CG2 3.96Å; L405-I409 HydrophobicContact CB-CD1 4.23Å; L405-I409 HydrophobicContact CD2-CD1 4.21Å; L405-I409 VanDerWaalsContact O-CB 3.29Å; L405-I409 WeakPolarHBondContact O-CB 3.22Å; L405-I409 WeakPolarHBondContact O-CD1 3.32Å; L405-I409 VanDerWaalsContact O-CG1 3.24Å; L405-I409 WeakPolarHBondContact O-CG1 3.48Å; L405-I409 PolarHBondContact O-N 2.9Å; K406-I409 PolarHBondContact O-N 3.29Å; I409-W413 HydrophobicContact CG1-CE3 4.06Å; I409-W413 HydrophobicContact CG1-CZ3 4.04Å; I409-I419 HydrophobicContact CD1-CG2 4.21Å; I409-I419 HydrophobicContact CG1-CG2 4.31Å
410	T	91	Very high	91.5	Very high	98 Å²	98	53.2 Å²	53.2	60%	0.601	30%	0.296	S	S	*	.	I	π-helix	trans	-108.8	-11.6	178.6	74.7	0	0	0	0	114.8	L352 K406	L352-T410 HydrophobicContact CD2-CG2 3.78Å; K406-T410 HydrophobicContact CG-CG2 4.45Å; K406-T410 PolarHBondContact O-N 2.95Å; K406-T410 PolarHBondContact O-OG1 3.01Å
411	G	88	Confident	91.5	Very high	66 Å²	66	53.6 Å²	53.6	68%	0.68	30%	0.299	S	S	*	.	I	π-helix	trans	-127.2	-30.6	-176.9	0	0	0	0	0	115.6	T407	T407-G411 WeakPolarHBondContact O-CA 3.39Å; T407-G411 PolarHBondContact O-N 3.42Å
412	E	91.8	Very high	91.5	Very high	73 Å²	73	53.8 Å²	53.8	34%	0.341	30%	0.3	S	S	.	.	I	π-helix	trans	-113.3	-3.6	-174.1	-55.6	178.7	164.6	0	0	114.3	T407 R408 E414 S415 N416	T407-E412 HydrophobicContact CG2-CG 4.28Å; T407-E412 PolarHBondContact O-N 3.42Å; T407-E412 VanDerWaalsContact O-N 3.16Å; R408-E412 IonicContact CZ-OE2 3.55Å; R408-E412 IonicContact NE-OE2 3.99Å; R408-E412 PolarHBondContact NE-OE2 3.38Å; R408-E412 IonicContact NH2-OE2 3.82Å; R408-E412 CarbonylContact O-C 3.53Å; R408-E412 PolarHBondContact O-N 3.29Å; E412-E414 VanDerWaalsContact C-N 3.31Å; E412-E414 PolarHBondContact O-N 2.85Å; E412-E414 VanDerWaalsContact O-N 3.16Å; E412-S415 PolarHBondContact O-N 3.43Å; E412-S415 PolarHBondContact O-OG 3.41Å; E412-S415 VanDerWaalsContact O-OG 3.06Å; E412-N416 PolarHBondContact O-N 3.5Å
413	W	89.8	Confident	91.4	Very high	28 Å²	28	52.8 Å²	52.8	11%	0.106	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-38.4	-163.9	-170	-92.8	0	0	0	114.3	L345 A348 R408 I409 S415 N416 P417 I419	L345-W413 HydrophobicContact CB-CZ2 4.15Å; L345-W413 HydrophobicContact CD1-CD2 3.76Å; L345-W413 HydrophobicContact CD1-CE3 4.44Å; L345-W413 HydrophobicContact CD1-CG 3.81Å; L345-W413 HydrophobicContact CD1-CZ2 4.35Å; A348-W413 HydrophobicContact CB-CH2 3.59Å; A348-W413 HydrophobicContact CB-CZ2 4.39Å; A348-W413 HydrophobicContact CB-CZ3 3.71Å; R408-W413 WeakPolarHBondContact O-CA 3.4Å; R408-W413 PolarHBondContact O-N 3.06Å; I409-W413 HydrophobicContact CG1-CE3 4.06Å; I409-W413 HydrophobicContact CG1-CZ3 4.04Å; W413-S415 VanDerWaalsContact C-N 3.28Å; W413-S415 PolarHBondContact O-N 3.16Å; W413-N416 CarbonylContact O-C 3.58Å; W413-N416 PolarHBondContact O-N 2.95Å; W413-P417 HydrophobicContact CD2-CB 4.1Å; W413-P417 HydrophobicContact CG-CB 4.41Å; W413-P417 HydrophobicContact CZ2-CB 3.92Å; W413-P417 WeakPolarHBondContact O-CA 3.4Å; W413-P417 WeakPolarHBondContact O-CB 3.42Å; W413-P417 WeakPolarHBondContact O-CD 3.36Å; W413-P417 VanDerWaalsContact O-N 3.15Å; W413-I419 HydrophobicContact CH2-CG2 4.28Å; W413-I419 HydrophobicContact CZ3-CG2 3.77Å
414	E	85.2	Confident	91.3	Very high	200 Å²	200	52 Å²	52	94%	0.935	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.4	-179.5	-63.5	177.5	177.8	0	0	113	E412	E412-E414 VanDerWaalsContact C-N 3.31Å; E412-E414 PolarHBondContact O-N 2.85Å; E412-E414 VanDerWaalsContact O-N 3.16Å
415	S	86.2	Confident	91.3	Very high	106 Å²	106	53.2 Å²	53.2	74%	0.741	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-18.6	177	63.5	0	0	0	0	113.4	E412 W413	E412-S415 PolarHBondContact O-N 3.43Å; E412-S415 PolarHBondContact O-OG 3.41Å; E412-S415 VanDerWaalsContact O-OG 3.06Å; W413-S415 VanDerWaalsContact C-N 3.28Å; W413-S415 PolarHBondContact O-N 3.16Å
416	N	86.8	Confident	91.1	Very high	40 Å²	40	53.2 Å²	53.2	21%	0.214	29%	0.291	C	S	.	.			trans	-151.6	73.1	-175.4	-166.3	14.1	0	0	0	111.7	R408 E412 W413 R418	R408-N416 WeakPolarHBondContact CD-O 3.46Å; R408-N416 PolarHBondContact NE-ND2 3.17Å; R408-N416 PolarHBondContact NH2-ND2 3.13Å; E412-N416 PolarHBondContact O-N 3.5Å; W413-N416 CarbonylContact O-C 3.58Å; W413-N416 PolarHBondContact O-N 2.95Å; N416-R418 PolarHBondContact O-N 2.87Å; N416-R418 WeakPolarHBondContact OD1-CD 3.26Å; N416-R418 VanDerWaalsContact OD1-CG 3.28Å; N416-R418 WeakPolarHBondContact OD1-CG 3.4Å; N416-R418 PolarHBondContact OD1-NE 2.76Å
417	P	86.1	Confident	90.9	Very high	73 Å²	73	48.9 Å²	48.9	47%	0.474	27%	0.272	S	S	.	.			trans	-78.8	57	-172.3	32.1	-37.2	0	0	0	113.3	W413	W413-P417 HydrophobicContact CD2-CB 4.1Å; W413-P417 HydrophobicContact CG-CB 4.41Å; W413-P417 HydrophobicContact CZ2-CB 3.92Å; W413-P417 WeakPolarHBondContact O-CA 3.4Å; W413-P417 WeakPolarHBondContact O-CB 3.42Å; W413-P417 WeakPolarHBondContact O-CD 3.36Å; W413-P417 VanDerWaalsContact O-N 3.15Å
418	R	90.1	Very high	90.6	Very high	80 Å²	80	48 Å²	48	30%	0.302	27%	0.268	S	S	.	.			trans	-140.3	146.5	-168.1	94.7	-179.9	-176	-179.8	8.1	113.2	R408 N416 D421 D506	R408-R418 WeakPolarHBondContact CD-O 3.41Å; R408-R418 VanDerWaalsContact CG-O 3.27Å; R408-R418 WeakPolarHBondContact CG-O 3.35Å; R408-R418 PolarHBondContact NH1-O 3.22Å; N416-R418 PolarHBondContact O-N 2.87Å; N416-R418 WeakPolarHBondContact OD1-CD 3.26Å; N416-R418 VanDerWaalsContact OD1-CG 3.28Å; N416-R418 WeakPolarHBondContact OD1-CG 3.4Å; N416-R418 PolarHBondContact OD1-NE 2.76Å; R418-D421 IonicContact CZ-OD2 3.62Å; R418-D421 VanDerWaalsContact CZ-OD2 3.25Å; R418-D421 IonicContact NE-OD1 2.69Å; R418-D421 IonicContact NE-OD2 2.72Å; R418-D421 PolarHBondContact NE-OD2 3Å; R418-D421 IonicContact NH2-OD2 3.52Å; R418-D421 PolarHBondContact NH2-OD2 3.24Å; R418-D506 HydrophobicContact CB-CB 3.85Å; R418-D506 VanDerWaalsContact CB-CG 3.49Å
419	I	92.9	Very high	90.4	Very high	3 Å²	3	48.4 Å²	48.4	2%	0.015	27%	0.27	C	S	.	.			trans	-135	-16.1	-179.6	63.4	175.6	0	0	0	114.4	A348 L351 I409 W413 D421 I422 L423 Y496 D506	A348-I419 HydrophobicContact CB-CG2 4.27Å; L351-I419 HydrophobicContact CD2-CD1 3.9Å; I409-I419 HydrophobicContact CD1-CG2 4.21Å; I409-I419 HydrophobicContact CG1-CG2 4.31Å; W413-I419 HydrophobicContact CH2-CG2 4.28Å; W413-I419 HydrophobicContact CZ3-CG2 3.77Å; I419-D421 VanDerWaalsContact C-N 3.3Å; I419-D421 PolarHBondContact O-N 3.04Å; I419-I422 PolarHBondContact O-N 2.93Å; I419-L423 HydrophobicContact CD1-CD1 4.31Å; I419-L423 HydrophobicContact CG1-CD1 4.36Å; I419-L423 WeakPolarHBondContact O-CG 3.47Å; I419-L423 PolarHBondContact O-N 3.35Å; I419-Y496 HydrophobicContact CD1-CD1 4.25Å; I419-Y496 HydrophobicContact CD1-CD2 3.77Å; I419-Y496 HydrophobicContact CD1-CE1 4.27Å; I419-Y496 HydrophobicContact CD1-CE2 3.8Å; I419-Y496 HydrophobicContact CD1-CG 4.01Å; I419-Y496 HydrophobicContact CG1-CD1 4.16Å; I419-Y496 HydrophobicContact CG1-CD2 4.27Å; I419-Y496 HydrophobicContact CG1-CE1 3.77Å; I419-Y496 HydrophobicContact CG1-CE2 3.9Å; I419-Y496 HydrophobicContact CG1-CG 4.4Å; I419-D506 PolarHBondContact N-OD2 3.15Å
420	G	92.5	Very high	90.2	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-38.7	177.6	0	0	0	0	0	112.1	I422 L423 Q424 D506	G420-I422 PolarHBondContact O-N 3.16Å; G420-L423 PolarHBondContact O-N 3.06Å; G420-Q424 VanDerWaalsContact O-CB 3.23Å; G420-Q424 WeakPolarHBondContact O-CB 3.49Å; G420-Q424 PolarHBondContact O-N 3.15Å; G420-D506 VanDerWaalsContact CA-OD1 3.25Å; G420-D506 WeakPolarHBondContact CA-OD1 3.27Å; G420-D506 VanDerWaalsContact N-CG 3.25Å; G420-D506 PolarHBondContact N-OD1 3.29Å; G420-D506 PolarHBondContact N-OD2 2.9Å
421	D	93.4	Very high	89.9	Confident	29 Å²	29	49 Å²	49	16%	0.155	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-45.7	175.9	73.4	-29.1	0	0	0	113.2	R408 R418 I419 K425 D506	R408-D421 IonicContact CZ-OD1 3.88Å; R408-D421 IonicContact CZ-OD2 2.87Å; R408-D421 IonicContact NH1-OD1 2.62Å; R408-D421 PolarHBondContact NH1-OD1 3.39Å; R408-D421 IonicContact NH1-OD2 2.64Å; R408-D421 PolarHBondContact NH1-OD2 3.14Å; R408-D421 IonicContact NH2-OD1 2.83Å; R408-D421 IonicContact NH2-OD2 2.63Å; R408-D421 PolarHBondContact NH2-OD2 3.43Å; R418-D421 IonicContact CZ-OD2 3.62Å; R418-D421 VanDerWaalsContact CZ-OD2 3.25Å; R418-D421 IonicContact NE-OD1 2.69Å; R418-D421 IonicContact NE-OD2 2.72Å; R418-D421 PolarHBondContact NE-OD2 3Å; R418-D421 IonicContact NH2-OD2 3.52Å; R418-D421 PolarHBondContact NH2-OD2 3.24Å; I419-D421 VanDerWaalsContact C-N 3.3Å; I419-D421 PolarHBondContact O-N 3.04Å; D421-K425 VanDerWaalsContact O-CB 3.26Å; D421-K425 WeakPolarHBondContact O-CB 3.2Å; D421-K425 PolarHBondContact O-N 3.21Å; D421-K425 VanDerWaalsContact O-N 3.14Å; D421-D506 PolarHBondContact N-OD1 2.94Å
422	I	94	Very high	89.8	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-49.5	175.8	-66.6	164.5	0	0	0	109.9	L401 E404 L405 R408 I419 G420 Q424 K425 L426	L401-I422 HydrophobicContact CD1-CG2 4.16Å; E404-I422 HydrophobicContact CB-CD1 4.41Å; E404-I422 HydrophobicContact CB-CG1 4.47Å; E404-I422 HydrophobicContact CB-CG2 4.05Å; L405-I422 HydrophobicContact CD2-CG2 4.11Å; L405-I422 HydrophobicContact CG-CG2 4.36Å; R408-I422 HydrophobicContact CB-CD1 3.68Å; R408-I422 HydrophobicContact CG-CD1 3.88Å; I419-I422 PolarHBondContact O-N 2.93Å; G420-I422 PolarHBondContact O-N 3.16Å; I422-Q424 PolarHBondContact O-N 3Å; I422-K425 PolarHBondContact O-N 2.86Å; I422-L426 HydrophobicContact CG2-CD1 3.82Å; I422-L426 WeakPolarHBondContact O-CB 3.46Å; I422-L426 WeakPolarHBondContact O-CG 3.29Å; I422-L426 PolarHBondContact O-N 3.19Å; I422-L426 VanDerWaalsContact O-N 3.07Å
423	L	92.9	Very high	89.5	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-38.6	-177.8	-69.3	174.3	0	0	0	112	L351 L401 I419 G420 L426 A427 L493 A513	L351-L423 HydrophobicContact CD2-CD1 4.11Å; L351-L423 HydrophobicContact CD2-CD2 4.49Å; L401-L423 HydrophobicContact CD1-CD2 4.23Å; I419-L423 HydrophobicContact CD1-CD1 4.31Å; I419-L423 HydrophobicContact CG1-CD1 4.36Å; I419-L423 WeakPolarHBondContact O-CG 3.47Å; I419-L423 PolarHBondContact O-N 3.35Å; G420-L423 PolarHBondContact O-N 3.06Å; L423-L426 PolarHBondContact O-N 3.3Å; L423-A427 WeakPolarHBondContact O-CB 3.04Å; L423-A427 PolarHBondContact O-N 2.89Å; L423-L493 HydrophobicContact CD1-CD1 3.92Å; L423-L493 HydrophobicContact CD1-CD2 4.39Å; L423-A513 HydrophobicContact CB-CB 3.87Å
424	Q	94.3	Very high	89.2	Confident	36 Å²	36	42.3 Å²	42.3	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-44.8	176.7	-171.8	-164.1	121	0	0	111.5	G420 I422 L426 P428 D509 K512 A513 L516	G420-Q424 VanDerWaalsContact O-CB 3.23Å; G420-Q424 WeakPolarHBondContact O-CB 3.49Å; G420-Q424 PolarHBondContact O-N 3.15Å; I422-Q424 PolarHBondContact O-N 3Å; Q424-L426 VanDerWaalsContact C-N 3.27Å; Q424-L426 PolarHBondContact O-N 3.47Å; Q424-P428 WeakPolarHBondContact O-CD 3.35Å; Q424-D509 VanDerWaalsContact NE2-CA 3.31Å; Q424-D509 PolarHBondContact NE2-OD1 3.3Å; Q424-K512 HydrophobicContact CG-CB 4.39Å; Q424-K512 HydrophobicContact CG-CD 4.24Å; Q424-K512 HydrophobicContact CG-CG 4.06Å; Q424-A513 HydrophobicContact CB-CB 4.05Å; Q424-L516 HydrophobicContact CG-CD1 4.28Å
425	K	94.1	Very high	89.2	Confident	77 Å²	77	37.1 Å²	37.1	34%	0.335	20%	0.195	S	C	.	.	H	α-helix	trans	-61.5	-35.2	178.2	171.8	-173.3	156.8	-160.4	0	112.1	E404 D421 I422	E404-K425 IonicContact OE1-NZ 2.71Å; E404-K425 PolarHBondContact OE1-NZ 3.5Å; E404-K425 IonicContact OE2-NZ 2.73Å; E404-K425 PolarHBondContact OE2-NZ 2.86Å; D421-K425 VanDerWaalsContact O-CB 3.26Å; D421-K425 WeakPolarHBondContact O-CB 3.2Å; D421-K425 PolarHBondContact O-N 3.21Å; D421-K425 VanDerWaalsContact O-N 3.14Å; I422-K425 PolarHBondContact O-N 2.86Å
426	L	91	Very high	89.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-101.9	-21.8	-171.7	-60.7	178.6	0	0	0	114.1	L124 F396 F400 L401 I422 L423 Q424 P428 F429	L124-L426 HydrophobicContact CD2-CD2 3.72Å; F396-L426 HydrophobicContact CE2-CB 4.08Å; F396-L426 HydrophobicContact CE2-CD2 4.21Å; F396-L426 HydrophobicContact CZ-CB 3.99Å; F396-L426 WeakPolarHBondContact CZ-O 3.19Å; F400-L426 HydrophobicContact CB-CD2 4.49Å; L401-L426 HydrophobicContact CB-CD1 4.19Å; L401-L426 HydrophobicContact CD1-CB 4.39Å; L401-L426 HydrophobicContact CD1-CD1 3.57Å; L401-L426 HydrophobicContact CG-CD1 4.49Å; I422-L426 HydrophobicContact CG2-CD1 3.82Å; I422-L426 WeakPolarHBondContact O-CB 3.46Å; I422-L426 WeakPolarHBondContact O-CG 3.29Å; I422-L426 PolarHBondContact O-N 3.19Å; I422-L426 VanDerWaalsContact O-N 3.07Å; L423-L426 PolarHBondContact O-N 3.3Å; Q424-L426 VanDerWaalsContact C-N 3.27Å; Q424-L426 PolarHBondContact O-N 3.47Å; L426-P428 VanDerWaalsContact C-N 3.35Å; L426-F429 WeakPolarHBondContact O-CB 3.12Å; L426-F429 PolarHBondContact O-N 3.2Å; L426-F429 VanDerWaalsContact O-N 3.12Å
427	A	88.6	Confident	89	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53	-36.3	175.5	0	0	0	0	0	115.4	L423 F429 M430 L516 I517	L423-A427 WeakPolarHBondContact O-CB 3.04Å; L423-A427 PolarHBondContact O-N 2.89Å; A427-F429 PolarHBondContact O-N 3Å; A427-F429 VanDerWaalsContact O-N 3.15Å; A427-M430 WeakPolarHBondContact O-CB 3.06Å; A427-M430 PolarHBondContact O-N 3.48Å; A427-L516 HydrophobicContact CB-CB 3.69Å; A427-L516 HydrophobicContact CB-CD1 4.3Å; A427-I517 HydrophobicContact CB-CD1 4.35Å; A427-I517 HydrophobicContact CB-CG1 3.77Å
428	P	88.9	Confident	88.8	Confident	58 Å²	58	36 Å²	36	38%	0.377	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-57.2	-30	176.7	-28.6	36.8	0	0	0	114.3	Q424 L426 K431 L516	Q424-P428 WeakPolarHBondContact O-CD 3.35Å; L426-P428 VanDerWaalsContact C-N 3.35Å; P428-K431 WeakPolarHBondContact O-CG 3.22Å; P428-L516 HydrophobicContact CG-CD1 4.24Å
429	F	89	Confident	88.7	Confident	32 Å²	32	34.8 Å²	34.8	14%	0.14	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-73.3	-28.8	178.1	-63.4	-91.5	0	0	0	112	L124 I125 F128 F396 L426 A427 K431 M432	L124-F429 HydrophobicContact CB-CZ 4.49Å; L124-F429 HydrophobicContact CD2-CE2 4.4Å; L124-F429 HydrophobicContact CD2-CZ 4.48Å; I125-F429 HydrophobicContact CG1-CZ 4.29Å; F128-F429 HydrophobicContact CB-CE1 4.12Å; F128-F429 HydrophobicContact CD1-CD1 4.05Å; F128-F429 HydrophobicContact CD1-CE1 4Å; F128-F429 HydrophobicContact CD2-CD1 4.29Å; F128-F429 HydrophobicContact CD2-CE1 4.49Å; F128-F429 HydrophobicContact CE1-CD1 4.18Å; F128-F429 HydrophobicContact CE2-CD1 4.43Å; F128-F429 HydrophobicContact CG-CD1 4.1Å; F128-F429 AromaticContact CG-CE1 3.95Å; F128-F429 HydrophobicContact CG-CE1 3.95Å; F128-F429 HydrophobicContact CZ-CD1 4.37Å; F396-F429 HydrophobicContact CD2-CB 3.9Å; F396-F429 HydrophobicContact CD2-CG 4.27Å; F396-F429 HydrophobicContact CE1-CB 4.31Å; F396-F429 HydrophobicContact CE2-CB 3.55Å; F396-F429 HydrophobicContact CE2-CD2 4.13Å; F396-F429 AromaticContact CE2-CG 3.95Å; F396-F429 HydrophobicContact CE2-CG 3.95Å; F396-F429 HydrophobicContact CG-CB 4.42Å; F396-F429 HydrophobicContact CZ-CB 3.79Å; L426-F429 WeakPolarHBondContact O-CB 3.12Å; L426-F429 PolarHBondContact O-N 3.2Å; L426-F429 VanDerWaalsContact O-N 3.12Å; A427-F429 PolarHBondContact O-N 3Å; A427-F429 VanDerWaalsContact O-N 3.15Å; F429-K431 PolarHBondContact O-N 2.81Å; F429-M432 WeakPolarHBondContact O-CB 3.28Å; F429-M432 WeakPolarHBondContact O-CG 3.43Å; F429-M432 PolarHBondContact O-N 3.31Å; F429-M432 VanDerWaalsContact O-SD 3.38Å
430	M	87.6	Confident	88.2	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-59.7	-15.3	178.8	-60.2	-173.6	-174.5	0	0	113.6	F396 L401 A427 M432 Y433 I486 Y489 I517 A520	F396-M430 HydrophobicContact CE1-CG 4.07Å; F396-M430 HydrophobicContact CZ-CG 4.42Å; L401-M430 HydrophobicContact CD2-CE 4.26Å; A427-M430 WeakPolarHBondContact O-CB 3.06Å; A427-M430 PolarHBondContact O-N 3.48Å; M430-M432 PolarHBondContact O-N 3.43Å; M430-M432 VanDerWaalsContact O-N 3.09Å; M430-Y433 HydrophobicContact CB-CD2 4.45Å; M430-Y433 WeakPolarHBondContact O-CB 3.27Å; M430-Y433 VanDerWaalsContact O-CD2 3.31Å; M430-Y433 WeakPolarHBondContact O-CD2 3.45Å; M430-Y433 PolarHBondContact O-N 2.95Å; M430-I486 HydrophobicContact CB-CD1 4.01Å; M430-I486 HydrophobicContact CG-CD1 4.2Å; M430-I486 HydrophobicContact SD-CD1 3.9Å; M430-Y489 HydrophobicContact CE-CD2 3.68Å; M430-Y489 HydrophobicContact CE-CE2 3.63Å; M430-Y489 HydrophobicContact CE-CG 4.29Å; M430-Y489 HydrophobicContact SD-CD2 3.7Å; M430-Y489 HydrophobicContact SD-CE2 3.95Å; M430-I517 HydrophobicContact SD-CD1 4.49Å; M430-I517 HydrophobicContact SD-CG1 3.92Å; M430-A520 HydrophobicContact CB-CB 4.37Å
431	K	84.2	Confident	87.6	Confident	117 Å²	117	38.8 Å²	38.8	51%	0.509	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-55.8	-22.9	169.2	-66.2	-179.7	178.8	-179.3	0	113.2	P428 F429 Y433 G434 A520	P428-K431 WeakPolarHBondContact O-CG 3.22Å; F429-K431 PolarHBondContact O-N 2.81Å; K431-Y433 PolarHBondContact O-N 2.98Å; K431-G434 PolarHBondContact O-N 3.44Å; K431-G434 VanDerWaalsContact O-N 3.12Å; K431-A520 HydrophobicContact CG-CB 4.38Å
432	M	86.5	Confident	87.3	Confident	13 Å²	13	45.5 Å²	45.5	6%	0.064	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.5	-25.1	173.1	71.9	-161.6	-57.9	0	0	114.1	F128 N389 S392 I393 F396 F429 M430 G434 E435	F128-M432 HydrophobicContact CE2-CE 4.09Å; F128-M432 HydrophobicContact CZ-CE 3.77Å; F128-M432 HydrophobicContact CZ-SD 4.38Å; N389-M432 PolarHBondContact ND2-O 2.87Å; S392-M432 VanDerWaalsContact O-CE 3.3Å; S392-M432 WeakPolarHBondContact O-CE 3.22Å; I393-M432 HydrophobicContact CG1-CE 3.96Å; I393-M432 HydrophobicContact CG1-CG 4.06Å; I393-M432 HydrophobicContact CG1-SD 4.26Å; F396-M432 HydrophobicContact CB-CE 4.49Å; F396-M432 HydrophobicContact CB-SD 4.14Å; F396-M432 HydrophobicContact CD1-SD 4.05Å; F396-M432 HydrophobicContact CG-SD 4.23Å; F429-M432 WeakPolarHBondContact O-CB 3.28Å; F429-M432 WeakPolarHBondContact O-CG 3.43Å; F429-M432 PolarHBondContact O-N 3.31Å; F429-M432 VanDerWaalsContact O-SD 3.38Å; M430-M432 PolarHBondContact O-N 3.43Å; M430-M432 VanDerWaalsContact O-N 3.09Å; M432-G434 PolarHBondContact O-N 3.15Å; M432-E435 PolarHBondContact O-N 2.94Å
433	Y	86.3	Confident	87.1	Confident	3 Å²	3	45.3 Å²	45.3	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-64.7	-27.1	176.3	-77.7	-108	0	0	0	111.9	Y358 I393 H397 M430 K431 E435 Y436 V437 P482 I486	Y358-Y433 WeakPolarHBondContact CE1-OH 3.48Å; Y358-Y433 WeakPolarHBondContact OH-CE1 3.46Å; Y358-Y433 PolarHBondContact OH-OH 3.05Å; I393-Y433 HydrophobicContact CD1-CD1 4.15Å; I393-Y433 HydrophobicContact CD1-CD2 4.35Å; I393-Y433 HydrophobicContact CD1-CE1 4.22Å; I393-Y433 HydrophobicContact CD1-CE2 4.43Å; I393-Y433 HydrophobicContact CD1-CG 4.24Å; I393-Y433 HydrophobicContact CG1-CE2 4.36Å; I393-Y433 HydrophobicContact CG2-CE1 4.07Å; I393-Y433 HydrophobicContact CG2-CE2 3.93Å; I393-Y433 WeakPolarHBondContact CG2-OH 3.29Å; H397-Y433 PolarHBondContact CD2-OH 2.68Å; H397-Y433 VanDerWaalsContact CD2-OH 3.24Å; H397-Y433 AromaticContact NE2-CE2 3.62Å; H397-Y433 AromaticContact NE2-CZ 3.59Å; H397-Y433 PolarHBondContact NE2-OH 3.37Å; M430-Y433 HydrophobicContact CB-CD2 4.45Å; M430-Y433 WeakPolarHBondContact O-CB 3.27Å; M430-Y433 VanDerWaalsContact O-CD2 3.31Å; M430-Y433 WeakPolarHBondContact O-CD2 3.45Å; M430-Y433 PolarHBondContact O-N 2.95Å; K431-Y433 PolarHBondContact O-N 2.98Å; Y433-E435 PolarHBondContact O-N 3.13Å; Y433-Y436 WeakPolarHBondContact O-CB 3.36Å; Y433-Y436 PolarHBondContact O-N 3.41Å; Y433-Y436 VanDerWaalsContact O-N 3.15Å; Y433-V437 VanDerWaalsContact O-CB 3.23Å; Y433-V437 WeakPolarHBondContact O-CB 3.43Å; Y433-V437 VanDerWaalsContact O-CG2 3.22Å; Y433-V437 WeakPolarHBondContact O-CG2 3.29Å; Y433-V437 PolarHBondContact O-N 2.57Å; Y433-P482 HydrophobicContact CD1-CB 4.3Å; Y433-P482 WeakPolarHBondContact CD1-O 3.31Å; Y433-P482 HydrophobicContact CE1-CB 3.84Å; Y433-P482 WeakPolarHBondContact CE1-O 3.3Å; Y433-I486 HydrophobicContact CD1-CD1 4.04Å; Y433-I486 HydrophobicContact CD1-CG1 3.69Å; Y433-I486 HydrophobicContact CD2-CD1 3.81Å; Y433-I486 HydrophobicContact CD2-CG1 4.23Å; Y433-I486 HydrophobicContact CE1-CD1 4.06Å; Y433-I486 HydrophobicContact CE1-CG1 4.04Å; Y433-I486 HydrophobicContact CE2-CD1 3.83Å; Y433-I486 HydrophobicContact CG-CD1 3.89Å; Y433-I486 HydrophobicContact CG-CG1 3.77Å
434	G	82.3	Confident	86.6	Confident	11 Å²	11	45.4 Å²	45.4	11%	0.113	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-29.3	175	0	0	0	0	0	113.4	K431 M432 K438	K431-G434 PolarHBondContact O-N 3.44Å; K431-G434 VanDerWaalsContact O-N 3.12Å; M432-G434 PolarHBondContact O-N 3.15Å; G434-K438 WeakPolarHBondContact O-CB 3.38Å; G434-K438 PolarHBondContact O-N 2.93Å
435	E	85.3	Confident	86.1	Confident	92 Å²	92	48.6 Å²	48.6	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-77.9	-40.8	173.8	169.7	176.7	-131.8	0	0	112.1	S388 N389 M432 Y433 N439	S388-E435 PolarHBondContact OG-O 2.77Å; N389-E435 HydrophobicContact CB-CG 4.45Å; N389-E435 WeakPolarHBondContact ND2-CB 3.44Å; N389-E435 WeakPolarHBondContact ND2-CG 3.23Å; N389-E435 PolarHBondContact ND2-OE2 3.32Å; M432-E435 PolarHBondContact O-N 2.94Å; Y433-E435 PolarHBondContact O-N 3.13Å; E435-N439 PolarHBondContact O-N 3.38Å; E435-N439 PolarHBondContact O-ND2 3.49Å
436	Y	87.6	Confident	85.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-56.6	-53.9	171.8	-170.1	-101.5	0	0	0	110.7	N389 I390 I393 Y433 K438 N439 F440 M479 P482 V483	N389-Y436 VanDerWaalsContact OD1-CB 3.31Å; N389-Y436 WeakPolarHBondContact OD1-CB 3.45Å; N389-Y436 PolarHBondContact OD1-N 2.79Å; I390-Y436 HydrophobicContact CB-CE2 4.06Å; I390-Y436 HydrophobicContact CD1-CD2 4.31Å; I390-Y436 HydrophobicContact CD1-CE2 3.78Å; I390-Y436 HydrophobicContact CG1-CE2 4.39Å; I393-Y436 HydrophobicContact CD1-CD2 4.17Å; I393-Y436 HydrophobicContact CD1-CG 4.03Å; Y433-Y436 WeakPolarHBondContact O-CB 3.36Å; Y433-Y436 PolarHBondContact O-N 3.41Å; Y433-Y436 VanDerWaalsContact O-N 3.15Å; Y436-K438 PolarHBondContact O-N 3.07Å; Y436-N439 PolarHBondContact O-N 3.45Å; Y436-F440 AromaticContact CE1-CD2 3.95Å; Y436-F440 HydrophobicContact CE1-CD2 3.95Å; Y436-F440 HydrophobicContact CE1-CE2 4.43Å; Y436-F440 PolarHBondContact O-N 3.39Å; Y436-F440 VanDerWaalsContact O-N 3.08Å; Y436-M479 PolarHBondContact OH-O 2.96Å; Y436-P482 HydrophobicContact CD1-CB 4.19Å; Y436-P482 HydrophobicContact CE1-CB 4Å; Y436-P482 HydrophobicContact CE1-CG 4.11Å; Y436-V483 HydrophobicContact CD1-CG2 4.25Å; Y436-V483 HydrophobicContact CE1-CG2 4.15Å
437	V	81.8	Confident	85.8	Confident	17 Å²	17	46.4 Å²	46.4	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-45	-178.4	165.6	0	0	0	0	112.1	Y433 N439 F440 V483 A527	Y433-V437 VanDerWaalsContact O-CB 3.23Å; Y433-V437 WeakPolarHBondContact O-CB 3.43Å; Y433-V437 VanDerWaalsContact O-CG2 3.22Å; Y433-V437 WeakPolarHBondContact O-CG2 3.29Å; Y433-V437 PolarHBondContact O-N 2.57Å; V437-N439 PolarHBondContact O-N 3.06Å; V437-F440 VanDerWaalsContact O-CB 3.32Å; V437-F440 WeakPolarHBondContact O-CB 3.44Å; V437-F440 PolarHBondContact O-N 3Å; V437-V483 HydrophobicContact CG2-CG1 4.18Å; V437-V483 HydrophobicContact CG2-CG2 4.3Å; V437-A527 HydrophobicContact CG1-CB 3.28Å
438	K	82.6	Confident	85.5	Confident	176 Å²	176	49 Å²	49	77%	0.765	24%	0.236	S	C	*	.	H	α-helix	trans	-60.1	-33.9	178.2	177.6	-180	177.2	-176.6	0	112.9	G434 Y436	G434-K438 WeakPolarHBondContact O-CB 3.38Å; G434-K438 PolarHBondContact O-N 2.93Å; Y436-K438 PolarHBondContact O-N 3.07Å
439	N	86.4	Confident	85.4	Confident	55 Å²	55	48.3 Å²	48.3	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-89.1	-15.8	-178.7	-67.5	-24.2	0	0	0	113.2	S388 E435 Y436 V437 D441 R442 S443	S388-N439 PolarHBondContact OG-ND2 2.68Å; E435-N439 PolarHBondContact O-N 3.38Å; E435-N439 PolarHBondContact O-ND2 3.49Å; Y436-N439 PolarHBondContact O-N 3.45Å; V437-N439 PolarHBondContact O-N 3.06Å; N439-D441 VanDerWaalsContact C-N 3.33Å; N439-D441 PolarHBondContact O-N 3.11Å; N439-D441 VanDerWaalsContact O-N 3.15Å; N439-R442 WeakPolarHBondContact O-CB 3.2Å; N439-R442 PolarHBondContact O-N 3.28Å; N439-S443 PolarHBondContact O-N 3.33Å; N439-S443 PolarHBondContact O-OG 3.29Å
440	F	83.8	Confident	85.4	Confident	15 Å²	15	49.8 Å²	49.8	7%	0.066	24%	0.235	C	C	.	.	H	α-helix	trans	-51.5	-42.5	-168.2	-173.4	-96.5	0	0	0	115	Y436 V437 S443 M444 M479 L480 V483	Y436-F440 AromaticContact CE1-CD2 3.95Å; Y436-F440 HydrophobicContact CE1-CD2 3.95Å; Y436-F440 HydrophobicContact CE1-CE2 4.43Å; Y436-F440 PolarHBondContact O-N 3.39Å; Y436-F440 VanDerWaalsContact O-N 3.08Å; V437-F440 VanDerWaalsContact O-CB 3.32Å; V437-F440 WeakPolarHBondContact O-CB 3.44Å; V437-F440 PolarHBondContact O-N 3Å; F440-S443 WeakPolarHBondContact O-CA 3.48Å; F440-S443 VanDerWaalsContact O-CB 3.3Å; F440-S443 WeakPolarHBondContact O-CB 3.43Å; F440-S443 PolarHBondContact O-N 3Å; F440-S443 VanDerWaalsContact O-N 3.14Å; F440-M444 HydrophobicContact CD1-CG 4.06Å; F440-M444 HydrophobicContact CE1-CE 4.3Å; F440-M444 HydrophobicContact CE1-CG 3.58Å; F440-M444 HydrophobicContact CE1-SD 4.04Å; F440-M444 HydrophobicContact CE2-CE 3.74Å; F440-M444 HydrophobicContact CE2-SD 4.48Å; F440-M444 HydrophobicContact CZ-CE 3.61Å; F440-M444 HydrophobicContact CZ-CG 3.87Å; F440-M444 HydrophobicContact CZ-SD 3.75Å; F440-M444 WeakPolarHBondContact O-CG 3.49Å; F440-M444 PolarHBondContact O-N 3.35Å; F440-M479 HydrophobicContact CE2-CB 4.02Å; F440-M479 VanDerWaalsContact CE2-O 3.3Å; F440-M479 WeakPolarHBondContact CE2-O 3.43Å; F440-L480 HydrophobicContact CE1-CD2 3.89Å; F440-L480 HydrophobicContact CE2-CD2 4.37Å; F440-L480 HydrophobicContact CZ-CD2 3.47Å; F440-L480 VanDerWaalsContact CZ-CD2 3.47Å; F440-L480 HydrophobicContact CZ-CG 4.04Å; F440-V483 HydrophobicContact CD2-CG2 4.29Å; F440-V483 HydrophobicContact CE2-CG2 4.44Å
441	D	79.1	Confident	85.4	Confident	72 Å²	72	51.6 Å²	51.6	39%	0.385	25%	0.247	S	C	.	.	H	α-helix	trans	-64.5	-44.8	-179.8	-82.1	9.9	0	0	0	112	N439 S443 M444 D445 K530	N439-D441 VanDerWaalsContact C-N 3.33Å; N439-D441 PolarHBondContact O-N 3.11Å; N439-D441 VanDerWaalsContact O-N 3.15Å; D441-S443 VanDerWaalsContact C-N 3.26Å; D441-S443 PolarHBondContact O-N 3.12Å; D441-M444 PolarHBondContact O-N 3Å; D441-D445 PolarHBondContact O-N 3.37Å; D441-K530 IonicContact OD1-NZ 2.74Å; D441-K530 PolarHBondContact OD1-NZ 3.02Å; D441-K530 IonicContact OD2-NZ 2.6Å; D441-K530 PolarHBondContact OD2-NZ 2.69Å
442	R	87	Confident	85.4	Confident	170 Å²	170	54.1 Å²	54.1	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-62.5	-35.9	172.6	176.3	180	173.5	-174.9	-3.3	111.2	N439 D445 L446	N439-R442 WeakPolarHBondContact O-CB 3.2Å; N439-R442 PolarHBondContact O-N 3.28Å; R442-D445 PolarHBondContact O-N 2.91Å; R442-L446 HydrophobicContact CG-CD1 4.15Å; R442-L446 WeakPolarHBondContact O-CB 3.38Å; R442-L446 VanDerWaalsContact O-CG 3.32Å; R442-L446 WeakPolarHBondContact O-CG 3.38Å; R442-L446 PolarHBondContact O-N 3.08Å
443	S	89.4	Confident	85.6	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.007	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-43.9	176.6	-57.1	0	0	0	0	112.1	G385 I386 N439 F440 D441 L446 V447	G385-S443 WeakPolarHBondContact O-CA 3.49Å; G385-S443 WeakPolarHBondContact O-CB 3.48Å; G385-S443 PolarHBondContact O-OG 3.49Å; I386-S443 WeakPolarHBondContact O-CB 3.32Å; I386-S443 PolarHBondContact O-OG 3Å; N439-S443 PolarHBondContact O-N 3.33Å; N439-S443 PolarHBondContact O-OG 3.29Å; F440-S443 WeakPolarHBondContact O-CA 3.48Å; F440-S443 VanDerWaalsContact O-CB 3.3Å; F440-S443 WeakPolarHBondContact O-CB 3.43Å; F440-S443 PolarHBondContact O-N 3Å; F440-S443 VanDerWaalsContact O-N 3.14Å; D441-S443 VanDerWaalsContact C-N 3.26Å; D441-S443 PolarHBondContact O-N 3.12Å; S443-L446 PolarHBondContact O-N 2.86Å; S443-V447 WeakPolarHBondContact O-CG2 3.43Å; S443-V447 PolarHBondContact O-N 2.89Å
444	M	82.6	Confident	85.9	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-46.7	172.9	-68.3	-65.1	101.5	0	0	111.9	F440 D441 L446 V447 N448 Q476 M479 P553	F440-M444 HydrophobicContact CD1-CG 4.06Å; F440-M444 HydrophobicContact CE1-CE 4.3Å; F440-M444 HydrophobicContact CE1-CG 3.58Å; F440-M444 HydrophobicContact CE1-SD 4.04Å; F440-M444 HydrophobicContact CE2-CE 3.74Å; F440-M444 HydrophobicContact CE2-SD 4.48Å; F440-M444 HydrophobicContact CZ-CE 3.61Å; F440-M444 HydrophobicContact CZ-CG 3.87Å; F440-M444 HydrophobicContact CZ-SD 3.75Å; F440-M444 WeakPolarHBondContact O-CG 3.49Å; F440-M444 PolarHBondContact O-N 3.35Å; D441-M444 PolarHBondContact O-N 3Å; M444-L446 VanDerWaalsContact C-N 3.31Å; M444-L446 PolarHBondContact O-N 2.96Å; M444-V447 PolarHBondContact O-N 3.02Å; M444-N448 WeakPolarHBondContact O-CB 3.13Å; M444-N448 VanDerWaalsContact O-CG 3.27Å; M444-N448 PolarHBondContact O-N 2.99Å; M444-N448 PolarHBondContact O-ND2 2.8Å; M444-Q476 HydrophobicContact CE-CB 4.43Å; M444-Q476 HydrophobicContact CE-CG 4.43Å; M444-Q476 HydrophobicContact SD-CB 3.94Å; M444-Q476 HydrophobicContact SD-CG 3.91Å; M444-M479 HydrophobicContact CE-CB 3.83Å; M444-M479 HydrophobicContact CE-CE 3.45Å; M444-M479 VanDerWaalsContact CE-CE 3.45Å; M444-M479 HydrophobicContact CE-CG 4.36Å; M444-M479 HydrophobicContact CE-SD 3.61Å; M444-P553 HydrophobicContact CG-CG 4.26Å; M444-P553 HydrophobicContact SD-CG 4.13Å
445	D	83.1	Confident	86.4	Confident	103 Å²	103	68.7 Å²	68.7	55%	0.551	33%	0.33	S	S	*	.	H	α-helix	trans	-64.3	-34.9	178.8	-75.2	-21.8	0	0	0	112.6	D441 R442 T449	D441-D445 PolarHBondContact O-N 3.37Å; R442-D445 PolarHBondContact O-N 2.91Å; D445-T449 WeakPolarHBondContact O-CB 3.31Å; D445-T449 PolarHBondContact O-N 2.84Å; D445-T449 PolarHBondContact O-OG1 2.91Å
446	L	90.6	Very high	86.8	Confident	32 Å²	32	69 Å²	69	17%	0.168	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-47.3	171.9	-77.3	169.6	0	0	0	111.8	G385 I386 R442 S443 M444 N448 T449 W450	G385-L446 VanDerWaalsContact C-CD1 3.5Å; I386-L446 HydrophobicContact CD1-CB 4.23Å; I386-L446 HydrophobicContact CG1-CB 3.58Å; I386-L446 HydrophobicContact CG1-CD1 4.42Å; R442-L446 HydrophobicContact CG-CD1 4.15Å; R442-L446 WeakPolarHBondContact O-CB 3.38Å; R442-L446 VanDerWaalsContact O-CG 3.32Å; R442-L446 WeakPolarHBondContact O-CG 3.38Å; R442-L446 PolarHBondContact O-N 3.08Å; S443-L446 PolarHBondContact O-N 2.86Å; M444-L446 VanDerWaalsContact C-N 3.31Å; M444-L446 PolarHBondContact O-N 2.96Å; L446-N448 VanDerWaalsContact C-N 3.32Å; L446-N448 PolarHBondContact O-N 3.47Å; L446-T449 PolarHBondContact O-N 3.21Å; L446-W450 WeakPolarHBondContact O-CB 3.47Å; L446-W450 VanDerWaalsContact O-CD1 3.32Å; L446-W450 PolarHBondContact O-N 3.19Å
447	V	88.4	Confident	87.1	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.3	-46.5	175.7	174.3	0	0	0	0	110.6	I386 S443 M444 T451 F457 L475 Q476 M479	I386-V447 HydrophobicContact CB-CG2 4.35Å; I386-V447 HydrophobicContact CD1-CG2 4.03Å; I386-V447 HydrophobicContact CG1-CG2 3.95Å; I386-V447 HydrophobicContact CG2-CG2 3.54Å; S443-V447 WeakPolarHBondContact O-CG2 3.43Å; S443-V447 PolarHBondContact O-N 2.89Å; M444-V447 PolarHBondContact O-N 3.02Å; V447-T451 VanDerWaalsContact O-CB 3.22Å; V447-T451 WeakPolarHBondContact O-CB 3.34Å; V447-T451 PolarHBondContact O-N 2.95Å; V447-T451 PolarHBondContact O-OG1 3.24Å; V447-F457 HydrophobicContact CG1-CE1 4.36Å; V447-F457 HydrophobicContact CG1-CZ 4.45Å; V447-L475 HydrophobicContact CG1-CD2 4.22Å; V447-L475 HydrophobicContact CG2-CD2 4.2Å; V447-Q476 HydrophobicContact CG1-CG 4.13Å; V447-M479 HydrophobicContact CG2-CE 4.49Å; V447-M479 HydrophobicContact CG2-SD 4.09Å
448	N	82.5	Confident	87.6	Confident	54 Å²	54	72.2 Å²	72.2	29%	0.289	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-46.8	178.9	-69.2	-27.3	0	0	0	111.6	M444 L446 T451 Q452 Q476	M444-N448 WeakPolarHBondContact O-CB 3.13Å; M444-N448 VanDerWaalsContact O-CG 3.27Å; M444-N448 PolarHBondContact O-N 2.99Å; M444-N448 PolarHBondContact O-ND2 2.8Å; L446-N448 VanDerWaalsContact C-N 3.32Å; L446-N448 PolarHBondContact O-N 3.47Å; N448-T451 PolarHBondContact O-N 3.15Å; N448-Q452 WeakPolarHBondContact O-CG 3.24Å; N448-Q452 PolarHBondContact O-N 3.18Å; N448-Q476 PolarHBondContact OD1-NE2 2.9Å
449	T	87.3	Confident	88.1	Confident	43 Å²	43	66.6 Å²	66.6	26%	0.264	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-45.7	178.6	-64.6	0	0	0	0	111.9	D445 L446 Q452 R453	D445-T449 WeakPolarHBondContact O-CB 3.31Å; D445-T449 PolarHBondContact O-N 2.84Å; D445-T449 PolarHBondContact O-OG1 2.91Å; L446-T449 PolarHBondContact O-N 3.21Å; T449-Q452 PolarHBondContact O-N 2.76Å; T449-R453 HydrophobicContact CG2-CG 4.39Å; T449-R453 WeakPolarHBondContact O-CB 3.26Å; T449-R453 WeakPolarHBondContact O-CG 3.4Å; T449-R453 PolarHBondContact O-N 3.23Å
450	W	90.1	Very high	88.5	Confident	63 Å²	63	65.3 Å²	65.3	24%	0.239	32%	0.321	C	S	.	.	H	α-helix	trans	-76.2	-30.8	-178.2	-80.2	82.2	0	0	0	112.9	I378 P379 V382 L446 Q452 R453 S454 F457	I378-W450 HydrophobicContact CD1-CZ3 4.49Å; I378-W450 HydrophobicContact CG2-CE3 4.4Å; I378-W450 HydrophobicContact CG2-CZ3 4.48Å; P379-W450 HydrophobicContact CG-CH2 3.94Å; V382-W450 HydrophobicContact CB-CZ2 4.45Å; V382-W450 HydrophobicContact CG1-CD2 3.85Å; V382-W450 HydrophobicContact CG1-CG 3.88Å; V382-W450 HydrophobicContact CG1-CZ2 4.32Å; V382-W450 HydrophobicContact CG2-CH2 4.3Å; V382-W450 HydrophobicContact CG2-CZ2 3.49Å; V382-W450 VanDerWaalsContact CG2-CZ2 3.49Å; L446-W450 WeakPolarHBondContact O-CB 3.47Å; L446-W450 VanDerWaalsContact O-CD1 3.32Å; L446-W450 PolarHBondContact O-N 3.19Å; W450-Q452 PolarHBondContact O-N 2.81Å; W450-R453 PolarHBondContact O-N 2.77Å; W450-S454 WeakPolarHBondContact O-CA 3.34Å; W450-S454 WeakPolarHBondContact O-CB 3.34Å; W450-S454 PolarHBondContact O-N 3.08Å; W450-F457 HydrophobicContact CB-CB 4.4Å; W450-F457 HydrophobicContact CB-CD1 3.89Å; W450-F457 HydrophobicContact CB-CD2 3.91Å; W450-F457 HydrophobicContact CB-CE1 4.12Å; W450-F457 HydrophobicContact CB-CE2 4.14Å; W450-F457 HydrophobicContact CB-CG 3.8Å; W450-F457 HydrophobicContact CB-CZ 4.26Å
451	T	86.2	Confident	88.8	Confident	40 Å²	40	64.8 Å²	64.8	25%	0.245	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-30.5	169.2	-59.2	0	0	0	0	112.3	V447 N448 F457 K458	V447-T451 VanDerWaalsContact O-CB 3.22Å; V447-T451 WeakPolarHBondContact O-CB 3.34Å; V447-T451 PolarHBondContact O-N 2.95Å; V447-T451 PolarHBondContact O-OG1 3.24Å; N448-T451 PolarHBondContact O-N 3.15Å; T451-F457 WeakPolarHBondContact OG1-CE1 3.45Å; T451-K458 HydrophobicContact CG2-CB 4.46Å; T451-K458 HydrophobicContact CG2-CD 4.31Å; T451-K458 HydrophobicContact CG2-CG 4.19Å
452	Q	85.7	Confident	89.3	Confident	169 Å²	169	65.6 Å²	65.6	79%	0.79	32%	0.32	S	S	*	.	H	α-helix	trans	-85.5	-41.3	175.7	-67.7	177.9	20.6	0	0	113.1	N448 T449 W450	N448-Q452 WeakPolarHBondContact O-CG 3.24Å; N448-Q452 PolarHBondContact O-N 3.18Å; T449-Q452 PolarHBondContact O-N 2.76Å; W450-Q452 PolarHBondContact O-N 2.81Å
453	R	89.6	Confident	89.6	Confident	210 Å²	210	61.2 Å²	61.2	79%	0.792	31%	0.309	S	S	*	.	H	α-helix	trans	-89	-25.3	-172.6	-67.5	-177.8	-178.1	167.3	1.2	114.9	T449 W450	T449-R453 HydrophobicContact CG2-CG 4.39Å; T449-R453 WeakPolarHBondContact O-CB 3.26Å; T449-R453 WeakPolarHBondContact O-CG 3.4Å; T449-R453 PolarHBondContact O-N 3.23Å; W450-R453 PolarHBondContact O-N 2.77Å
454	S	93	Very high	89.6	Confident	19 Å²	19	61.3 Å²	61.3	13%	0.133	31%	0.31	C	S	.	.			trans	-120.7	110.7	-178	177.2	0	0	0	0	111.5	W450 Q456 F457 K458	W450-S454 WeakPolarHBondContact O-CA 3.34Å; W450-S454 WeakPolarHBondContact O-CB 3.34Å; W450-S454 PolarHBondContact O-N 3.08Å; S454-Q456 PolarHBondContact O-N 2.84Å; S454-Q456 PolarHBondContact OG-N 2.66Å; S454-F457 PolarHBondContact O-N 2.79Å; S454-F457 PolarHBondContact OG-N 3.07Å; S454-F457 VanDerWaalsContact OG-N 3.09Å; S454-K458 WeakPolarHBondContact O-CB 3.47Å; S454-K458 PolarHBondContact O-N 3.48Å
455	S	92	Very high	89.8	Confident	104 Å²	104	63.3 Å²	63.3	73%	0.727	32%	0.319	S	S	*	.	H	α-helix	trans	-61.4	-31.7	171.6	51.7	0	0	0	0	112.2	S459	S455-S459 VanDerWaalsContact O-CB 3.24Å; S455-S459 WeakPolarHBondContact O-CB 3.43Å; S455-S459 PolarHBondContact O-N 3.04Å
456	Q	93.3	Very high	89.9	Confident	98 Å²	98	65.1 Å²	65.1	46%	0.458	32%	0.322	S	S	.	.	H	α-helix	trans	-68.2	-51.1	176.6	-172	176.3	19.4	0	0	111.4	A376 S454 K458 S459 V460	A376-Q456 HydrophobicContact CB-CG 4.35Å; A376-Q456 PolarHBondContact O-NE2 2.97Å; A376-Q456 PolarHBondContact O-OE1 3.28Å; S454-Q456 PolarHBondContact O-N 2.84Å; S454-Q456 PolarHBondContact OG-N 2.66Å; Q456-K458 VanDerWaalsContact C-N 3.33Å; Q456-K458 PolarHBondContact O-N 2.68Å; Q456-S459 PolarHBondContact O-N 2.84Å; Q456-V460 WeakPolarHBondContact O-CG2 3.47Å; Q456-V460 PolarHBondContact O-N 2.74Å
457	F	94.3	Very high	89.7	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-54.4	-51.5	174.2	-178.8	-84.9	0	0	0	110.6	L373 I378 I386 V447 W450 T451 S454 S459 V460 V461	L373-F457 HydrophobicContact CD1-CE2 3.89Å; L373-F457 HydrophobicContact CD1-CZ 4.44Å; L373-F457 HydrophobicContact CD2-CD2 3.58Å; L373-F457 HydrophobicContact CD2-CE2 3.79Å; L373-F457 HydrophobicContact CD2-CG 4.25Å; L373-F457 HydrophobicContact CG-CE2 4.49Å; I378-F457 HydrophobicContact CD1-CB 3.95Å; I378-F457 HydrophobicContact CD1-CD2 4.34Å; I378-F457 HydrophobicContact CG1-CD2 4.26Å; I378-F457 HydrophobicContact CG2-CD2 4.24Å; I386-F457 HydrophobicContact CD1-CE2 3.58Å; I386-F457 HydrophobicContact CD1-CZ 3.74Å; V447-F457 HydrophobicContact CG1-CE1 4.36Å; V447-F457 HydrophobicContact CG1-CZ 4.45Å; W450-F457 HydrophobicContact CB-CB 4.4Å; W450-F457 HydrophobicContact CB-CD1 3.89Å; W450-F457 HydrophobicContact CB-CD2 3.91Å; W450-F457 HydrophobicContact CB-CE1 4.12Å; W450-F457 HydrophobicContact CB-CE2 4.14Å; W450-F457 HydrophobicContact CB-CG 3.8Å; W450-F457 HydrophobicContact CB-CZ 4.26Å; T451-F457 WeakPolarHBondContact OG1-CE1 3.45Å; S454-F457 PolarHBondContact O-N 2.79Å; S454-F457 PolarHBondContact OG-N 3.07Å; S454-F457 VanDerWaalsContact OG-N 3.09Å; F457-S459 VanDerWaalsContact C-N 3.35Å; F457-S459 PolarHBondContact O-N 2.92Å; F457-V460 PolarHBondContact O-N 2.75Å; F457-V461 HydrophobicContact CD1-CG2 4.11Å; F457-V461 HydrophobicContact CE1-CG2 3.73Å; F457-V461 HydrophobicContact CZ-CG2 3.97Å; F457-V461 WeakPolarHBondContact O-CG2 3.17Å; F457-V461 PolarHBondContact O-N 2.83Å
458	K	92.2	Very high	89.3	Confident	87 Å²	87	76.6 Å²	76.6	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-57.8	-44.3	178.3	-178.6	174.1	-176.4	169.7	0	112.4	T451 S454 Q456 Q462	T451-K458 HydrophobicContact CG2-CB 4.46Å; T451-K458 HydrophobicContact CG2-CD 4.31Å; T451-K458 HydrophobicContact CG2-CG 4.19Å; S454-K458 WeakPolarHBondContact O-CB 3.47Å; S454-K458 PolarHBondContact O-N 3.48Å; Q456-K458 VanDerWaalsContact C-N 3.33Å; Q456-K458 PolarHBondContact O-N 2.68Å; K458-Q462 HydrophobicContact CG-CG 4.31Å; K458-Q462 VanDerWaalsContact O-CB 3.25Å; K458-Q462 WeakPolarHBondContact O-CB 3.39Å; K458-Q462 VanDerWaalsContact O-CG 3.25Å; K458-Q462 WeakPolarHBondContact O-CG 3.47Å; K458-Q462 PolarHBondContact O-N 2.66Å
459	S	93.4	Very high	89	Confident	58 Å²	58	78 Å²	78	41%	0.406	39%	0.385	S	S	.	.	H	α-helix	trans	-64.7	-42.6	179.5	-171.7	0	0	0	0	112.1	S455 Q456 F457 N463	S455-S459 VanDerWaalsContact O-CB 3.24Å; S455-S459 WeakPolarHBondContact O-CB 3.43Å; S455-S459 PolarHBondContact O-N 3.04Å; Q456-S459 PolarHBondContact O-N 2.84Å; F457-S459 VanDerWaalsContact C-N 3.35Å; F457-S459 PolarHBondContact O-N 2.92Å; S459-N463 VanDerWaalsContact O-CB 3.23Å; S459-N463 WeakPolarHBondContact O-CB 3.41Å; S459-N463 PolarHBondContact O-N 3.2Å; S459-N463 PolarHBondContact O-ND2 2.85Å
460	V	94.3	Very high	88.5	Confident	28 Å²	28	76 Å²	76	17%	0.17	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-52.8	176.8	173	0	0	0	0	110.6	K372 L373 A376 Q456 F457 Q462 N463 I464	K372-V460 HydrophobicContact CB-CG1 3.95Å; L373-V460 HydrophobicContact CD2-CB 4.06Å; L373-V460 HydrophobicContact CD2-CG1 3.78Å; L373-V460 HydrophobicContact CG-CG1 4.14Å; A376-V460 HydrophobicContact CB-CG2 3.64Å; Q456-V460 WeakPolarHBondContact O-CG2 3.47Å; Q456-V460 PolarHBondContact O-N 2.74Å; F457-V460 PolarHBondContact O-N 2.75Å; V460-Q462 PolarHBondContact O-N 2.96Å; V460-N463 PolarHBondContact O-N 3.33Å; V460-N463 VanDerWaalsContact O-N 3.13Å; V460-I464 HydrophobicContact CG1-CD1 3.9Å; V460-I464 WeakPolarHBondContact O-CG1 3.41Å; V460-I464 PolarHBondContact O-N 2.95Å
461	V	91.9	Very high	87.6	Confident	5 Å²	5	74.6 Å²	74.6	3%	0.03	38%	0.379	C	S	.	.	H	α-helix	trans	-58.7	-48.6	179	174.4	0	0	0	0	110.8	F369 L373 F457 N463 I464 Q465 L475	F369-V461 HydrophobicContact CE1-CG1 4.18Å; L373-V461 HydrophobicContact CD2-CG2 4.24Å; F457-V461 HydrophobicContact CD1-CG2 4.11Å; F457-V461 HydrophobicContact CE1-CG2 3.73Å; F457-V461 HydrophobicContact CZ-CG2 3.97Å; F457-V461 WeakPolarHBondContact O-CG2 3.17Å; F457-V461 PolarHBondContact O-N 2.83Å; V461-N463 VanDerWaalsContact C-N 3.27Å; V461-N463 PolarHBondContact O-N 3.4Å; V461-I464 PolarHBondContact O-N 3.42Å; V461-I464 VanDerWaalsContact O-N 3.17Å; V461-Q465 HydrophobicContact CG1-CG 4.39Å; V461-Q465 WeakPolarHBondContact O-CG 3.3Å; V461-Q465 PolarHBondContact O-N 3.13Å; V461-L475 HydrophobicContact CG1-CB 4.02Å; V461-L475 HydrophobicContact CG1-CD2 4.19Å; V461-L475 HydrophobicContact CG2-CD2 3.94Å
462	Q	89.7	Confident	86.8	Confident	89 Å²	89	79 Å²	79	42%	0.416	40%	0.4	S	S	.	.	H	α-helix	trans	-65.9	-24.5	178.3	-72.4	-172.3	-29.2	0	0	114	K458 V460 K466	K458-Q462 HydrophobicContact CG-CG 4.31Å; K458-Q462 VanDerWaalsContact O-CB 3.25Å; K458-Q462 WeakPolarHBondContact O-CB 3.39Å; K458-Q462 VanDerWaalsContact O-CG 3.25Å; K458-Q462 WeakPolarHBondContact O-CG 3.47Å; K458-Q462 PolarHBondContact O-N 2.66Å; V460-Q462 PolarHBondContact O-N 2.96Å; Q462-K466 VanDerWaalsContact O-CD 3.28Å; Q462-K466 WeakPolarHBondContact O-CD 3.26Å; Q462-K466 WeakPolarHBondContact O-CE 3.24Å; Q462-K466 VanDerWaalsContact O-CG 3.23Å; Q462-K466 WeakPolarHBondContact O-CG 3.36Å
463	N	91.4	Very high	86.3	Confident	77 Å²	77	72.8 Å²	72.8	41%	0.412	37%	0.373	S	S	.	.	H	α-helix	trans	-83.6	-21.2	175.7	-71.5	-17	0	0	0	113	S459 V460 V461 K466 Q467	S459-N463 VanDerWaalsContact O-CB 3.23Å; S459-N463 WeakPolarHBondContact O-CB 3.41Å; S459-N463 PolarHBondContact O-N 3.2Å; S459-N463 PolarHBondContact O-ND2 2.85Å; V460-N463 PolarHBondContact O-N 3.33Å; V460-N463 VanDerWaalsContact O-N 3.13Å; V461-N463 VanDerWaalsContact C-N 3.27Å; V461-N463 PolarHBondContact O-N 3.4Å; N463-K466 PolarHBondContact OD1-NZ 2.87Å; N463-Q467 WeakPolarHBondContact O-CG 3.28Å; N463-Q467 PolarHBondContact O-NE2 3.38Å; N463-Q467 VanDerWaalsContact O-NE2 3.15Å
464	I	89.8	Confident	85.8	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-80.7	-42.9	170.1	-61	161.8	0	0	0	110	L364 V368 F369 K372 V460 V461 K466 Q467 C470	L364-I464 HydrophobicContact CD1-CG2 4.49Å; V368-I464 HydrophobicContact CG1-CD1 4.42Å; V368-I464 HydrophobicContact CG1-CG1 4.37Å; V368-I464 HydrophobicContact CG1-CG2 3.88Å; F369-I464 HydrophobicContact CD1-CB 4.14Å; F369-I464 HydrophobicContact CD1-CD1 3.53Å; F369-I464 HydrophobicContact CD1-CG1 4.45Å; F369-I464 HydrophobicContact CD1-CG2 3.98Å; F369-I464 HydrophobicContact CD2-CG2 4.15Å; F369-I464 HydrophobicContact CE1-CB 3.64Å; F369-I464 HydrophobicContact CE1-CD1 3.92Å; F369-I464 HydrophobicContact CE1-CG1 4.4Å; F369-I464 HydrophobicContact CE1-CG2 3.56Å; F369-I464 HydrophobicContact CE2-CG2 3.74Å; F369-I464 HydrophobicContact CG-CD1 4.17Å; F369-I464 HydrophobicContact CG-CG2 4.26Å; F369-I464 HydrophobicContact CZ-CB 3.95Å; F369-I464 HydrophobicContact CZ-CG2 3.43Å; F369-I464 VanDerWaalsContact CZ-CG2 3.43Å; K372-I464 HydrophobicContact CB-CD1 3.85Å; K372-I464 HydrophobicContact CG-CD1 4.25Å; V460-I464 HydrophobicContact CG1-CD1 3.9Å; V460-I464 WeakPolarHBondContact O-CG1 3.41Å; V460-I464 PolarHBondContact O-N 2.95Å; V461-I464 PolarHBondContact O-N 3.42Å; V461-I464 VanDerWaalsContact O-N 3.17Å; I464-K466 PolarHBondContact O-N 3.02Å; I464-K466 VanDerWaalsContact O-N 3.13Å; I464-Q467 WeakPolarHBondContact O-CB 3.33Å; I464-Q467 PolarHBondContact O-N 3.26Å; I464-C470 WeakPolarHBondContact O-CB 3.45Å
465	Q	87.7	Confident	85.4	Confident	46 Å²	46	64 Å²	64	22%	0.215	34%	0.341	C	S	.	.	H	α-helix	trans	-57.4	-27.9	177.7	-74.1	-174.4	-96.7	0	0	114.9	V461 Q467 L473	V461-Q465 HydrophobicContact CG1-CG 4.39Å; V461-Q465 WeakPolarHBondContact O-CG 3.3Å; V461-Q465 PolarHBondContact O-N 3.13Å; Q465-Q467 VanDerWaalsContact C-N 3.29Å; Q465-L473 PolarHBondContact NE2-O 3.02Å; Q465-L473 VanDerWaalsContact NE2-O 3.11Å
466	K	85.4	Confident	85	Confident	141 Å²	141	60.9 Å²	60.9	61%	0.613	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-11	176.3	-69	163.7	-163.5	162.3	0	113.7	Q462 N463 I464	Q462-K466 VanDerWaalsContact O-CD 3.28Å; Q462-K466 WeakPolarHBondContact O-CD 3.26Å; Q462-K466 WeakPolarHBondContact O-CE 3.24Å; Q462-K466 VanDerWaalsContact O-CG 3.23Å; Q462-K466 WeakPolarHBondContact O-CG 3.36Å; N463-K466 PolarHBondContact OD1-NZ 2.87Å; I464-K466 PolarHBondContact O-N 3.02Å; I464-K466 VanDerWaalsContact O-N 3.13Å
467	Q	85.8	Confident	84.3	Confident	89 Å²	89	58 Å²	58	42%	0.416	30%	0.302	S	S	.	.	S	Bend	trans	-83.8	142.1	-179.4	-57.8	173.4	25.3	0	0	109.5	N463 I464 Q465 V469 C470	N463-Q467 WeakPolarHBondContact O-CG 3.28Å; N463-Q467 PolarHBondContact O-NE2 3.38Å; N463-Q467 VanDerWaalsContact O-NE2 3.15Å; I464-Q467 WeakPolarHBondContact O-CB 3.33Å; I464-Q467 PolarHBondContact O-N 3.26Å; Q465-Q467 VanDerWaalsContact C-N 3.29Å; Q467-V469 HydrophobicContact CB-CG2 3.82Å; Q467-V469 PolarHBondContact O-N 2.7Å; Q467-V469 VanDerWaalsContact O-N 3.13Å; Q467-C470 WeakPolarHBondContact O-CB 3.37Å; Q467-C470 PolarHBondContact O-N 2.89Å
468	E	79.1	Confident	83.8	Confident	184 Å²	184	58 Å²	58	86%	0.86	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-59.4	-29.9	-176.2	-59.5	-174.2	149.5	0	0	112.8	C470 G471	E468-C470 PolarHBondContact O-N 3.13Å; E468-G471 PolarHBondContact O-N 2.89Å
469	V	77.4	Confident	83.5	Confident	84 Å²	84	53.9 Å²	53.9	51%	0.509	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-56.4	-30.8	172.8	-62.5	0	0	0	0	113.1	R361 L364 Q467 G471	R361-V469 PolarHBondContact NH1-O 2.98Å; L364-V469 HydrophobicContact CD1-CB 4.4Å; L364-V469 HydrophobicContact CD1-CG2 3.91Å; Q467-V469 HydrophobicContact CB-CG2 3.82Å; Q467-V469 PolarHBondContact O-N 2.7Å; Q467-V469 VanDerWaalsContact O-N 3.13Å; V469-G471 VanDerWaalsContact C-N 3.3Å
470	C	75.9	Confident	82.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-82.6	-4.5	177.5	-152.4	0	0	0	0	113	I464 Q467 E468 N472 L473 H478	I464-C470 WeakPolarHBondContact O-CB 3.45Å; Q467-C470 WeakPolarHBondContact O-CB 3.37Å; Q467-C470 PolarHBondContact O-N 2.89Å; E468-C470 PolarHBondContact O-N 3.13Å; C470-N472 PolarHBondContact O-N 2.83Å; C470-L473 WeakPolarHBondContact O-CB 3.14Å; C470-L473 PolarHBondContact O-N 2.79Å; C470-H478 PolarHBondContact O-NE2 3.47Å; C470-H478 VanDerWaalsContact O-NE2 3.11Å; C470-H478 VanDerWaalsContact SG-CD2 3.54Å; C470-H478 PolarHBondContact SG-NE2 3.22Å
471	G	72.6	Confident	82.2	Confident	35 Å²	35	52 Å²	52	36%	0.361	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	12.6	177.2	0	0	0	0	0	115.7	E468 V469	E468-G471 PolarHBondContact O-N 2.89Å; V469-G471 VanDerWaalsContact C-N 3.3Å
472	N	69.4	Low	81.9	Confident	131 Å²	131	51.8 Å²	51.8	70%	0.701	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	17.6	-166.2	-47.4	-86.3	0	0	0	115	C470	C470-N472 PolarHBondContact O-N 2.83Å
473	L	73.4	Confident	81.4	Confident	40 Å²	40	48.2 Å²	48.2	21%	0.209	25%	0.25	C	S	.	.			trans	-85.6	175.8	178.2	-63.3	164.8	0	0	0	111.2	Q465 C470 H477	Q465-L473 PolarHBondContact NE2-O 3.02Å; Q465-L473 VanDerWaalsContact NE2-O 3.11Å; C470-L473 WeakPolarHBondContact O-CB 3.14Å; C470-L473 PolarHBondContact O-N 2.79Å; L473-H477 HydrophobicContact CB-CB 4.34Å
474	T	80	Confident	80.4	Confident	43 Å²	43	45.8 Å²	45.8	26%	0.264	24%	0.236	S	C	.	.			trans	-95.6	156.9	177.3	66.2	0	0	0	0	111.8	Q476 H477 H478	T474-Q476 PolarHBondContact O-N 2.91Å; T474-H477 WeakPolarHBondContact O-CB 3.41Å; T474-H477 PolarHBondContact O-N 3.11Å; T474-H477 VanDerWaalsContact O-N 3.07Å; T474-H477 WeakPolarHBondContact OG1-CB 3.34Å; T474-H477 PolarHBondContact OG1-N 3.36Å; T474-H478 PolarHBondContact O-CD2 3.21Å; T474-H478 PolarHBondContact O-N 2.89Å
475	L	85.5	Confident	80.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-55.9	-43.5	170.5	171.9	57.3	0	0	0	110.3	L365 F369 F387 V447 V461 H477 H478 M479	L365-L475 HydrophobicContact CD2-CD1 3.91Å; F369-L475 HydrophobicContact CB-CD1 4.26Å; F369-L475 HydrophobicContact CD1-CD1 3.92Å; F369-L475 HydrophobicContact CD1-CD2 4.3Å; F369-L475 HydrophobicContact CD2-CD1 3.92Å; F369-L475 HydrophobicContact CE1-CB 4.1Å; F369-L475 HydrophobicContact CE1-CD1 4.15Å; F369-L475 HydrophobicContact CE1-CD2 4.49Å; F369-L475 HydrophobicContact CE1-CG 4.48Å; F369-L475 HydrophobicContact CE2-CD1 4.16Å; F369-L475 HydrophobicContact CG-CD1 3.8Å; F369-L475 HydrophobicContact CZ-CB 4.19Å; F369-L475 HydrophobicContact CZ-CD1 4.27Å; F387-L475 HydrophobicContact CE1-CD1 4.05Å; F387-L475 HydrophobicContact CZ-CD1 4.21Å; V447-L475 HydrophobicContact CG1-CD2 4.22Å; V447-L475 HydrophobicContact CG2-CD2 4.2Å; V461-L475 HydrophobicContact CG1-CB 4.02Å; V461-L475 HydrophobicContact CG1-CD2 4.19Å; V461-L475 HydrophobicContact CG2-CD2 3.94Å; L475-H477 VanDerWaalsContact C-N 3.29Å; L475-H477 PolarHBondContact O-N 3.44Å; L475-H478 PolarHBondContact O-N 3.1Å; L475-M479 HydrophobicContact CD1-CG 4.07Å; L475-M479 HydrophobicContact CD1-SD 3.91Å; L475-M479 HydrophobicContact CG-SD 3.85Å; L475-M479 VanDerWaalsContact O-CG 3.22Å; L475-M479 WeakPolarHBondContact O-CG 3.41Å; L475-M479 PolarHBondContact O-N 3.3Å
476	Q	83	Confident	79.9	Confident	39 Å²	39	44 Å²	44	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-38	175.1	-62.6	90.9	-32.9	0	0	112.6	M444 V447 N448 T474 L480	M444-Q476 HydrophobicContact CE-CB 4.43Å; M444-Q476 HydrophobicContact CE-CG 4.43Å; M444-Q476 HydrophobicContact SD-CB 3.94Å; M444-Q476 HydrophobicContact SD-CG 3.91Å; V447-Q476 HydrophobicContact CG1-CG 4.13Å; N448-Q476 PolarHBondContact OD1-NE2 2.9Å; T474-Q476 PolarHBondContact O-N 2.91Å; Q476-L480 PolarHBondContact O-N 3.12Å
477	H	79.1	Confident	79.3	Confident	37 Å²	37	39 Å²	39	17%	0.171	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-50	176	-174.3	102.8	0	0	0	111.6	L473 T474 L475 M479 L480	L473-H477 HydrophobicContact CB-CB 4.34Å; T474-H477 WeakPolarHBondContact O-CB 3.41Å; T474-H477 PolarHBondContact O-N 3.11Å; T474-H477 VanDerWaalsContact O-N 3.07Å; T474-H477 WeakPolarHBondContact OG1-CB 3.34Å; T474-H477 PolarHBondContact OG1-N 3.36Å; L475-H477 VanDerWaalsContact C-N 3.29Å; L475-H477 PolarHBondContact O-N 3.44Å; H477-M479 VanDerWaalsContact C-N 3.26Å; H477-M479 PolarHBondContact O-N 3.19Å; H477-L480 WeakPolarHBondContact O-CB 3.45Å; H477-L480 PolarHBondContact O-N 2.72Å
478	H	83.1	Confident	78.8	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-36.2	178.3	-70.2	-50.9	0	0	0	112.5	L364 L365 C470 T474 L475 L480 E481	L364-H478 WeakPolarHBondContact CD2-NE2 3.37Å; L365-H478 HydrophobicContact CD2-CB 3.74Å; L365-H478 HydrophobicContact CG-CB 4.23Å; C470-H478 PolarHBondContact O-NE2 3.47Å; C470-H478 VanDerWaalsContact O-NE2 3.11Å; C470-H478 VanDerWaalsContact SG-CD2 3.54Å; C470-H478 PolarHBondContact SG-NE2 3.22Å; T474-H478 PolarHBondContact O-CD2 3.21Å; T474-H478 PolarHBondContact O-N 2.89Å; L475-H478 PolarHBondContact O-N 3.1Å; H478-L480 PolarHBondContact O-N 3.19Å; H478-E481 IonicContact CE1-OE1 2.69Å; H478-E481 IonicContact CG-OE1 2.9Å; H478-E481 IonicContact ND1-OE1 2.7Å; H478-E481 PolarHBondContact ND1-OE1 3.39Å; H478-E481 WeakPolarHBondContact O-CB 3.28Å; H478-E481 PolarHBondContact O-N 3.32Å; H478-E481 VanDerWaalsContact O-N 3.09Å
479	M	86.6	Confident	79	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-18.1	175.8	-69.2	172.7	70.6	0	0	113.7	L365 I386 Y436 F440 M444 V447 L475 H477 P482	L365-M479 HydrophobicContact CD2-CG 3.71Å; I386-M479 HydrophobicContact CG2-CE 3.94Å; I386-M479 HydrophobicContact CG2-SD 4.21Å; I386-M479 WeakPolarHBondContact O-CE 3.3Å; Y436-M479 PolarHBondContact OH-O 2.96Å; F440-M479 HydrophobicContact CE2-CB 4.02Å; F440-M479 VanDerWaalsContact CE2-O 3.3Å; F440-M479 WeakPolarHBondContact CE2-O 3.43Å; M444-M479 HydrophobicContact CE-CB 3.83Å; M444-M479 HydrophobicContact CE-CE 3.45Å; M444-M479 VanDerWaalsContact CE-CE 3.45Å; M444-M479 HydrophobicContact CE-CG 4.36Å; M444-M479 HydrophobicContact CE-SD 3.61Å; V447-M479 HydrophobicContact CG2-CE 4.49Å; V447-M479 HydrophobicContact CG2-SD 4.09Å; L475-M479 HydrophobicContact CD1-CG 4.07Å; L475-M479 HydrophobicContact CD1-SD 3.91Å; L475-M479 HydrophobicContact CG-SD 3.85Å; L475-M479 VanDerWaalsContact O-CG 3.22Å; L475-M479 WeakPolarHBondContact O-CG 3.41Å; L475-M479 PolarHBondContact O-N 3.3Å; H477-M479 VanDerWaalsContact C-N 3.26Å; H477-M479 PolarHBondContact O-N 3.19Å; M479-P482 WeakPolarHBondContact O-CD 3.22Å
480	L	77.6	Confident	79.1	Confident	17 Å²	17	29.4 Å²	29.4	9%	0.089	15%	0.154	C	C	.	.	H	α-helix	trans	-76.7	-25.6	172.9	-69	164.3	0	0	0	112.9	F440 Q476 H477 H478 V483 Q484 M534	F440-L480 HydrophobicContact CE1-CD2 3.89Å; F440-L480 HydrophobicContact CE2-CD2 4.37Å; F440-L480 HydrophobicContact CZ-CD2 3.47Å; F440-L480 VanDerWaalsContact CZ-CD2 3.47Å; F440-L480 HydrophobicContact CZ-CG 4.04Å; Q476-L480 PolarHBondContact O-N 3.12Å; H477-L480 WeakPolarHBondContact O-CB 3.45Å; H477-L480 PolarHBondContact O-N 2.72Å; H478-L480 PolarHBondContact O-N 3.19Å; L480-V483 WeakPolarHBondContact O-CB 3.49Å; L480-V483 PolarHBondContact O-N 3.47Å; L480-Q484 PolarHBondContact O-N 3.13Å; L480-Q484 VanDerWaalsContact O-N 3.13Å; L480-M534 HydrophobicContact CD1-CE 4.16Å; L480-M534 HydrophobicContact CD1-CG 3.77Å; L480-M534 HydrophobicContact CD1-SD 3.98Å; L480-M534 HydrophobicContact CD2-CE 4.44Å; L480-M534 HydrophobicContact CD2-CG 4.13Å
481	E	81.6	Confident	79.1	Confident	30 Å²	30	35 Å²	35	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-58.1	-39.7	-172.4	-62.1	-177.2	-132.6	0	0	114	R361 H478 V483 Q484 R485	R361-E481 VanDerWaalsContact CB-OE2 3.25Å; R361-E481 WeakPolarHBondContact CB-OE2 3.49Å; R361-E481 WeakPolarHBondContact CD-OE1 3.06Å; R361-E481 WeakPolarHBondContact CD-OE2 3.45Å; R361-E481 WeakPolarHBondContact CG-OE2 3.49Å; R361-E481 IonicContact NE-OE1 3.16Å; R361-E481 IonicContact NE-OE2 3.56Å; H478-E481 IonicContact CE1-OE1 2.69Å; H478-E481 IonicContact CG-OE1 2.9Å; H478-E481 IonicContact ND1-OE1 2.7Å; H478-E481 PolarHBondContact ND1-OE1 3.39Å; H478-E481 WeakPolarHBondContact O-CB 3.28Å; H478-E481 PolarHBondContact O-N 3.32Å; H478-E481 VanDerWaalsContact O-N 3.09Å; E481-V483 VanDerWaalsContact C-N 3.35Å; E481-V483 PolarHBondContact O-N 3.21Å; E481-Q484 PolarHBondContact O-N 3.26Å; E481-R485 PolarHBondContact O-N 2.79Å; E481-R485 VanDerWaalsContact O-N 3.07Å
482	P	86.1	Confident	79.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-40.2	173	-22.7	33.6	0	0	0	113.5	Y358 L362 L365 I390 Y433 Y436 M479 Q484 R485	Y358-P482 HydrophobicContact CE2-CG 4.48Å; Y358-P482 VanDerWaalsContact OH-CA 3.28Å; Y358-P482 WeakPolarHBondContact OH-CA 3.44Å; Y358-P482 WeakPolarHBondContact OH-CB 3.38Å; L362-P482 HydrophobicContact CD2-CG 3.98Å; L365-P482 HydrophobicContact CD1-CG 4.28Å; I390-P482 HydrophobicContact CD1-CB 4.35Å; I390-P482 HydrophobicContact CD1-CG 3.59Å; Y433-P482 HydrophobicContact CD1-CB 4.3Å; Y433-P482 WeakPolarHBondContact CD1-O 3.31Å; Y433-P482 HydrophobicContact CE1-CB 3.84Å; Y433-P482 WeakPolarHBondContact CE1-O 3.3Å; Y436-P482 HydrophobicContact CD1-CB 4.19Å; Y436-P482 HydrophobicContact CE1-CB 4Å; Y436-P482 HydrophobicContact CE1-CG 4.11Å; M479-P482 WeakPolarHBondContact O-CD 3.22Å; P482-Q484 PolarHBondContact O-N 3.06Å; P482-R485 PolarHBondContact O-N 3.05Å
483	V	78.9	Confident	80.1	Confident	14 Å²	14	28.4 Å²	28.4	9%	0.085	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-36.9	177.8	-167.2	0	0	0	0	110.3	Y436 V437 F440 L480 E481 P487 M531	Y436-V483 HydrophobicContact CD1-CG2 4.25Å; Y436-V483 HydrophobicContact CE1-CG2 4.15Å; V437-V483 HydrophobicContact CG2-CG1 4.18Å; V437-V483 HydrophobicContact CG2-CG2 4.3Å; F440-V483 HydrophobicContact CD2-CG2 4.29Å; F440-V483 HydrophobicContact CE2-CG2 4.44Å; L480-V483 WeakPolarHBondContact O-CB 3.49Å; L480-V483 PolarHBondContact O-N 3.47Å; E481-V483 VanDerWaalsContact C-N 3.35Å; E481-V483 PolarHBondContact O-N 3.21Å; V483-P487 WeakPolarHBondContact O-CD 3.4Å; V483-M531 HydrophobicContact CB-SD 4.42Å; V483-M531 HydrophobicContact CG1-CB 4.49Å; V483-M531 HydrophobicContact CG1-CE 4.34Å; V483-M531 HydrophobicContact CG1-SD 3.86Å
484	Q	71.4	Confident	80.4	Confident	26 Å²	26	30.5 Å²	30.5	12%	0.121	15%	0.147	C	C	.	.	H	α-helix	trans	-77.9	-17.7	178.1	-62.4	-177.6	-4.8	0	0	115.2	L480 E481 P482 R488 M531	L480-Q484 PolarHBondContact O-N 3.13Å; L480-Q484 VanDerWaalsContact O-N 3.13Å; E481-Q484 PolarHBondContact O-N 3.26Å; P482-Q484 PolarHBondContact O-N 3.06Å; Q484-R488 VanDerWaalsContact CB-NH1 3.28Å; Q484-R488 WeakPolarHBondContact O-CG 3.23Å; Q484-M531 HydrophobicContact CB-SD 4.47Å; Q484-M531 HydrophobicContact CG-SD 4.1Å
485	R	84.9	Confident	80.3	Confident	7 Å²	7	31.3 Å²	31.3	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-72.6	-36.9	-176.6	-168.7	73.4	178.3	147.4	1.1	112.2	L351 T354 E355 Y358 E481 P482 R488 Y489	L351-R485 PolarHBondContact O-NH2 3.3Å; T354-R485 VanDerWaalsContact CB-NH1 3.3Å; T354-R485 PolarHBondContact OG1-NH1 3.09Å; T354-R485 PolarHBondContact OG1-NH2 3.21Å; E355-R485 VanDerWaalsContact CA-NH2 3.34Å; E355-R485 VanDerWaalsContact N-NH2 3.2Å; E355-R485 IonicContact OE2-CZ 3.92Å; E355-R485 VanDerWaalsContact OE2-CZ 3.23Å; E355-R485 IonicContact OE2-NE 3.82Å; E355-R485 PolarHBondContact OE2-NE 3.29Å; E355-R485 IonicContact OE2-NH2 3.2Å; E355-R485 PolarHBondContact OE2-NH2 3.02Å; Y358-R485 HydrophobicContact CD1-CB 4.35Å; Y358-R485 HydrophobicContact CD1-CG 3.65Å; Y358-R485 HydrophobicContact CD2-CB 4.32Å; Y358-R485 HydrophobicContact CD2-CG 4.34Å; Y358-R485 HydrophobicContact CE1-CB 3.94Å; Y358-R485 HydrophobicContact CE1-CG 3.56Å; Y358-R485 HydrophobicContact CE2-CB 3.93Å; Y358-R485 HydrophobicContact CE2-CG 4.29Å; Y358-R485 HydrophobicContact CG-CG 4.05Å; E481-R485 PolarHBondContact O-N 2.79Å; E481-R485 VanDerWaalsContact O-N 3.07Å; P482-R485 PolarHBondContact O-N 3.05Å; R485-R488 WeakPolarHBondContact O-CB 3.39Å; R485-R488 PolarHBondContact O-N 3.25Å; R485-R488 VanDerWaalsContact O-N 3.11Å; R485-Y489 HydrophobicContact CG-CD2 4.35Å; R485-Y489 HydrophobicContact CG-CE1 4.24Å; R485-Y489 HydrophobicContact CG-CE2 3.56Å; R485-Y489 VanDerWaalsContact CG-CZ 3.47Å; R485-Y489 VanDerWaalsContact CG-OH 3.32Å; R485-Y489 WeakPolarHBondContact CG-OH 3.12Å; R485-Y489 PolarHBondContact NE-OH 3.04Å; R485-Y489 VanDerWaalsContact NE-OH 3.14Å; R485-Y489 WeakPolarHBondContact O-CD2 3.47Å; R485-Y489 PolarHBondContact O-N 3.3Å; R485-Y489 VanDerWaalsContact O-N 3.14Å
486	I	81.2	Confident	80.4	Confident	6 Å²	6	31.4 Å²	31.4	3%	0.031	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-48.8	-177.6	-59.6	-54.8	0	0	0	113.1	M430 Y433 R488 Y489 E490 A521	M430-I486 HydrophobicContact CB-CD1 4.01Å; M430-I486 HydrophobicContact CG-CD1 4.2Å; M430-I486 HydrophobicContact SD-CD1 3.9Å; Y433-I486 HydrophobicContact CD1-CD1 4.04Å; Y433-I486 HydrophobicContact CD1-CG1 3.69Å; Y433-I486 HydrophobicContact CD2-CD1 3.81Å; Y433-I486 HydrophobicContact CD2-CG1 4.23Å; Y433-I486 HydrophobicContact CE1-CD1 4.06Å; Y433-I486 HydrophobicContact CE1-CG1 4.04Å; Y433-I486 HydrophobicContact CE2-CD1 3.83Å; Y433-I486 HydrophobicContact CG-CD1 3.89Å; Y433-I486 HydrophobicContact CG-CG1 3.77Å; I486-R488 VanDerWaalsContact C-N 3.27Å; I486-R488 PolarHBondContact O-N 3.4Å; I486-Y489 HydrophobicContact CD1-CD2 4.09Å; I486-Y489 HydrophobicContact CD1-CE2 4.14Å; I486-Y489 PolarHBondContact O-N 2.86Å; I486-E490 PolarHBondContact O-N 3Å; I486-A521 HydrophobicContact CG2-CB 3.92Å
487	P	72	Confident	80.6	Confident	36 Å²	36	31 Å²	31	23%	0.234	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-30.9	172.9	-20.9	30.4	0	0	0	113.8	V483 E490 L491 M531	V483-P487 WeakPolarHBondContact O-CD 3.4Å; P487-E490 PolarHBondContact O-N 3.37Å; P487-L491 WeakPolarHBondContact O-CG 3.4Å; P487-L491 PolarHBondContact O-N 2.93Å; P487-M531 HydrophobicContact CG-CE 3.45Å; P487-M531 VanDerWaalsContact CG-CE 3.45Å; P487-M531 HydrophobicContact CG-SD 4.27Å
488	R	77	Confident	81	Confident	118 Å²	118	36.6 Å²	36.6	45%	0.445	17%	0.173	S	C	.	.	H	α-helix	trans	-65.7	-37.4	177.4	-74.8	177.4	172.1	121.7	1.4	111.8	Q484 R485 I486 L491 L492	Q484-R488 VanDerWaalsContact CB-NH1 3.28Å; Q484-R488 WeakPolarHBondContact O-CG 3.23Å; R485-R488 WeakPolarHBondContact O-CB 3.39Å; R485-R488 PolarHBondContact O-N 3.25Å; R485-R488 VanDerWaalsContact O-N 3.11Å; I486-R488 VanDerWaalsContact C-N 3.27Å; I486-R488 PolarHBondContact O-N 3.4Å; R488-L491 PolarHBondContact O-N 3.35Å; R488-L492 WeakPolarHBondContact O-CB 3.2Å; R488-L492 VanDerWaalsContact O-CG 3.31Å; R488-L492 WeakPolarHBondContact O-CG 3.29Å; R488-L492 PolarHBondContact O-N 3.47Å
489	Y	82.6	Confident	81.1	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-42.4	170.4	-61.5	-51.2	0	0	0	111.9	L351 E355 H397 L401 M430 R485 I486 L491 L492 L493	L351-Y489 HydrophobicContact CD1-CD1 3.8Å; L351-Y489 HydrophobicContact CD1-CE1 3.9Å; E355-Y489 PolarHBondContact OE2-OH 2.97Å; H397-Y489 AromaticContact CE1-CZ 3.93Å; H397-Y489 PolarHBondContact CE1-OH 2.73Å; H397-Y489 PolarHBondContact ND1-OH 3.39Å; L401-Y489 HydrophobicContact CD2-CE1 4.33Å; M430-Y489 HydrophobicContact CE-CD2 3.68Å; M430-Y489 HydrophobicContact CE-CE2 3.63Å; M430-Y489 HydrophobicContact CE-CG 4.29Å; M430-Y489 HydrophobicContact SD-CD2 3.7Å; M430-Y489 HydrophobicContact SD-CE2 3.95Å; R485-Y489 HydrophobicContact CG-CD2 4.35Å; R485-Y489 HydrophobicContact CG-CE1 4.24Å; R485-Y489 HydrophobicContact CG-CE2 3.56Å; R485-Y489 VanDerWaalsContact CG-CZ 3.47Å; R485-Y489 VanDerWaalsContact CG-OH 3.32Å; R485-Y489 WeakPolarHBondContact CG-OH 3.12Å; R485-Y489 PolarHBondContact NE-OH 3.04Å; R485-Y489 VanDerWaalsContact NE-OH 3.14Å; R485-Y489 WeakPolarHBondContact O-CD2 3.47Å; R485-Y489 PolarHBondContact O-N 3.3Å; R485-Y489 VanDerWaalsContact O-N 3.14Å; I486-Y489 HydrophobicContact CD1-CD2 4.09Å; I486-Y489 HydrophobicContact CD1-CE2 4.14Å; I486-Y489 PolarHBondContact O-N 2.86Å; Y489-L491 VanDerWaalsContact C-N 3.32Å; Y489-L491 PolarHBondContact O-N 3.48Å; Y489-L492 PolarHBondContact O-N 2.85Å; Y489-L493 WeakPolarHBondContact O-CB 3.47Å; Y489-L493 PolarHBondContact O-N 3.23Å
490	E	78.6	Confident	81.1	Confident	35 Å²	35	40.9 Å²	40.9	16%	0.164	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-39.8	178.6	-161	-174.4	131.6	0	0	112	I486 P487 K494 L514 I517 S518	I486-E490 PolarHBondContact O-N 3Å; P487-E490 PolarHBondContact O-N 3.37Å; E490-K494 HydrophobicContact CG-CD 4.48Å; E490-K494 WeakPolarHBondContact O-CB 3.46Å; E490-K494 WeakPolarHBondContact O-CD 3.4Å; E490-K494 WeakPolarHBondContact O-CG 3.34Å; E490-K494 PolarHBondContact O-N 3.46Å; E490-K494 VanDerWaalsContact O-N 3.11Å; E490-K494 WeakPolarHBondContact OE1-CE 3.27Å; E490-K494 IonicContact OE1-NZ 2.68Å; E490-K494 PolarHBondContact OE1-NZ 2.87Å; E490-L514 HydrophobicContact CB-CD1 4.37Å; E490-L514 HydrophobicContact CG-CD1 3.56Å; E490-I517 HydrophobicContact CB-CG2 4.21Å; E490-S518 WeakPolarHBondContact OE2-CB 3.25Å; E490-S518 PolarHBondContact OE2-OG 2.88Å; E490-S518 VanDerWaalsContact OE2-OG 3.08Å
491	L	75.8	Confident	81.5	Confident	118 Å²	118	42.8 Å²	42.8	62%	0.618	21%	0.206	S	C	*	.	H	α-helix	trans	-69.9	-50.2	176.7	-69.2	172	0	0	0	112.7	P487 R488 Y489 L493 K494 D495	P487-L491 WeakPolarHBondContact O-CG 3.4Å; P487-L491 PolarHBondContact O-N 2.93Å; R488-L491 PolarHBondContact O-N 3.35Å; Y489-L491 VanDerWaalsContact C-N 3.32Å; Y489-L491 PolarHBondContact O-N 3.48Å; L491-L493 VanDerWaalsContact C-N 3.31Å; L491-L493 PolarHBondContact O-N 3.45Å; L491-K494 PolarHBondContact O-N 3.13Å; L491-D495 PolarHBondContact O-N 2.82Å
492	L	79.1	Confident	81.5	Confident	23 Å²	23	48.3 Å²	48.3	12%	0.12	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-40.6	179.7	-74	168.5	0	0	0	111.7	E350 L351 R488 Y489 D495 Y496	E350-L492 HydrophobicContact CG-CD2 4.29Å; L351-L492 HydrophobicContact CB-CD1 4.36Å; L351-L492 HydrophobicContact CD1-CD1 3.89Å; R488-L492 WeakPolarHBondContact O-CB 3.2Å; R488-L492 VanDerWaalsContact O-CG 3.31Å; R488-L492 WeakPolarHBondContact O-CG 3.29Å; R488-L492 PolarHBondContact O-N 3.47Å; Y489-L492 PolarHBondContact O-N 2.85Å; L492-D495 PolarHBondContact O-N 2.97Å; L492-Y496 WeakPolarHBondContact O-CB 3.32Å; L492-Y496 PolarHBondContact O-N 3.09Å
493	L	84.2	Confident	81.4	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-73.6	-32.8	-179.8	-170.2	56.6	0	0	0	112.4	L423 Y489 L491 Y496 L497 A510 A513 L514 I517	L423-L493 HydrophobicContact CD1-CD1 3.92Å; L423-L493 HydrophobicContact CD1-CD2 4.39Å; Y489-L493 WeakPolarHBondContact O-CB 3.47Å; Y489-L493 PolarHBondContact O-N 3.23Å; L491-L493 VanDerWaalsContact C-N 3.31Å; L491-L493 PolarHBondContact O-N 3.45Å; L493-Y496 HydrophobicContact CD1-CD1 4.33Å; L493-L497 WeakPolarHBondContact O-CB 3.46Å; L493-L497 VanDerWaalsContact O-CG 3.32Å; L493-L497 WeakPolarHBondContact O-CG 3.42Å; L493-L497 PolarHBondContact O-N 3.03Å; L493-A510 HydrophobicContact CD1-CB 3.78Å; L493-A513 HydrophobicContact CD2-CB 3.81Å; L493-L514 HydrophobicContact CB-CD1 4.31Å; L493-L514 HydrophobicContact CD2-CB 3.82Å; L493-L514 HydrophobicContact CD2-CD1 4.33Å; L493-L514 HydrophobicContact CG-CB 4.2Å; L493-L514 HydrophobicContact CG-CD1 4.42Å; L493-I517 HydrophobicContact CD2-CD1 3.79Å
494	K	80.6	Confident	81.7	Confident	84 Å²	84	55.4 Å²	55.4	37%	0.365	28%	0.277	S	S	.	.	H	α-helix	trans	-64.7	-36.5	168.8	-80.5	172.6	-174.9	173.5	0	112.6	E490 L491 K498 L514	E490-K494 HydrophobicContact CG-CD 4.48Å; E490-K494 WeakPolarHBondContact O-CB 3.46Å; E490-K494 WeakPolarHBondContact O-CD 3.4Å; E490-K494 WeakPolarHBondContact O-CG 3.34Å; E490-K494 PolarHBondContact O-N 3.46Å; E490-K494 VanDerWaalsContact O-N 3.11Å; E490-K494 WeakPolarHBondContact OE1-CE 3.27Å; E490-K494 IonicContact OE1-NZ 2.68Å; E490-K494 PolarHBondContact OE1-NZ 2.87Å; L491-K494 PolarHBondContact O-N 3.13Å; K494-K498 VanDerWaalsContact O-CG 3.3Å; K494-K498 WeakPolarHBondContact O-CG 3.12Å; K494-K498 PolarHBondContact O-N 2.9Å; K494-L514 HydrophobicContact CG-CD1 3.92Å; K494-L514 HydrophobicContact CG-CD2 3.66Å; K494-L514 HydrophobicContact CG-CG 4.46Å
495	D	78.4	Confident	82.3	Confident	60 Å²	60	61.3 Å²	61.3	32%	0.321	31%	0.309	S	S	.	.	H	α-helix	trans	-76.9	-38.2	176.2	-155.2	58.5	0	0	0	112.2	L491 L492 L497 K498 K499	L491-D495 PolarHBondContact O-N 2.82Å; L492-D495 PolarHBondContact O-N 2.97Å; D495-L497 VanDerWaalsContact C-N 3.34Å; D495-L497 PolarHBondContact O-N 2.96Å; D495-K498 WeakPolarHBondContact O-CB 3.24Å; D495-K498 PolarHBondContact O-N 3.32Å; D495-K498 VanDerWaalsContact O-N 3.1Å; D495-K499 PolarHBondContact O-N 2.93Å
496	Y	86.6	Confident	82.6	Confident	1 Å²	1	61.3 Å²	61.3	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-53.4	-50.5	170.8	-173.9	-102.9	0	0	0	111.3	L344 I347 I419 L492 L493 K498 K499 L500 D506 A510	L344-Y496 HydrophobicContact CB-CE2 4.2Å; L344-Y496 HydrophobicContact CD2-CD2 3.62Å; L344-Y496 HydrophobicContact CD2-CE2 3.47Å; L344-Y496 VanDerWaalsContact CD2-CE2 3.47Å; L344-Y496 HydrophobicContact CD2-CG 4.26Å; L344-Y496 HydrophobicContact CG-CE2 4.43Å; I347-Y496 HydrophobicContact CG2-CD2 4.23Å; I419-Y496 HydrophobicContact CD1-CD1 4.25Å; I419-Y496 HydrophobicContact CD1-CD2 3.77Å; I419-Y496 HydrophobicContact CD1-CE1 4.27Å; I419-Y496 HydrophobicContact CD1-CE2 3.8Å; I419-Y496 HydrophobicContact CD1-CG 4.01Å; I419-Y496 HydrophobicContact CG1-CD1 4.16Å; I419-Y496 HydrophobicContact CG1-CD2 4.27Å; I419-Y496 HydrophobicContact CG1-CE1 3.77Å; I419-Y496 HydrophobicContact CG1-CE2 3.9Å; I419-Y496 HydrophobicContact CG1-CG 4.4Å; L492-Y496 WeakPolarHBondContact O-CB 3.32Å; L492-Y496 PolarHBondContact O-N 3.09Å; L493-Y496 HydrophobicContact CD1-CD1 4.33Å; Y496-K498 VanDerWaalsContact C-N 3.32Å; Y496-K498 PolarHBondContact O-N 3.02Å; Y496-K499 PolarHBondContact O-N 3.24Å; Y496-L500 HydrophobicContact CD1-CD2 4.38Å; Y496-L500 HydrophobicContact CE1-CD1 4.04Å; Y496-L500 HydrophobicContact CE1-CD2 3.9Å; Y496-L500 HydrophobicContact CE1-CG 4.5Å; Y496-L500 WeakPolarHBondContact O-CB 3.27Å; Y496-L500 PolarHBondContact O-N 3.12Å; Y496-L500 VanDerWaalsContact O-N 3.16Å; Y496-D506 WeakPolarHBondContact CE1-OD2 3.32Å; Y496-D506 PolarHBondContact OH-OD2 3.24Å; Y496-A510 HydrophobicContact CD1-CB 4.35Å
497	L	88.4	Confident	83.1	Confident	31 Å²	31	63.1 Å²	63.1	16%	0.162	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-37.4	176.4	-77	168	0	0	0	113.3	L493 D495 K499 L500 R507 A510 E511 L514	L493-L497 WeakPolarHBondContact O-CB 3.46Å; L493-L497 VanDerWaalsContact O-CG 3.32Å; L493-L497 WeakPolarHBondContact O-CG 3.42Å; L493-L497 PolarHBondContact O-N 3.03Å; D495-L497 VanDerWaalsContact C-N 3.34Å; D495-L497 PolarHBondContact O-N 2.96Å; L497-K499 PolarHBondContact O-N 3.48Å; L497-L500 HydrophobicContact CD2-CD2 4.42Å; L497-L500 PolarHBondContact O-N 2.99Å; L497-R507 HydrophobicContact CD2-CB 4.49Å; L497-R507 HydrophobicContact CD2-CG 3.53Å; L497-A510 HydrophobicContact CD2-CB 3.6Å; L497-A510 HydrophobicContact CG-CB 4.07Å; L497-E511 HydrophobicContact CD1-CG 4.28Å; L497-E511 HydrophobicContact CD2-CG 3.92Å; L497-L514 HydrophobicContact CD1-CB 4.39Å; L497-L514 HydrophobicContact CD1-CD2 3.83Å
498	K	86.9	Confident	84.1	Confident	154 Å²	154	69.2 Å²	69.2	67%	0.67	34%	0.339	S	S	*	.	H	α-helix	trans	-68.9	-14.5	175.6	-70.9	170.3	-169	171.5	0	114.4	K494 D495 Y496	K494-K498 VanDerWaalsContact O-CG 3.3Å; K494-K498 WeakPolarHBondContact O-CG 3.12Å; K494-K498 PolarHBondContact O-N 2.9Å; D495-K498 WeakPolarHBondContact O-CB 3.24Å; D495-K498 PolarHBondContact O-N 3.32Å; D495-K498 VanDerWaalsContact O-N 3.1Å; Y496-K498 VanDerWaalsContact C-N 3.32Å; Y496-K498 PolarHBondContact O-N 3.02Å
499	K	84.6	Confident	84.9	Confident	76 Å²	76	65.9 Å²	65.9	33%	0.33	33%	0.33	S	S	.	.	H	α-helix	trans	-106.4	-2.7	176.4	-55.4	-51.4	173	-165.4	0	112.8	L344 I347 D495 Y496 L497	L344-K499 HydrophobicContact CD2-CB 3.72Å; L344-K499 HydrophobicContact CG-CB 4.06Å; I347-K499 HydrophobicContact CD1-CB 4.34Å; I347-K499 HydrophobicContact CD1-CG 3.69Å; D495-K499 PolarHBondContact O-N 2.93Å; Y496-K499 PolarHBondContact O-N 3.24Å; L497-K499 PolarHBondContact O-N 3.48Å
500	L	87.6	Confident	85.5	Confident	16 Å²	16	65.8 Å²	65.8	8%	0.084	33%	0.329	C	S	.	.	S	Bend	trans	-93.7	124.3	-172	-164.1	67.2	0	0	0	110.1	L344 Y496 L497 A504 D506 R507	L344-L500 HydrophobicContact CD1-CD1 3.91Å; L344-L500 HydrophobicContact CD2-CB 4.24Å; L344-L500 HydrophobicContact CD2-CD1 3.92Å; Y496-L500 HydrophobicContact CD1-CD2 4.38Å; Y496-L500 HydrophobicContact CE1-CD1 4.04Å; Y496-L500 HydrophobicContact CE1-CD2 3.9Å; Y496-L500 HydrophobicContact CE1-CG 4.5Å; Y496-L500 WeakPolarHBondContact O-CB 3.27Å; Y496-L500 PolarHBondContact O-N 3.12Å; Y496-L500 VanDerWaalsContact O-N 3.16Å; L497-L500 HydrophobicContact CD2-CD2 4.42Å; L497-L500 PolarHBondContact O-N 2.99Å; L500-A504 HydrophobicContact CD1-CB 4.04Å; L500-A504 HydrophobicContact CG-CB 3.89Å; L500-D506 HydrophobicContact CD2-CB 4.18Å; L500-R507 VanDerWaalsContact CD2-CA 3.48Å; L500-R507 HydrophobicContact CD2-CB 3.72Å; L500-R507 HydrophobicContact CD2-CG 4.05Å
501	P	85.3	Confident	86.2	Confident	57 Å²	57	68.7 Å²	68.7	37%	0.37	34%	0.343	S	S	.	.			trans	-56.1	153.7	-177.2	-29.4	36.2	0	0	0	115	D503 A504 R507	P501-D503 WeakPolarHBondContact CB-OD1 3.49Å; P501-D503 PolarHBondContact O-N 2.73Å; P501-A504 HydrophobicContact CB-CB 4.14Å; P501-A504 HydrophobicContact CG-CB 4.49Å; P501-A504 VanDerWaalsContact O-CB 3.31Å; P501-A504 WeakPolarHBondContact O-CB 3.43Å; P501-A504 PolarHBondContact O-N 3.11Å; P501-A504 VanDerWaalsContact O-N 3.1Å; P501-R507 PolarHBondContact O-NE 2.68Å; P501-R507 VanDerWaalsContact O-NE 3.13Å; P501-R507 PolarHBondContact O-NH2 3.14Å
502	D	80.9	Confident	87	Confident	146 Å²	146	67.9 Å²	67.9	78%	0.781	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-8.6	-176	-84	-48.8	0	0	0	115.4	R507	D502-R507 PolarHBondContact O-NH1 3.43Å; D502-R507 PolarHBondContact O-NH2 2.96Å; D502-R507 IonicContact OD1-CZ 2.69Å; D502-R507 IonicContact OD1-NH1 3.49Å
503	D	84	Confident	87.7	Confident	137 Å²	137	66.8 Å²	66.8	73%	0.733	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-16	170.5	63.3	-22.5	0	0	0	113.9	P501 L505	P501-D503 WeakPolarHBondContact CB-OD1 3.49Å; P501-D503 PolarHBondContact O-N 2.73Å; D503-L505 PolarHBondContact O-N 3.45Å
504	A	85.7	Confident	88	Confident	25 Å²	25	68 Å²	68	21%	0.207	34%	0.335	C	S	.	.			trans	-59.6	128.8	-172.5	0	0	0	0	0	114.2	L500 P501 D506 R507	L500-A504 HydrophobicContact CD1-CB 4.04Å; L500-A504 HydrophobicContact CG-CB 3.89Å; P501-A504 HydrophobicContact CB-CB 4.14Å; P501-A504 HydrophobicContact CG-CB 4.49Å; P501-A504 VanDerWaalsContact O-CB 3.31Å; P501-A504 WeakPolarHBondContact O-CB 3.43Å; P501-A504 PolarHBondContact O-N 3.11Å; P501-A504 VanDerWaalsContact O-N 3.1Å; A504-D506 VanDerWaalsContact C-N 3.26Å; A504-D506 PolarHBondContact O-N 2.8Å; A504-D506 VanDerWaalsContact O-N 3.17Å; A504-R507 PolarHBondContact O-N 2.78Å; A504-R507 PolarHBondContact O-NH2 3.47Å
505	L	84.3	Confident	88.5	Confident	151 Å²	151	70 Å²	70	79%	0.791	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-36.6	-177.2	-62.6	176.3	0	0	0	113.9	D503 R507	D503-L505 PolarHBondContact O-N 3.45Å; L505-R507 VanDerWaalsContact C-N 3.26Å; L505-R507 PolarHBondContact O-N 3.32Å
506	D	91.4	Very high	89	Confident	6 Å²	6	69 Å²	69	3%	0.032	34%	0.34	C	S	.	.	H	α-helix	trans	-73.5	-12.3	-173.4	-156.4	44.6	0	0	0	113.7	R418 I419 G420 D421 Y496 L500 A504 D509 A510	R418-D506 HydrophobicContact CB-CB 3.85Å; R418-D506 VanDerWaalsContact CB-CG 3.49Å; I419-D506 PolarHBondContact N-OD2 3.15Å; G420-D506 VanDerWaalsContact CA-OD1 3.25Å; G420-D506 WeakPolarHBondContact CA-OD1 3.27Å; G420-D506 VanDerWaalsContact N-CG 3.25Å; G420-D506 PolarHBondContact N-OD1 3.29Å; G420-D506 PolarHBondContact N-OD2 2.9Å; D421-D506 PolarHBondContact N-OD1 2.94Å; Y496-D506 WeakPolarHBondContact CE1-OD2 3.32Å; Y496-D506 PolarHBondContact OH-OD2 3.24Å; L500-D506 HydrophobicContact CD2-CB 4.18Å; A504-D506 VanDerWaalsContact C-N 3.26Å; A504-D506 PolarHBondContact O-N 2.8Å; A504-D506 VanDerWaalsContact O-N 3.17Å; D506-D509 PolarHBondContact O-N 2.87Å; D506-D509 VanDerWaalsContact O-N 3.17Å; D506-A510 VanDerWaalsContact O-CB 3.31Å; D506-A510 WeakPolarHBondContact O-CB 3.26Å; D506-A510 PolarHBondContact O-N 3.22Å
507	R	91.8	Very high	89	Confident	45 Å²	45	68.9 Å²	68.9	17%	0.17	34%	0.339	C	S	.	.	H	α-helix	trans	-66	-45.6	-172.8	-158.2	-170.1	-37.7	104.8	51	112.2	L497 L500 P501 D502 A504 L505 D509 A510 E511	L497-R507 HydrophobicContact CD2-CB 4.49Å; L497-R507 HydrophobicContact CD2-CG 3.53Å; L500-R507 VanDerWaalsContact CD2-CA 3.48Å; L500-R507 HydrophobicContact CD2-CB 3.72Å; L500-R507 HydrophobicContact CD2-CG 4.05Å; P501-R507 PolarHBondContact O-NE 2.68Å; P501-R507 VanDerWaalsContact O-NE 3.13Å; P501-R507 PolarHBondContact O-NH2 3.14Å; D502-R507 PolarHBondContact O-NH1 3.43Å; D502-R507 PolarHBondContact O-NH2 2.96Å; D502-R507 IonicContact OD1-CZ 2.69Å; D502-R507 IonicContact OD1-NH1 3.49Å; A504-R507 PolarHBondContact O-N 2.78Å; A504-R507 PolarHBondContact O-NH2 3.47Å; L505-R507 VanDerWaalsContact C-N 3.26Å; L505-R507 PolarHBondContact O-N 3.32Å; R507-D509 PolarHBondContact O-N 3.02Å; R507-A510 PolarHBondContact O-N 3.01Å; R507-E511 WeakPolarHBondContact CD-OE1 3.36Å; R507-E511 HydrophobicContact CG-CG 4.31Å; R507-E511 WeakPolarHBondContact CG-OE1 3.42Å; R507-E511 WeakPolarHBondContact O-CB 3.19Å; R507-E511 WeakPolarHBondContact O-CG 3.26Å; R507-E511 PolarHBondContact O-N 2.83Å
508	K	92.5	Very high	88.7	Confident	164 Å²	164	68.7 Å²	68.7	71%	0.713	34%	0.341	S	S	*	.	H	α-helix	trans	-59.8	-34.9	175.6	-65.3	-178.5	-179.2	177.2	0	111.7	K512	K508-K512 WeakPolarHBondContact O-CB 3.49Å; K508-K512 PolarHBondContact O-N 3.14Å
509	D	94.7	Very high	88.3	Confident	48 Å²	48	64.6 Å²	64.6	26%	0.257	33%	0.329	S	S	.	.	H	α-helix	trans	-75.6	-41.5	179	-73.7	-28.7	0	0	0	111.9	Q424 D506 R507 A513	Q424-D509 VanDerWaalsContact NE2-CA 3.31Å; Q424-D509 PolarHBondContact NE2-OD1 3.3Å; D506-D509 PolarHBondContact O-N 2.87Å; D506-D509 VanDerWaalsContact O-N 3.17Å; R507-D509 PolarHBondContact O-N 3.02Å; D509-A513 VanDerWaalsContact O-CB 3.28Å; D509-A513 WeakPolarHBondContact O-CB 3.27Å; D509-A513 PolarHBondContact O-N 3.12Å
510	A	93.5	Very high	87.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-37.8	175.1	0	0	0	0	0	113.6	L493 Y496 L497 D506 R507 A513 L514	L493-A510 HydrophobicContact CD1-CB 3.78Å; Y496-A510 HydrophobicContact CD1-CB 4.35Å; L497-A510 HydrophobicContact CD2-CB 3.6Å; L497-A510 HydrophobicContact CG-CB 4.07Å; D506-A510 VanDerWaalsContact O-CB 3.31Å; D506-A510 WeakPolarHBondContact O-CB 3.26Å; D506-A510 PolarHBondContact O-N 3.22Å; R507-A510 PolarHBondContact O-N 3.01Å; A510-A513 PolarHBondContact O-N 3.17Å; A510-L514 WeakPolarHBondContact O-CB 3.24Å; A510-L514 PolarHBondContact O-N 3.1Å
511	E	93.6	Very high	86.8	Confident	96 Å²	96	60.7 Å²	60.7	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-49	173.2	-76.6	163.9	175	0	0	111	L497 R507 L514 E515	L497-E511 HydrophobicContact CD1-CG 4.28Å; L497-E511 HydrophobicContact CD2-CG 3.92Å; R507-E511 WeakPolarHBondContact CD-OE1 3.36Å; R507-E511 HydrophobicContact CG-CG 4.31Å; R507-E511 WeakPolarHBondContact CG-OE1 3.42Å; R507-E511 WeakPolarHBondContact O-CB 3.19Å; R507-E511 WeakPolarHBondContact O-CG 3.26Å; R507-E511 PolarHBondContact O-N 2.83Å; E511-L514 WeakPolarHBondContact O-CB 3.49Å; E511-L514 PolarHBondContact O-N 3.41Å; E511-L514 VanDerWaalsContact O-N 3.13Å; E511-E515 PolarHBondContact O-N 3.29Å
512	K	93.4	Very high	85.8	Confident	102 Å²	102	62.1 Å²	62.1	44%	0.443	32%	0.317	S	S	.	.	H	α-helix	trans	-69.5	-32.5	178	-176.5	173.1	160.1	-150.2	0	112.4	Q424 K508 L514 L516	Q424-K512 HydrophobicContact CG-CB 4.39Å; Q424-K512 HydrophobicContact CG-CD 4.24Å; Q424-K512 HydrophobicContact CG-CG 4.06Å; K508-K512 WeakPolarHBondContact O-CB 3.49Å; K508-K512 PolarHBondContact O-N 3.14Å; K512-L514 VanDerWaalsContact C-N 3.35Å; K512-L516 WeakPolarHBondContact O-CD1 3.45Å; K512-L516 VanDerWaalsContact O-CG 3.26Å; K512-L516 WeakPolarHBondContact O-CG 3.12Å; K512-L516 PolarHBondContact O-N 3.41Å; K512-L516 VanDerWaalsContact O-N 3.14Å
513	A	93.8	Very high	84.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.1	-42.1	168.3	0	0	0	0	0	111.3	L423 Q424 L493 D509 A510 L516 I517	L423-A513 HydrophobicContact CB-CB 3.87Å; Q424-A513 HydrophobicContact CB-CB 4.05Å; L493-A513 HydrophobicContact CD2-CB 3.81Å; D509-A513 VanDerWaalsContact O-CB 3.28Å; D509-A513 WeakPolarHBondContact O-CB 3.27Å; D509-A513 PolarHBondContact O-N 3.12Å; A510-A513 PolarHBondContact O-N 3.17Å; A513-L516 PolarHBondContact O-N 2.86Å; A513-I517 WeakPolarHBondContact O-CB 3.3Å; A513-I517 WeakPolarHBondContact O-CD1 3.42Å; A513-I517 WeakPolarHBondContact O-CG1 3.08Å; A513-I517 PolarHBondContact O-N 3.46Å
514	L	89.8	Confident	83.5	Confident	29 Å²	29	56.6 Å²	56.6	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-64.5	-42	177.9	-177.2	65.9	0	0	0	112	E490 L493 K494 L497 A510 E511 K512 I517 S518	E490-L514 HydrophobicContact CB-CD1 4.37Å; E490-L514 HydrophobicContact CG-CD1 3.56Å; L493-L514 HydrophobicContact CB-CD1 4.31Å; L493-L514 HydrophobicContact CD2-CB 3.82Å; L493-L514 HydrophobicContact CD2-CD1 4.33Å; L493-L514 HydrophobicContact CG-CB 4.2Å; L493-L514 HydrophobicContact CG-CD1 4.42Å; K494-L514 HydrophobicContact CG-CD1 3.92Å; K494-L514 HydrophobicContact CG-CD2 3.66Å; K494-L514 HydrophobicContact CG-CG 4.46Å; L497-L514 HydrophobicContact CD1-CB 4.39Å; L497-L514 HydrophobicContact CD1-CD2 3.83Å; A510-L514 WeakPolarHBondContact O-CB 3.24Å; A510-L514 PolarHBondContact O-N 3.1Å; E511-L514 WeakPolarHBondContact O-CB 3.49Å; E511-L514 PolarHBondContact O-N 3.41Å; E511-L514 VanDerWaalsContact O-N 3.13Å; K512-L514 VanDerWaalsContact C-N 3.35Å; L514-I517 PolarHBondContact O-N 3.02Å; L514-S518 VanDerWaalsContact O-CB 3.27Å; L514-S518 WeakPolarHBondContact O-CB 3.47Å; L514-S518 PolarHBondContact O-N 3.48Å
515	E	90.8	Very high	81.8	Confident	127 Å²	127	57.9 Å²	57.9	59%	0.593	29%	0.287	S	S	*	.	H	α-helix	trans	-57.7	-48.1	173.2	-170.3	-159.8	163.3	0	0	111.4	E511 T519	E511-E515 PolarHBondContact O-N 3.29Å; E515-T519 VanDerWaalsContact O-CB 3.3Å; E515-T519 WeakPolarHBondContact O-CB 3.4Å; E515-T519 PolarHBondContact O-N 3.36Å; E515-T519 PolarHBondContact O-OG1 2.79Å
516	L	89.3	Confident	80.4	Confident	37 Å²	37	54.7 Å²	54.7	19%	0.194	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-41.1	179.9	-71.1	167.6	0	0	0	112.5	Q424 A427 P428 K512 A513 T519 A520	Q424-L516 HydrophobicContact CG-CD1 4.28Å; A427-L516 HydrophobicContact CB-CB 3.69Å; A427-L516 HydrophobicContact CB-CD1 4.3Å; P428-L516 HydrophobicContact CG-CD1 4.24Å; K512-L516 WeakPolarHBondContact O-CD1 3.45Å; K512-L516 VanDerWaalsContact O-CG 3.26Å; K512-L516 WeakPolarHBondContact O-CG 3.12Å; K512-L516 PolarHBondContact O-N 3.41Å; K512-L516 VanDerWaalsContact O-N 3.14Å; A513-L516 PolarHBondContact O-N 2.86Å; L516-T519 PolarHBondContact O-N 3.3Å; L516-A520 PolarHBondContact O-N 3.18Å; L516-A520 VanDerWaalsContact O-N 3.08Å
517	I	86.2	Confident	78.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-47.3	177.7	-70.8	164	0	0	0	110.4	A427 M430 E490 L493 A513 L514 T519 A520 A521	A427-I517 HydrophobicContact CB-CD1 4.35Å; A427-I517 HydrophobicContact CB-CG1 3.77Å; M430-I517 HydrophobicContact SD-CD1 4.49Å; M430-I517 HydrophobicContact SD-CG1 3.92Å; E490-I517 HydrophobicContact CB-CG2 4.21Å; L493-I517 HydrophobicContact CD2-CD1 3.79Å; A513-I517 WeakPolarHBondContact O-CB 3.3Å; A513-I517 WeakPolarHBondContact O-CD1 3.42Å; A513-I517 WeakPolarHBondContact O-CG1 3.08Å; A513-I517 PolarHBondContact O-N 3.46Å; L514-I517 PolarHBondContact O-N 3.02Å; I517-T519 VanDerWaalsContact C-N 3.27Å; I517-T519 PolarHBondContact O-N 3.39Å; I517-A520 WeakPolarHBondContact O-CB 3.23Å; I517-A520 PolarHBondContact O-N 2.95Å; I517-A520 VanDerWaalsContact O-N 3.09Å; I517-A521 PolarHBondContact O-N 2.64Å
518	S	81.8	Confident	76.8	Confident	27 Å²	27	54.5 Å²	54.5	19%	0.189	29%	0.287	C	S	.	.	H	α-helix	trans	-65.9	-31.5	177.2	-162.1	0	0	0	0	111.6	E490 L514 A521 N522	E490-S518 WeakPolarHBondContact OE2-CB 3.25Å; E490-S518 PolarHBondContact OE2-OG 2.88Å; E490-S518 VanDerWaalsContact OE2-OG 3.08Å; L514-S518 VanDerWaalsContact O-CB 3.27Å; L514-S518 WeakPolarHBondContact O-CB 3.47Å; L514-S518 PolarHBondContact O-N 3.48Å; S518-A521 PolarHBondContact O-N 2.78Å; S518-N522 VanDerWaalsContact O-CB 3.3Å; S518-N522 WeakPolarHBondContact O-CB 3.39Å; S518-N522 PolarHBondContact O-N 3.19Å; S518-N522 PolarHBondContact O-ND2 2.94Å; S518-N522 PolarHBondContact OG-ND2 3.02Å
519	T	80.2	Confident	75.3	Confident	68 Å²	68	54.5 Å²	54.5	42%	0.417	28%	0.283	S	S	.	.	H	α-helix	trans	-64	-41.3	170.3	-61.7	0	0	0	0	112	E515 L516 I517 N522 H523	E515-T519 VanDerWaalsContact O-CB 3.3Å; E515-T519 WeakPolarHBondContact O-CB 3.4Å; E515-T519 PolarHBondContact O-N 3.36Å; E515-T519 PolarHBondContact O-OG1 2.79Å; L516-T519 PolarHBondContact O-N 3.3Å; I517-T519 VanDerWaalsContact C-N 3.27Å; I517-T519 PolarHBondContact O-N 3.39Å; T519-N522 PolarHBondContact O-N 2.91Å; T519-H523 PolarHBondContact O-N 2.83Å
520	A	72.4	Confident	73.4	Confident	5 Å²	5	55.7 Å²	55.7	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-68.4	-36.4	175.6	0	0	0	0	0	112.6	M430 K431 L516 I517 S524	M430-A520 HydrophobicContact CB-CB 4.37Å; K431-A520 HydrophobicContact CG-CB 4.38Å; L516-A520 PolarHBondContact O-N 3.18Å; L516-A520 VanDerWaalsContact O-N 3.08Å; I517-A520 WeakPolarHBondContact O-CB 3.23Å; I517-A520 PolarHBondContact O-N 2.95Å; I517-A520 VanDerWaalsContact O-N 3.09Å; A520-S524 PolarHBondContact O-OG 3Å
521	A	66.8	Low	71.7	Confident	5 Å²	5	56.3 Å²	56.3	4%	0.041	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-50.2	170.1	0	0	0	0	0	111.1	I486 I517 S518 H523 S524 N525 I528	I486-A521 HydrophobicContact CG2-CB 3.92Å; I517-A521 PolarHBondContact O-N 2.64Å; S518-A521 PolarHBondContact O-N 2.78Å; A521-H523 VanDerWaalsContact C-N 3.34Å; A521-H523 PolarHBondContact O-N 3.18Å; A521-S524 CarbonylContact O-C 3.52Å; A521-S524 VanDerWaalsContact O-CA 3.29Å; A521-S524 WeakPolarHBondContact O-CA 3.24Å; A521-S524 WeakPolarHBondContact O-CB 3.41Å; A521-S524 PolarHBondContact O-N 3.38Å; A521-N525 PolarHBondContact O-N 3.3Å; A521-I528 HydrophobicContact CB-CD1 4.06Å; A521-I528 WeakPolarHBondContact O-CD1 3.32Å
522	N	64.4	Low	70.3	Confident	86 Å²	86	57.3 Å²	57.3	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-63.6	-35.7	-177.8	-83.6	-69.7	0	0	0	113.3	S518 T519 S524 N525	S518-N522 VanDerWaalsContact O-CB 3.3Å; S518-N522 WeakPolarHBondContact O-CB 3.39Å; S518-N522 PolarHBondContact O-N 3.19Å; S518-N522 PolarHBondContact O-ND2 2.94Å; S518-N522 PolarHBondContact OG-ND2 3.02Å; T519-N522 PolarHBondContact O-N 2.91Å; N522-S524 PolarHBondContact O-N 3.39Å; N522-S524 VanDerWaalsContact O-N 3.14Å; N522-N525 WeakPolarHBondContact CA-ND2 3.25Å; N522-N525 VanDerWaalsContact O-CB 3.24Å; N522-N525 WeakPolarHBondContact O-CB 3.41Å; N522-N525 PolarHBondContact O-N 3.44Å; N522-N525 VanDerWaalsContact O-N 3.14Å; N522-N525 PolarHBondContact O-ND2 2.92Å; N522-N525 PolarHBondContact OD1-ND2 3.36Å
523	H	58.3	Low	68.9	Low	158 Å²	158	55.8 Å²	55.8	73%	0.731	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-12.4	171.1	-168.9	-80.4	0	0	0	113.2	T519 A521	T519-H523 PolarHBondContact O-N 2.83Å; A521-H523 VanDerWaalsContact C-N 3.34Å; A521-H523 PolarHBondContact O-N 3.18Å
524	S	58.8	Low	67.4	Low	10 Å²	10	56.4 Å²	56.4	7%	0.07	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	1.6	177.6	-52.9	0	0	0	0	113.3	A520 A521 N522 A526 A527 I528	A520-S524 PolarHBondContact O-OG 3Å; A521-S524 CarbonylContact O-C 3.52Å; A521-S524 VanDerWaalsContact O-CA 3.29Å; A521-S524 WeakPolarHBondContact O-CA 3.24Å; A521-S524 WeakPolarHBondContact O-CB 3.41Å; A521-S524 PolarHBondContact O-N 3.38Å; N522-S524 PolarHBondContact O-N 3.39Å; N522-S524 VanDerWaalsContact O-N 3.14Å; S524-A526 VanDerWaalsContact C-N 3.3Å; S524-A526 PolarHBondContact O-N 3.43Å; S524-A527 PolarHBondContact O-N 3.3Å; S524-I528 PolarHBondContact O-N 2.84Å
525	N	51.2	Low	66.2	Low	52 Å²	52	58.3 Å²	58.3	28%	0.278	30%	0.3	S	S	.	.	H	α-helix	trans	-55.3	-29	-162.9	-90.8	-17.8	0	0	0	117.2	A521 N522 A527 I528 R529	A521-N525 PolarHBondContact O-N 3.3Å; N522-N525 WeakPolarHBondContact CA-ND2 3.25Å; N522-N525 VanDerWaalsContact O-CB 3.24Å; N522-N525 WeakPolarHBondContact O-CB 3.41Å; N522-N525 PolarHBondContact O-N 3.44Å; N522-N525 VanDerWaalsContact O-N 3.14Å; N522-N525 PolarHBondContact O-ND2 2.92Å; N522-N525 PolarHBondContact OD1-ND2 3.36Å; N525-A527 VanDerWaalsContact C-N 3.29Å; N525-A527 PolarHBondContact O-N 2.63Å; N525-I528 PolarHBondContact O-N 2.94Å; N525-R529 PolarHBondContact O-N 3.26Å; N525-R529 VanDerWaalsContact O-N 3.12Å
526	A	53.3	Low	65.3	Low	84 Å²	84	55.5 Å²	55.5	69%	0.694	29%	0.286	S	S	*	.	H	α-helix	trans	-62.5	-38.1	177.4	0	0	0	0	0	112	S524	S524-A526 VanDerWaalsContact C-N 3.3Å; S524-A526 PolarHBondContact O-N 3.43Å
527	A	52	Low	64.5	Low	20 Å²	20	53.9 Å²	53.9	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-86.1	-19.4	172.4	0	0	0	0	0	112.9	V437 S524 N525 R529 K530 M531	V437-A527 HydrophobicContact CG1-CB 3.28Å; S524-A527 PolarHBondContact O-N 3.3Å; N525-A527 VanDerWaalsContact C-N 3.29Å; N525-A527 PolarHBondContact O-N 2.63Å; A527-R529 VanDerWaalsContact C-N 3.32Å; A527-K530 CarbonylContact O-C 3.54Å; A527-K530 WeakPolarHBondContact O-CA 3.46Å; A527-K530 WeakPolarHBondContact O-CB 3.38Å; A527-K530 PolarHBondContact O-N 2.83Å; A527-K530 VanDerWaalsContact O-N 3.1Å; A527-M531 WeakPolarHBondContact O-CB 3.17Å; A527-M531 PolarHBondContact O-N 3.32Å
528	I	55.6	Low	63.5	Low	27 Å²	27	55.2 Å²	55.2	14%	0.138	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-42.5	170.4	-60.9	-167.7	0	0	0	110.2	A521 S524 N525 K530 M531 E532	A521-I528 HydrophobicContact CB-CD1 4.06Å; A521-I528 WeakPolarHBondContact O-CD1 3.32Å; S524-I528 PolarHBondContact O-N 2.84Å; N525-I528 PolarHBondContact O-N 2.94Å; I528-K530 VanDerWaalsContact C-N 3.26Å; I528-K530 PolarHBondContact O-N 3.15Å; I528-M531 HydrophobicContact CB-CE 4.21Å; I528-M531 HydrophobicContact CD1-CE 4.44Å; I528-M531 HydrophobicContact CG1-CE 3.88Å; I528-M531 HydrophobicContact CG2-CE 4.01Å; I528-M531 CarbonylContact O-C 3.57Å; I528-M531 WeakPolarHBondContact O-CA 3.2Å; I528-M531 WeakPolarHBondContact O-CB 3.38Å; I528-M531 PolarHBondContact O-N 3.24Å; I528-E532 HydrophobicContact CG2-CG 4.5Å; I528-E532 WeakPolarHBondContact O-CG 3.23Å; I528-E532 PolarHBondContact O-N 2.87Å
529	R	61.5	Low	63.2	Low	164 Å²	164	57.5 Å²	57.5	62%	0.619	29%	0.292	S	S	*	.	H	α-helix	trans	-61.4	-31.9	171.3	-72.3	-175	-77	-103.6	5.3	113.8	N525 A527 E532 K533	N525-R529 PolarHBondContact O-N 3.26Å; N525-R529 VanDerWaalsContact O-N 3.12Å; A527-R529 VanDerWaalsContact C-N 3.32Å; R529-E532 WeakPolarHBondContact CA-OE2 3.44Å; R529-K533 PolarHBondContact O-N 2.93Å
530	K	55.5	Low	63.1	Low	72 Å²	72	54.2 Å²	54.2	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-74.5	-30.1	172.4	-157.4	174.8	-172.6	-178.8	0	112.2	D441 A527 I528 M534	D441-K530 IonicContact OD1-NZ 2.74Å; D441-K530 PolarHBondContact OD1-NZ 3.02Å; D441-K530 IonicContact OD2-NZ 2.6Å; D441-K530 PolarHBondContact OD2-NZ 2.69Å; A527-K530 CarbonylContact O-C 3.54Å; A527-K530 WeakPolarHBondContact O-CA 3.46Å; A527-K530 WeakPolarHBondContact O-CB 3.38Å; A527-K530 PolarHBondContact O-N 2.83Å; A527-K530 VanDerWaalsContact O-N 3.1Å; I528-K530 VanDerWaalsContact C-N 3.26Å; I528-K530 PolarHBondContact O-N 3.15Å; K530-M534 WeakPolarHBondContact O-CB 3.17Å; K530-M534 PolarHBondContact O-N 2.87Å
531	M	58	Low	63	Low	13 Å²	13	57 Å²	57	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-76.9	-34.2	175.1	174.7	173.9	55.8	0	0	112.2	V483 Q484 P487 A527 I528 K533 M534 N535	V483-M531 HydrophobicContact CB-SD 4.42Å; V483-M531 HydrophobicContact CG1-CB 4.49Å; V483-M531 HydrophobicContact CG1-CE 4.34Å; V483-M531 HydrophobicContact CG1-SD 3.86Å; Q484-M531 HydrophobicContact CB-SD 4.47Å; Q484-M531 HydrophobicContact CG-SD 4.1Å; P487-M531 HydrophobicContact CG-CE 3.45Å; P487-M531 VanDerWaalsContact CG-CE 3.45Å; P487-M531 HydrophobicContact CG-SD 4.27Å; A527-M531 WeakPolarHBondContact O-CB 3.17Å; A527-M531 PolarHBondContact O-N 3.32Å; I528-M531 HydrophobicContact CB-CE 4.21Å; I528-M531 HydrophobicContact CD1-CE 4.44Å; I528-M531 HydrophobicContact CG1-CE 3.88Å; I528-M531 HydrophobicContact CG2-CE 4.01Å; I528-M531 CarbonylContact O-C 3.57Å; I528-M531 WeakPolarHBondContact O-CA 3.2Å; I528-M531 WeakPolarHBondContact O-CB 3.38Å; I528-M531 PolarHBondContact O-N 3.24Å; M531-K533 VanDerWaalsContact C-N 3.34Å; M531-M534 CarbonylContact O-C 3.55Å; M531-M534 PolarHBondContact O-N 3.2Å; M531-N535 WeakPolarHBondContact O-CB 3.38Å; M531-N535 PolarHBondContact O-N 2.88Å; M531-N535 PolarHBondContact O-ND2 2.62Å; M531-N535 PolarHBondContact O-OD1 3.31Å
532	E	62.9	Low	63.2	Low	118 Å²	118	62.8 Å²	62.8	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-60	-48.1	170.8	-71.9	164.6	164.8	0	0	109.9	I528 R529 M534 N535 K536	I528-E532 HydrophobicContact CG2-CG 4.5Å; I528-E532 WeakPolarHBondContact O-CG 3.23Å; I528-E532 PolarHBondContact O-N 2.87Å; R529-E532 WeakPolarHBondContact CA-OE2 3.44Å; E532-M534 PolarHBondContact O-N 3.37Å; E532-N535 PolarHBondContact O-N 3.14Å; E532-K536 PolarHBondContact O-N 2.98Å
533	K	63.7	Low	63.8	Low	70 Å²	70	61.9 Å²	61.9	30%	0.304	30%	0.298	S	S	.	.	H	α-helix	trans	-58.9	-42.7	171.6	174.1	171.3	165.7	172.5	0	112.6	R529 M531 K536 L537 N555 E556	R529-K533 PolarHBondContact O-N 2.93Å; M531-K533 VanDerWaalsContact C-N 3.34Å; K533-K536 PolarHBondContact O-N 3.37Å; K533-L537 WeakPolarHBondContact O-CD1 3.42Å; K533-L537 PolarHBondContact O-N 3.45Å; K533-L537 VanDerWaalsContact O-N 3.11Å; K533-N555 WeakPolarHBondContact CE-O 3.19Å; K533-E556 HydrophobicContact CD-CG 4.26Å; K533-E556 IonicContact NZ-OE1 3.65Å; K533-E556 PolarHBondContact NZ-OE1 2.9Å
534	M	62.9	Low	64.6	Low	12 Å²	12	54.4 Å²	54.4	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-69.3	-37.9	175.8	-174.5	60.4	74.5	0	0	112.8	L480 K530 M531 E532 K536 L537 L538 V551 P553	L480-M534 HydrophobicContact CD1-CE 4.16Å; L480-M534 HydrophobicContact CD1-CG 3.77Å; L480-M534 HydrophobicContact CD1-SD 3.98Å; L480-M534 HydrophobicContact CD2-CE 4.44Å; L480-M534 HydrophobicContact CD2-CG 4.13Å; K530-M534 WeakPolarHBondContact O-CB 3.17Å; K530-M534 PolarHBondContact O-N 2.87Å; M531-M534 CarbonylContact O-C 3.55Å; M531-M534 PolarHBondContact O-N 3.2Å; E532-M534 PolarHBondContact O-N 3.37Å; M534-K536 VanDerWaalsContact C-N 3.3Å; M534-K536 PolarHBondContact O-N 3.4Å; M534-L537 CarbonylContact O-C 3.58Å; M534-L537 WeakPolarHBondContact O-CA 3.44Å; M534-L537 VanDerWaalsContact O-CB 3.3Å; M534-L537 WeakPolarHBondContact O-CB 3.39Å; M534-L537 PolarHBondContact O-N 2.87Å; M534-L537 VanDerWaalsContact O-N 3.15Å; M534-L537 HydrophobicContact SD-CB 4.38Å; M534-L537 HydrophobicContact SD-CD2 4.31Å; M534-L538 HydrophobicContact CG-CD1 4.33Å; M534-L538 WeakPolarHBondContact O-CG 3.18Å; M534-L538 PolarHBondContact O-N 3.19Å; M534-V551 HydrophobicContact SD-CG1 3.78Å; M534-P553 HydrophobicContact CE-CB 4.12Å; M534-P553 HydrophobicContact CE-CG 3.86Å
535	N	63.9	Low	64.8	Low	69 Å²	69	55.3 Å²	55.3	37%	0.369	27%	0.274	S	S	.	.	H	α-helix	trans	-66.8	-35.4	176.7	-71.9	-10.9	0	0	0	110.1	M531 E532 L538 E539	M531-N535 WeakPolarHBondContact O-CB 3.38Å; M531-N535 PolarHBondContact O-N 2.88Å; M531-N535 PolarHBondContact O-ND2 2.62Å; M531-N535 PolarHBondContact O-OD1 3.31Å; E532-N535 PolarHBondContact O-N 3.14Å; N535-L538 PolarHBondContact O-N 3.47Å; N535-E539 WeakPolarHBondContact O-CB 3.31Å; N535-E539 PolarHBondContact O-N 3.23Å
536	K	72.6	Confident	65.2	Low	69 Å²	69	54.1 Å²	54.1	30%	0.3	27%	0.274	S	S	.	.	H	α-helix	trans	-65.2	-39.5	170.2	-169.4	66.3	-172.6	170.8	0	112.1	E532 K533 M534 E539 V540 L557 E560	E532-K536 PolarHBondContact O-N 2.98Å; K533-K536 PolarHBondContact O-N 3.37Å; M534-K536 VanDerWaalsContact C-N 3.3Å; M534-K536 PolarHBondContact O-N 3.4Å; K536-E539 WeakPolarHBondContact CD-OE2 3.16Å; K536-E539 WeakPolarHBondContact CE-OE2 3.38Å; K536-E539 IonicContact NZ-OE2 3.67Å; K536-E539 PolarHBondContact NZ-OE2 2.99Å; K536-E539 PolarHBondContact O-N 3.27Å; K536-V540 WeakPolarHBondContact O-CG2 3.47Å; K536-V540 PolarHBondContact O-N 2.71Å; K536-L557 HydrophobicContact CD-CD2 4.29Å; K536-L557 HydrophobicContact CG-CD2 3.71Å; K536-E560 WeakPolarHBondContact CE-OE1 3.31Å; K536-E560 IonicContact NZ-OE1 3.31Å; K536-E560 PolarHBondContact NZ-OE1 2.89Å; K536-E560 IonicContact NZ-OE2 3.72Å
537	L	73.1	Confident	64.8	Low	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-39.8	170.3	-98.1	56.6	0	0	0	112.5	K533 M534 V540 Y541 I550 N555 L557 F581	K533-L537 WeakPolarHBondContact O-CD1 3.42Å; K533-L537 PolarHBondContact O-N 3.45Å; K533-L537 VanDerWaalsContact O-N 3.11Å; M534-L537 CarbonylContact O-C 3.58Å; M534-L537 WeakPolarHBondContact O-CA 3.44Å; M534-L537 VanDerWaalsContact O-CB 3.3Å; M534-L537 WeakPolarHBondContact O-CB 3.39Å; M534-L537 PolarHBondContact O-N 2.87Å; M534-L537 VanDerWaalsContact O-N 3.15Å; M534-L537 HydrophobicContact SD-CB 4.38Å; M534-L537 HydrophobicContact SD-CD2 4.31Å; L537-V540 PolarHBondContact O-N 3.48Å; L537-Y541 WeakPolarHBondContact O-CB 3.36Å; L537-Y541 PolarHBondContact O-N 3.1Å; L537-I550 WeakPolarHBondContact O-CD1 3.39Å; L537-N555 HydrophobicContact CD2-CB 3.78Å; L537-L557 HydrophobicContact CD1-CB 4.18Å; L537-F581 HydrophobicContact CD1-CD1 4.41Å; L537-F581 HydrophobicContact CD1-CE1 3.92Å; L537-F581 HydrophobicContact CG-CE1 4.15Å
538	L	65.1	Low	65.1	Low	28 Å²	28	57.2 Å²	57.2	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-70.4	-38.2	177.4	-72.3	169.2	0	0	0	112.3	M534 N535 V540 Y541 E542 V551	M534-L538 HydrophobicContact CG-CD1 4.33Å; M534-L538 WeakPolarHBondContact O-CG 3.18Å; M534-L538 PolarHBondContact O-N 3.19Å; N535-L538 PolarHBondContact O-N 3.47Å; L538-V540 VanDerWaalsContact C-N 3.34Å; L538-Y541 WeakPolarHBondContact O-CB 3.3Å; L538-Y541 PolarHBondContact O-N 3.43Å; L538-E542 PolarHBondContact O-N 3.36Å; L538-V551 HydrophobicContact CD2-CG1 3.73Å; L538-V551 HydrophobicContact CD2-CG2 4.07Å; L538-V551 HydrophobicContact CG-CG1 4.39Å
539	E	74.7	Confident	65.4	Low	75 Å²	75	61.7 Å²	61.7	35%	0.35	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-46.2	171.3	-170.5	-163.1	-162.9	0	0	110.3	N535 K536 Y541 E542 R543	N535-E539 WeakPolarHBondContact O-CB 3.31Å; N535-E539 PolarHBondContact O-N 3.23Å; K536-E539 WeakPolarHBondContact CD-OE2 3.16Å; K536-E539 WeakPolarHBondContact CE-OE2 3.38Å; K536-E539 IonicContact NZ-OE2 3.67Å; K536-E539 PolarHBondContact NZ-OE2 2.99Å; K536-E539 PolarHBondContact O-N 3.27Å; E539-Y541 VanDerWaalsContact C-N 3.35Å; E539-Y541 PolarHBondContact O-N 2.71Å; E539-E542 PolarHBondContact O-N 3.21Å; E539-R543 VanDerWaalsContact CD-NH2 3.25Å; E539-R543 WeakPolarHBondContact O-CB 3.44Å; E539-R543 WeakPolarHBondContact O-CG 3.42Å; E539-R543 PolarHBondContact O-N 3.19Å; E539-R543 IonicContact OE1-CZ 2.72Å; E539-R543 VanDerWaalsContact OE1-CZ 3.28Å; E539-R543 IonicContact OE1-NE 2.74Å; E539-R543 PolarHBondContact OE1-NE 3.26Å; E539-R543 IonicContact OE1-NH2 3.68Å; E539-R543 PolarHBondContact OE1-NH2 2.86Å; E539-R543 IonicContact OE2-CZ 3.69Å; E539-R543 IonicContact OE2-NE 3.45Å; E539-R543 IonicContact OE2-NH2 3.68Å; E539-R543 PolarHBondContact OE2-NH2 3.42Å
540	V	79.6	Confident	65.8	Low	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-39.9	174.1	177.2	0	0	0	0	111.4	K536 L537 L538 E542 R543 L544 I550 L557 Y579 F581	K536-V540 WeakPolarHBondContact O-CG2 3.47Å; K536-V540 PolarHBondContact O-N 2.71Å; L537-V540 PolarHBondContact O-N 3.48Å; L538-V540 VanDerWaalsContact C-N 3.34Å; V540-E542 VanDerWaalsContact C-N 3.35Å; V540-E542 PolarHBondContact O-N 3.48Å; V540-R543 PolarHBondContact O-N 2.82Å; V540-L544 HydrophobicContact CG1-CD1 3.89Å; V540-L544 HydrophobicContact CG1-CG 4.15Å; V540-L544 VanDerWaalsContact O-CB 3.32Å; V540-L544 WeakPolarHBondContact O-CB 3.49Å; V540-L544 VanDerWaalsContact O-CG 3.23Å; V540-L544 WeakPolarHBondContact O-CG 3.49Å; V540-L544 PolarHBondContact O-N 3.15Å; V540-I550 HydrophobicContact CB-CD1 3.89Å; V540-I550 HydrophobicContact CG1-CD1 3.6Å; V540-L557 HydrophobicContact CG2-CD2 4Å; V540-Y579 HydrophobicContact CB-CD1 4.39Å; V540-Y579 HydrophobicContact CB-CE1 4.17Å; V540-Y579 HydrophobicContact CG1-CD1 3.57Å; V540-Y579 HydrophobicContact CG1-CD2 4.11Å; V540-Y579 HydrophobicContact CG1-CE1 3.52Å; V540-Y579 HydrophobicContact CG1-CE2 4.07Å; V540-Y579 HydrophobicContact CG1-CG 3.88Å; V540-Y579 HydrophobicContact CG2-CD1 3.8Å; V540-Y579 HydrophobicContact CG2-CE1 3.6Å; V540-F581 HydrophobicContact CG1-CZ 4.14Å
541	Y	70.1	Confident	65.7	Low	63 Å²	63	51.3 Å²	51.3	25%	0.247	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-41.1	177.4	176.5	-104.9	0	0	0	111.8	L537 L538 E539 L544 G545 G546 E548 I550 V551	L537-Y541 WeakPolarHBondContact O-CB 3.36Å; L537-Y541 PolarHBondContact O-N 3.1Å; L538-Y541 WeakPolarHBondContact O-CB 3.3Å; L538-Y541 PolarHBondContact O-N 3.43Å; E539-Y541 VanDerWaalsContact C-N 3.35Å; E539-Y541 PolarHBondContact O-N 2.71Å; Y541-L544 CarbonylContact O-C 3.51Å; Y541-L544 PolarHBondContact O-N 3.05Å; Y541-G545 PolarHBondContact O-N 3.24Å; Y541-G546 VanDerWaalsContact CZ-CA 3.47Å; Y541-G546 PolarHBondContact O-N 3.08Å; Y541-G546 PolarHBondContact OH-O 3.07Å; Y541-E548 VanDerWaalsContact CD2-O 3.24Å; Y541-E548 WeakPolarHBondContact CD2-O 3.35Å; Y541-E548 VanDerWaalsContact CE2-O 3.26Å; Y541-E548 WeakPolarHBondContact CE2-O 3.49Å; Y541-I550 HydrophobicContact CD2-CG1 4.23Å; Y541-V551 HydrophobicContact CD1-CG2 4.23Å; Y541-V551 HydrophobicContact CD2-CG2 3.75Å; Y541-V551 HydrophobicContact CE2-CG2 4.31Å; Y541-V551 HydrophobicContact CG-CG2 3.7Å
542	E	70.1	Confident	65.8	Low	126 Å²	126	53.9 Å²	53.9	59%	0.589	27%	0.27	S	S	*	.	H	α-helix	trans	-69.9	-40.4	174.8	177.8	167.6	-166.8	0	0	112.7	L538 E539 V540 L544 G545 K598	L538-E542 PolarHBondContact O-N 3.36Å; E539-E542 PolarHBondContact O-N 3.21Å; V540-E542 VanDerWaalsContact C-N 3.35Å; V540-E542 PolarHBondContact O-N 3.48Å; E542-L544 VanDerWaalsContact C-N 3.27Å; E542-L544 PolarHBondContact O-N 3.48Å; E542-G545 PolarHBondContact O-N 3.49Å; E542-K598 VanDerWaalsContact CG-NZ 3.29Å; E542-K598 PolarHBondContact O-NZ 3.03Å; E542-K598 IonicContact OE1-NZ 3.18Å; E542-K598 PolarHBondContact OE1-NZ 2.8Å
543	R	76.1	Confident	65.4	Low	67 Å²	67	49.8 Å²	49.8	25%	0.253	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-38.9	171.5	-73.1	169	179.8	-161.7	-2.2	110.7	E539 V540 G545 E560 K598 F599	E539-R543 VanDerWaalsContact CD-NH2 3.25Å; E539-R543 WeakPolarHBondContact O-CB 3.44Å; E539-R543 WeakPolarHBondContact O-CG 3.42Å; E539-R543 PolarHBondContact O-N 3.19Å; E539-R543 IonicContact OE1-CZ 2.72Å; E539-R543 VanDerWaalsContact OE1-CZ 3.28Å; E539-R543 IonicContact OE1-NE 2.74Å; E539-R543 PolarHBondContact OE1-NE 3.26Å; E539-R543 IonicContact OE1-NH2 3.68Å; E539-R543 PolarHBondContact OE1-NH2 2.86Å; E539-R543 IonicContact OE2-CZ 3.69Å; E539-R543 IonicContact OE2-NE 3.45Å; E539-R543 IonicContact OE2-NH2 3.68Å; E539-R543 PolarHBondContact OE2-NH2 3.42Å; V540-R543 PolarHBondContact O-N 2.82Å; R543-G545 PolarHBondContact O-N 3.04Å; R543-E560 IonicContact CZ-OE1 3.25Å; R543-E560 IonicContact CZ-OE2 3.82Å; R543-E560 IonicContact NH1-OE1 2.87Å; R543-E560 PolarHBondContact NH1-OE1 2.79Å; R543-E560 IonicContact NH1-OE2 3.73Å; R543-E560 PolarHBondContact NH1-OE2 2.86Å; R543-E560 IonicContact NH2-OE1 2.77Å; R543-K598 CarbonylContact O-C 3.55Å; R543-K598 WeakPolarHBondContact O-CA 3.49Å; R543-K598 WeakPolarHBondContact O-CB 3.43Å; R543-F599 HydrophobicContact CB-CD2 4.42Å; R543-F599 PolarHBondContact O-N 3.48Å
544	L	76.9	Confident	65.4	Low	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	2.2	173.4	-69.1	178.3	0	0	0	114	V540 Y541 E542 G546 I550 Y579 L586 F599 V601	V540-L544 HydrophobicContact CG1-CD1 3.89Å; V540-L544 HydrophobicContact CG1-CG 4.15Å; V540-L544 VanDerWaalsContact O-CB 3.32Å; V540-L544 WeakPolarHBondContact O-CB 3.49Å; V540-L544 VanDerWaalsContact O-CG 3.23Å; V540-L544 WeakPolarHBondContact O-CG 3.49Å; V540-L544 PolarHBondContact O-N 3.15Å; Y541-L544 CarbonylContact O-C 3.51Å; Y541-L544 PolarHBondContact O-N 3.05Å; E542-L544 VanDerWaalsContact C-N 3.27Å; E542-L544 PolarHBondContact O-N 3.48Å; L544-G546 VanDerWaalsContact C-N 3.29Å; L544-G546 PolarHBondContact O-N 2.88Å; L544-I550 HydrophobicContact CD1-CD1 4.11Å; L544-I550 HydrophobicContact CD1-CG2 4.42Å; L544-Y579 HydrophobicContact CD2-CD2 4.32Å; L544-Y579 HydrophobicContact CD2-CE2 3.78Å; L544-Y579 HydrophobicContact CG-CE2 4.23Å; L544-L586 HydrophobicContact CD1-CD1 3.97Å; L544-F599 CarbonylContact C-O 3.52Å; L544-F599 WeakPolarHBondContact CA-O 3.39Å; L544-F599 HydrophobicContact CD2-CB 4.01Å; L544-V601 HydrophobicContact CD1-CG2 4.12Å; L544-V601 HydrophobicContact CD2-CG2 3.82Å
545	G	62.3	Low	66	Low	28 Å²	28	49.1 Å²	49.1	29%	0.289	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	13.5	176.1	0	0	0	0	0	115.4	Y541 E542 R543 E547	Y541-G545 PolarHBondContact O-N 3.24Å; E542-G545 PolarHBondContact O-N 3.49Å; R543-G545 PolarHBondContact O-N 3.04Å; G545-E547 VanDerWaalsContact C-N 3.28Å; G545-E547 PolarHBondContact O-N 3.07Å
546	G	58.3	Low	66.9	Low	28 Å²	28	48.1 Å²	48.1	29%	0.289	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	9.8	-179.6	0	0	0	0	0	115.5	Y541 L544	Y541-G546 VanDerWaalsContact CZ-CA 3.47Å; Y541-G546 PolarHBondContact O-N 3.08Å; Y541-G546 PolarHBondContact OH-O 3.07Å; L544-G546 VanDerWaalsContact C-N 3.29Å; L544-G546 PolarHBondContact O-N 2.88Å
547	E	46.9	Very low	67.6	Low	105 Å²	105	46.3 Å²	46.3	49%	0.491	25%	0.249	S	C	.	.			trans	-82.2	-9.1	-172.1	-62.5	176.1	-152.1	0	0	113.7	G545 K591 R593	G545-E547 VanDerWaalsContact C-N 3.28Å; G545-E547 PolarHBondContact O-N 3.07Å; E547-K591 IonicContact OE1-NZ 3.08Å; E547-K591 PolarHBondContact OE1-NZ 3.4Å; E547-K591 IonicContact OE2-NZ 3Å; E547-K591 PolarHBondContact OE2-NZ 3.09Å; E547-R593 IonicContact OE1-CZ 2.64Å; E547-R593 IonicContact OE1-NH2 2.59Å; E547-R593 PolarHBondContact OE1-NH2 2.93Å
548	E	58.1	Low	68.5	Low	64 Å²	64	48.8 Å²	48.8	30%	0.299	26%	0.262	S	S	.	.	S	Bend	trans	-135.9	132.7	-169.2	-77.6	-84.8	-167.9	0	0	113.2	Y541 I550 V601	Y541-E548 VanDerWaalsContact CD2-O 3.24Å; Y541-E548 WeakPolarHBondContact CD2-O 3.35Å; Y541-E548 VanDerWaalsContact CE2-O 3.26Å; Y541-E548 WeakPolarHBondContact CE2-O 3.49Å; E548-I550 HydrophobicContact CB-CG2 4.31Å; E548-I550 PolarHBondContact O-N 2.97Å; E548-V601 HydrophobicContact CG-CB 4.06Å; E548-V601 HydrophobicContact CG-CG2 3.74Å
549	D	60.5	Low	69.8	Low	120 Å²	120	49.6 Å²	49.6	64%	0.642	26%	0.264	S	S	*	.			trans	-79.4	85.3	-179.9	-174.4	15.8	0	0	0	112.1
550	I	69.6	Low	70.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.			trans	-106.7	-4.7	175.5	69.2	156.7	0	0	0	113.3	L537 V540 Y541 L544 E548 N552 N555 F581 M584 L586	L537-I550 WeakPolarHBondContact O-CD1 3.39Å; V540-I550 HydrophobicContact CB-CD1 3.89Å; V540-I550 HydrophobicContact CG1-CD1 3.6Å; Y541-I550 HydrophobicContact CD2-CG1 4.23Å; L544-I550 HydrophobicContact CD1-CD1 4.11Å; L544-I550 HydrophobicContact CD1-CG2 4.42Å; E548-I550 HydrophobicContact CB-CG2 4.31Å; E548-I550 PolarHBondContact O-N 2.97Å; I550-N552 PolarHBondContact O-N 2.92Å; I550-N555 PolarHBondContact O-ND2 3.42Å; I550-F581 HydrophobicContact CD1-CE1 4.45Å; I550-F581 HydrophobicContact CD1-CZ 3.87Å; I550-M584 HydrophobicContact CB-CE 4.13Å; I550-M584 HydrophobicContact CG2-CE 3.91Å; I550-L586 HydrophobicContact CG2-CD1 3.69Å
551	V	55.3	Low	71.3	Confident	18 Å²	18	49 Å²	49	11%	0.109	26%	0.264	C	S	.	.			trans	-88.3	58.5	-169.4	-167.1	0	0	0	0	110.6	M534 L538 Y541	M534-V551 HydrophobicContact SD-CG1 3.78Å; L538-V551 HydrophobicContact CD2-CG1 3.73Å; L538-V551 HydrophobicContact CD2-CG2 4.07Å; L538-V551 HydrophobicContact CG-CG1 4.39Å; Y541-V551 HydrophobicContact CD1-CG2 4.23Å; Y541-V551 HydrophobicContact CD2-CG2 3.75Å; Y541-V551 HydrophobicContact CE2-CG2 4.31Å; Y541-V551 HydrophobicContact CG-CG2 3.7Å
552	N	59.5	Low	72.3	Confident	68 Å²	68	49.3 Å²	49.3	36%	0.364	27%	0.267	S	S	.	.			trans	-108.3	129.4	178.4	-178.1	-26	0	0	0	109.7	I550 A554 N555	I550-N552 PolarHBondContact O-N 2.92Å; N552-A554 PolarHBondContact O-N 3.12Å; N552-A554 WeakPolarHBondContact OD1-CB 3.33Å; N552-A554 PolarHBondContact OD1-N 3.03Å; N552-N555 HydrophobicContact CB-CB 4.42Å; N552-N555 WeakPolarHBondContact O-CB 3.39Å; N552-N555 PolarHBondContact O-N 3.15Å
553	P	53.9	Low	73.4	Confident	31 Å²	31	43.5 Å²	43.5	20%	0.201	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-18	176.8	-26.6	34.7	0	0	0	116.1	M444 M534	M444-P553 HydrophobicContact CG-CG 4.26Å; M444-P553 HydrophobicContact SD-CG 4.13Å; M534-P553 HydrophobicContact CE-CB 4.12Å; M534-P553 HydrophobicContact CE-CG 3.86Å
554	A	63.8	Low	74.1	Confident	62 Å²	62	44 Å²	44	51%	0.512	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-16	174.1	0	0	0	0	0	113.9	N552 N582	N552-A554 PolarHBondContact O-N 3.12Å; N552-A554 WeakPolarHBondContact OD1-CB 3.33Å; N552-A554 PolarHBondContact OD1-N 3.03Å; A554-N582 PolarHBondContact O-ND2 3.35Å
555	N	76.1	Confident	74.8	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.037	25%	0.254	C	S	.	.			trans	-75	146.4	175.3	-69.2	-3.7	0	0	0	110	K533 L537 I550 N552 F581 N582 N583 M584	K533-N555 WeakPolarHBondContact CE-O 3.19Å; L537-N555 HydrophobicContact CD2-CB 3.78Å; I550-N555 PolarHBondContact O-ND2 3.42Å; N552-N555 HydrophobicContact CB-CB 4.42Å; N552-N555 WeakPolarHBondContact O-CB 3.39Å; N552-N555 PolarHBondContact O-N 3.15Å; N555-F581 HydrophobicContact CB-CD1 4.37Å; N555-N582 WeakPolarHBondContact CA-OD1 3.46Å; N555-N583 PolarHBondContact OD1-ND2 2.68Å; N555-M584 WeakPolarHBondContact ND2-CE 3.24Å
556	E	82.9	Confident	76.1	Confident	47 Å²	47	45.6 Å²	45.6	22%	0.22	24%	0.244	C	C	.	.			trans	-143.2	117.4	178.9	-179.4	178.4	-101.2	0	0	108.7	K533 I558 F581 N582 R656	K533-E556 HydrophobicContact CD-CG 4.26Å; K533-E556 IonicContact NZ-OE1 3.65Å; K533-E556 PolarHBondContact NZ-OE1 2.9Å; E556-I558 HydrophobicContact CB-CD1 4.21Å; E556-I558 HydrophobicContact CG-CD1 3.64Å; E556-I558 PolarHBondContact O-N 3.3Å; E556-I558 VanDerWaalsContact OE2-CD1 3.24Å; E556-I558 WeakPolarHBondContact OE2-CD1 3.34Å; E556-F581 CarbonylContact O-C 3.48Å; E556-F581 WeakPolarHBondContact O-CA 3.37Å; E556-N582 HydrophobicContact CB-CB 4Å; E556-N582 PolarHBondContact N-OD1 2.9Å; E556-N582 PolarHBondContact O-N 3.02Å; E556-R656 IonicContact OE2-CZ 3.28Å; E556-R656 IonicContact OE2-NH1 3.46Å; E556-R656 PolarHBondContact OE2-NH1 3.13Å; E556-R656 IonicContact OE2-NH2 2.71Å; E556-R656 PolarHBondContact OE2-NH2 3.48Å
557	L	87	Confident	77.1	Confident	31 Å²	31	45.6 Å²	45.6	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	124.9	171.5	-175.6	72.9	0	0	0	108.7	K536 L537 V540 E560 Y579 F581	K536-L557 HydrophobicContact CD-CD2 4.29Å; K536-L557 HydrophobicContact CG-CD2 3.71Å; L537-L557 HydrophobicContact CD1-CB 4.18Å; V540-L557 HydrophobicContact CG2-CD2 4Å; L557-E560 HydrophobicContact CD2-CB 4.35Å; L557-E560 HydrophobicContact CD2-CG 4.42Å; L557-Y579 HydrophobicContact CD1-CD1 4.04Å; L557-F581 HydrophobicContact CB-CD1 4.22Å; L557-F581 HydrophobicContact CB-CE1 4.06Å; L557-F581 HydrophobicContact CD1-CD1 4.37Å; L557-F581 HydrophobicContact CD1-CE1 4.05Å; L557-F581 HydrophobicContact CD1-CE2 4.27Å; L557-F581 HydrophobicContact CD1-CZ 4Å
558	I	90.9	Very high	78.2	Confident	55 Å²	55	45.2 Å²	45.2	28%	0.282	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-41.7	-179.2	-49.1	-54.5	0	0	0	110.7	E556 L580 N582 V649	E556-I558 HydrophobicContact CB-CD1 4.21Å; E556-I558 HydrophobicContact CG-CD1 3.64Å; E556-I558 PolarHBondContact O-N 3.3Å; E556-I558 VanDerWaalsContact OE2-CD1 3.24Å; E556-I558 WeakPolarHBondContact OE2-CD1 3.34Å; I558-L580 HydrophobicContact CB-CD2 4.23Å; I558-L580 HydrophobicContact CB-CG 4.11Å; I558-L580 HydrophobicContact CG2-CD2 4.32Å; I558-L580 PolarHBondContact N-O 2.71Å; I558-N582 HydrophobicContact CD1-CB 4.3Å; I558-V649 HydrophobicContact CG2-CG1 3.53Å
559	K	92.9	Very high	78.8	Confident	45 Å²	45	51.8 Å²	51.8	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	141.8	-179.7	-160.6	175.4	179.5	80.7	0	110.3	L580 D645 W646 V649	K559-L580 HydrophobicContact CB-CB 4.3Å; K559-L580 HydrophobicContact CB-CD2 4.3Å; K559-L580 PolarHBondContact N-O 3.38Å; K559-L580 PolarHBondContact O-N 2.59Å; K559-D645 WeakPolarHBondContact CE-OD1 3.42Å; K559-D645 WeakPolarHBondContact CE-OD2 3.18Å; K559-D645 IonicContact NZ-OD1 3.17Å; K559-D645 PolarHBondContact NZ-OD1 2.87Å; K559-D645 IonicContact NZ-OD2 2.68Å; K559-D645 PolarHBondContact NZ-OD2 2.81Å; K559-W646 HydrophobicContact CB-CH2 4.02Å; K559-W646 HydrophobicContact CB-CZ3 3.9Å; K559-W646 HydrophobicContact CD-CD2 3.84Å; K559-W646 HydrophobicContact CD-CE3 3.68Å; K559-W646 HydrophobicContact CD-CH2 3.91Å; K559-W646 HydrophobicContact CD-CZ2 4.07Å; K559-W646 HydrophobicContact CD-CZ3 3.72Å; K559-W646 HydrophobicContact CG-CE3 4.38Å; K559-W646 HydrophobicContact CG-CH2 3.74Å; K559-W646 HydrophobicContact CG-CZ2 4.1Å; K559-W646 HydrophobicContact CG-CZ3 3.9Å; K559-V649 HydrophobicContact CB-CG1 4.39Å; K559-V649 HydrophobicContact CD-CB 4.4Å; K559-V649 HydrophobicContact CD-CG1 4.38Å; K559-V649 HydrophobicContact CD-CG2 4.47Å
560	E	93	Very high	79.1	Confident	51 Å²	51	51 Å²	51	24%	0.238	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.6	169.3	67.3	173	-176	0	0	109.9	K536 R543 L557 Y577 L578 Y579	K536-E560 WeakPolarHBondContact CE-OE1 3.31Å; K536-E560 IonicContact NZ-OE1 3.31Å; K536-E560 PolarHBondContact NZ-OE1 2.89Å; K536-E560 IonicContact NZ-OE2 3.72Å; R543-E560 IonicContact CZ-OE1 3.25Å; R543-E560 IonicContact CZ-OE2 3.82Å; R543-E560 IonicContact NH1-OE1 2.87Å; R543-E560 PolarHBondContact NH1-OE1 2.79Å; R543-E560 IonicContact NH1-OE2 3.73Å; R543-E560 PolarHBondContact NH1-OE2 2.86Å; R543-E560 IonicContact NH2-OE1 2.77Å; L557-E560 HydrophobicContact CD2-CB 4.35Å; L557-E560 HydrophobicContact CD2-CG 4.42Å; E560-Y577 HydrophobicContact CB-CE1 3.92Å; E560-Y577 WeakPolarHBondContact CG-OH 3.15Å; E560-L578 WeakPolarHBondContact CA-O 3.48Å; E560-Y579 HydrophobicContact CB-CD1 3.81Å; E560-Y579 HydrophobicContact CB-CE1 4.1Å; E560-Y579 VanDerWaalsContact OE2-CE1 3.3Å; E560-Y579 WeakPolarHBondContact OE2-CE1 3.36Å
561	G	92.1	Very high	79.2	Confident	11 Å²	11	53.5 Å²	53.5	11%	0.113	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.9	172.6	177	0	0	0	0	0	115.6	Y577 L578	G561-Y577 WeakPolarHBondContact O-CA 3.48Å; G561-Y577 WeakPolarHBondContact O-CD2 3.34Å; G561-L578 PolarHBondContact N-O 3.23Å; G561-L578 VanDerWaalsContact N-O 3.13Å; G561-L578 PolarHBondContact O-N 2.82Å
562	H	91.7	Very high	80.4	Confident	69 Å²	69	55.5 Å²	55.5	32%	0.319	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	146.4	177.2	-69	94.3	0	0	0	111	R576 Y577	H562-R576 WeakPolarHBondContact CA-O 3.4Å; H562-Y577 AromaticContact CD2-CD2 3.72Å; H562-Y577 AromaticContact CE1-CE2 3.77Å; H562-Y577 AromaticContact CG-CD2 3.95Å; H562-Y577 AromaticContact ND1-CE2 3.87Å; H562-Y577 AromaticContact NE2-CD2 3.77Å; H562-Y577 AromaticContact NE2-CE2 3.98Å
563	I	93.3	Very high	81.7	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	154.2	174.8	-156.7	69.5	0	0	0	109.7	R576 L578 F624 L635 Q636 A637	I563-R576 HydrophobicContact CG2-CB 4.03Å; I563-R576 PolarHBondContact N-O 3.03Å; I563-R576 CarbonylContact O-C 3.51Å; I563-R576 WeakPolarHBondContact O-CA 3.46Å; I563-R576 WeakPolarHBondContact O-CB 3.43Å; I563-R576 PolarHBondContact O-N 3.31Å; I563-R576 VanDerWaalsContact O-O 3.13Å; I563-L578 HydrophobicContact CB-CD1 3.92Å; I563-L578 HydrophobicContact CB-CG 4.39Å; I563-L578 HydrophobicContact CG1-CD1 4.05Å; I563-L578 HydrophobicContact CG2-CD1 3.71Å; I563-L578 HydrophobicContact CG2-CG 3.77Å; I563-F624 HydrophobicContact CD1-CE1 3.99Å; I563-F624 HydrophobicContact CD1-CZ 4.05Å; I563-L635 HydrophobicContact CG1-CB 4.04Å; I563-L635 HydrophobicContact CG1-CD2 4.17Å; I563-L635 HydrophobicContact CG1-CG 4.47Å; I563-L635 HydrophobicContact CG2-CD2 4Å; I563-Q636 VanDerWaalsContact CD1-O 3.27Å; I563-Q636 WeakPolarHBondContact CD1-O 3.26Å; I563-Q636 WeakPolarHBondContact CG1-O 3.49Å; I563-A637 HydrophobicContact CD1-CB 4.26Å
564	K	91.8	Very high	83.3	Confident	78 Å²	78	56.6 Å²	56.6	34%	0.339	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128	167	-77.7	172.8	179	-179.6	0	109.8	A573 Q574 D575 L635 Q636	K564-A573 HydrophobicContact CB-CB 4.27Å; K564-A573 HydrophobicContact CD-CB 4.18Å; K564-A573 HydrophobicContact CG-CB 4.46Å; K564-Q574 CarbonylContact C-O 3.59Å; K564-Q574 VanDerWaalsContact CA-O 3.29Å; K564-Q574 WeakPolarHBondContact CA-O 3.48Å; K564-D575 WeakPolarHBondContact CE-OD1 3.3Å; K564-D575 WeakPolarHBondContact CG-OD1 3.18Å; K564-L635 CarbonylContact O-C 3.58Å; K564-L635 VanDerWaalsContact O-CA 3.31Å; K564-L635 WeakPolarHBondContact O-CA 3.27Å; K564-Q636 HydrophobicContact CB-CB 4.06Å; K564-Q636 PolarHBondContact N-O 3.4Å; K564-Q636 PolarHBondContact O-N 2.81Å
565	K	91.3	Very high	84.5	Confident	47 Å²	47	57.8 Å²	57.8	20%	0.204	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	130.5	166.3	179.3	171.5	-175.2	168.8	0	109.3	A573 Q574 R576 Y587 E603 L633 L635	K565-A573 CarbonylContact O-C 3.24Å; K565-A573 WeakPolarHBondContact O-CA 3.42Å; K565-Q574 PolarHBondContact N-O 3.05Å; K565-Q574 PolarHBondContact O-N 3.25Å; K565-R576 HydrophobicContact CB-CG 4.09Å; K565-Y587 HydrophobicContact CB-CE2 3.93Å; K565-Y587 HydrophobicContact CD-CE1 4.19Å; K565-Y587 HydrophobicContact CD-CE2 3.84Å; K565-Y587 VanDerWaalsContact CD-CZ 3.49Å; K565-Y587 WeakPolarHBondContact CD-OH 3.36Å; K565-Y587 HydrophobicContact CG-CE2 4.41Å; K565-E603 IonicContact NZ-OE2 2.66Å; K565-L633 HydrophobicContact CD-CD2 3.99Å; K565-L635 HydrophobicContact CB-CD2 4.27Å
566	M	88.5	Confident	85.3	Confident	17 Å²	17	59.8 Å²	59.8	8%	0.084	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133	171.5	-54.9	-51.1	-64.8	0	0	110	G571 A573 V620 T623 E634 Q636	M566-G571 VanDerWaalsContact CE-O 3.31Å; M566-G571 WeakPolarHBondContact CE-O 3.16Å; M566-A573 HydrophobicContact CE-CB 4.21Å; M566-A573 HydrophobicContact SD-CB 3.85Å; M566-V620 HydrophobicContact CE-CG1 4.04Å; M566-T623 HydrophobicContact CG-CG2 4.41Å; M566-E634 HydrophobicContact CB-CB 4.14Å; M566-E634 HydrophobicContact CB-CG 3.83Å; M566-E634 HydrophobicContact CG-CG 4.07Å; M566-E634 PolarHBondContact N-O 2.88Å; M566-Q636 HydrophobicContact CG-CB 4.44Å; M566-Q636 HydrophobicContact SD-CB 3.94Å
567	S	79.4	Confident	85.8	Confident	28 Å²	28	58.5 Å²	58.5	20%	0.196	32%	0.322	C	S	.	.			trans	-86.7	112	175.7	-178.9	0	0	0	0	111.8	K569 N570 G571 T572	S567-K569 PolarHBondContact O-N 2.82Å; S567-N570 WeakPolarHBondContact CB-OD1 3.49Å; S567-N570 PolarHBondContact O-N 3.42Å; S567-N570 PolarHBondContact OG-OD1 3.08Å; S567-G571 PolarHBondContact O-N 3.34Å; S567-T572 WeakPolarHBondContact CB-O 3.48Å; S567-T572 PolarHBondContact N-O 3.09Å
568	A	69.8	Low	86.1	Confident	97 Å²	97	57 Å²	57	80%	0.802	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-7.2	176.8	0	0	0	0	0	115.1
569	K	70.7	Confident	86.2	Confident	202 Å²	202	54.4 Å²	54.4	88%	0.878	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-27.5	179.1	-70.6	-167.9	174.4	-169.3	0	114.8	S567	S567-K569 PolarHBondContact O-N 2.82Å
570	N	67.6	Low	86.2	Confident	103 Å²	103	52.3 Å²	52.3	55%	0.551	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.6	15.1	-168.1	64.3	-38.1	0	0	0	113.8	S567 T572	S567-N570 WeakPolarHBondContact CB-OD1 3.49Å; S567-N570 PolarHBondContact O-N 3.42Å; S567-N570 PolarHBondContact OG-OD1 3.08Å; N570-T572 PolarHBondContact ND2-OG1 2.9Å; N570-T572 PolarHBondContact O-N 2.76Å; N570-T572 PolarHBondContact OD1-OG1 3.05Å
571	G	71.5	Confident	86.2	Confident	52 Å²	52	49.9 Å²	49.9	54%	0.536	28%	0.281	S	S	.	.			trans	70.1	-14.5	174.1	0	0	0	0	0	116.1	M566 S567 A573	M566-G571 VanDerWaalsContact CE-O 3.31Å; M566-G571 WeakPolarHBondContact CE-O 3.16Å; S567-G571 PolarHBondContact O-N 3.34Å; G571-A573 PolarHBondContact O-N 3.37Å
572	T	80.6	Confident	86.1	Confident	61 Å²	61	51.1 Å²	51.1	37%	0.374	28%	0.284	S	S	.	.			trans	-62.7	128.6	-174.7	58.8	0	0	0	0	112.2	S567 N570	S567-T572 WeakPolarHBondContact CB-O 3.48Å; S567-T572 PolarHBondContact N-O 3.09Å; N570-T572 PolarHBondContact ND2-OG1 2.9Å; N570-T572 PolarHBondContact O-N 2.76Å; N570-T572 PolarHBondContact OD1-OG1 3.05Å
573	A	86	Confident	85.8	Confident	47 Å²	47	49.9 Å²	49.9	39%	0.388	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	142.6	166.3	0	0	0	0	0	109.8	K564 K565 M566 G571	K564-A573 HydrophobicContact CB-CB 4.27Å; K564-A573 HydrophobicContact CD-CB 4.18Å; K564-A573 HydrophobicContact CG-CB 4.46Å; K565-A573 CarbonylContact O-C 3.24Å; K565-A573 WeakPolarHBondContact O-CA 3.42Å; M566-A573 HydrophobicContact CE-CB 4.21Å; M566-A573 HydrophobicContact SD-CB 3.85Å; G571-A573 PolarHBondContact O-N 3.37Å
574	Q	88.6	Confident	85.7	Confident	74 Å²	74	49.7 Å²	49.7	35%	0.346	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.4	178.2	-56.7	-176.6	-14.8	0	0	109.6	K564 K565 R576	K564-Q574 CarbonylContact C-O 3.59Å; K564-Q574 VanDerWaalsContact CA-O 3.29Å; K564-Q574 WeakPolarHBondContact CA-O 3.48Å; K565-Q574 PolarHBondContact N-O 3.05Å; K565-Q574 PolarHBondContact O-N 3.25Å; Q574-R576 WeakPolarHBondContact O-CG 3.29Å
575	D	89.8	Confident	85.8	Confident	88 Å²	88	46.1 Å²	46.1	47%	0.471	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	130.4	179	-72.8	-57.3	0	0	0	112.5	K564	K564-D575 WeakPolarHBondContact CE-OD1 3.3Å; K564-D575 WeakPolarHBondContact CG-OD1 3.18Å
576	R	92.1	Very high	85.8	Confident	48 Å²	48	43.9 Å²	43.9	18%	0.181	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	175.4	-168	-60.3	-66.4	172	-119.1	10.8	109.8	H562 I563 K565 Q574 Y587 C588	H562-R576 WeakPolarHBondContact CA-O 3.4Å; I563-R576 HydrophobicContact CG2-CB 4.03Å; I563-R576 PolarHBondContact N-O 3.03Å; I563-R576 CarbonylContact O-C 3.51Å; I563-R576 WeakPolarHBondContact O-CA 3.46Å; I563-R576 WeakPolarHBondContact O-CB 3.43Å; I563-R576 PolarHBondContact O-N 3.31Å; I563-R576 VanDerWaalsContact O-O 3.13Å; K565-R576 HydrophobicContact CB-CG 4.09Å; Q574-R576 WeakPolarHBondContact O-CG 3.29Å; R576-Y587 HydrophobicContact CB-CD2 4.46Å; R576-Y587 HydrophobicContact CB-CE2 3.72Å; R576-Y587 WeakPolarHBondContact CD-OH 3.36Å; R576-Y587 HydrophobicContact CG-CE2 3.59Å; R576-Y587 WeakPolarHBondContact CG-OH 3.42Å; R576-Y587 PolarHBondContact NE-OH 3.24Å; R576-Y587 VanDerWaalsContact NE-OH 3.14Å; R576-C588 WeakPolarHBondContact CB-O 3.4Å; R576-C588 WeakPolarHBondContact CD-O 3.32Å
577	Y	92.6	Very high	85.9	Confident	20 Å²	20	43.5 Å²	43.5	8%	0.078	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	143.9	178.8	-155.4	-89.3	0	0	0	110.3	E560 G561 H562 Y579 C588 F599	E560-Y577 HydrophobicContact CB-CE1 3.92Å; E560-Y577 WeakPolarHBondContact CG-OH 3.15Å; G561-Y577 WeakPolarHBondContact O-CA 3.48Å; G561-Y577 WeakPolarHBondContact O-CD2 3.34Å; H562-Y577 AromaticContact CD2-CD2 3.72Å; H562-Y577 AromaticContact CE1-CE2 3.77Å; H562-Y577 AromaticContact CG-CD2 3.95Å; H562-Y577 AromaticContact ND1-CE2 3.87Å; H562-Y577 AromaticContact NE2-CD2 3.77Å; H562-Y577 AromaticContact NE2-CE2 3.98Å; Y577-Y579 HydrophobicContact CD1-CD1 4.43Å; Y577-Y579 HydrophobicContact CD1-CD2 4.24Å; Y577-Y579 AromaticContact CD1-CE1 3.95Å; Y577-Y579 HydrophobicContact CD1-CE1 3.95Å; Y577-Y579 AromaticContact CD1-CE2 3.73Å; Y577-Y579 HydrophobicContact CD1-CE2 3.73Å; Y577-Y579 AromaticContact CD1-CZ 3.57Å; Y577-Y579 HydrophobicContact CE1-CD1 4.02Å; Y577-Y579 AromaticContact CE1-CE1 3.44Å; Y577-Y579 HydrophobicContact CE1-CE1 3.44Å; Y577-Y579 VanDerWaalsContact CE1-CE1 3.44Å; Y577-Y579 HydrophobicContact CE1-CE2 4.11Å; Y577-Y579 AromaticContact CE1-CZ 3.48Å; Y577-Y579 VanDerWaalsContact CE1-CZ 3.48Å; Y577-C588 PolarHBondContact N-O 2.89Å; Y577-C588 VanDerWaalsContact N-O 3.08Å; Y577-C588 WeakPolarHBondContact O-CB 3.33Å; Y577-C588 PolarHBondContact O-N 3.4Å; Y577-F599 VanDerWaalsContact CB-CE1 3.45Å; Y577-F599 HydrophobicContact CD1-CE2 4.38Å; Y577-F599 HydrophobicContact CD1-CZ 4.39Å; Y577-F599 AromaticContact CD2-CE1 3.91Å; Y577-F599 HydrophobicContact CD2-CE1 3.91Å; Y577-F599 HydrophobicContact CD2-CE2 4.17Å; Y577-F599 AromaticContact CD2-CZ 3.54Å; Y577-F599 HydrophobicContact CD2-CZ 3.54Å; Y577-F599 HydrophobicContact CE2-CE2 4.43Å; Y577-F599 HydrophobicContact CE2-CZ 4.1Å; Y577-F599 HydrophobicContact CG-CD1 4.25Å; Y577-F599 AromaticContact CG-CE1 3.77Å; Y577-F599 HydrophobicContact CG-CE1 3.77Å; Y577-F599 HydrophobicContact CG-CE2 4.14Å; Y577-F599 AromaticContact CG-CZ 3.71Å; Y577-F599 HydrophobicContact CG-CZ 3.71Å
578	L	93.7	Very high	86.4	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	138	177.9	-76.8	168.9	0	0	0	110.6	E560 G561 I563 V585 Y587 L635 W646	E560-L578 WeakPolarHBondContact CA-O 3.48Å; G561-L578 PolarHBondContact N-O 3.23Å; G561-L578 VanDerWaalsContact N-O 3.13Å; G561-L578 PolarHBondContact O-N 2.82Å; I563-L578 HydrophobicContact CB-CD1 3.92Å; I563-L578 HydrophobicContact CB-CG 4.39Å; I563-L578 HydrophobicContact CG1-CD1 4.05Å; I563-L578 HydrophobicContact CG2-CD1 3.71Å; I563-L578 HydrophobicContact CG2-CG 3.77Å; L578-V585 HydrophobicContact CD2-CG1 3.73Å; L578-Y587 HydrophobicContact CD2-CD2 4.44Å; L578-L635 HydrophobicContact CD1-CD1 4.03Å; L578-W646 HydrophobicContact CB-CH2 3.83Å; L578-W646 HydrophobicContact CB-CZ2 4.35Å; L578-W646 HydrophobicContact CB-CZ3 4.27Å; L578-W646 HydrophobicContact CD1-CZ3 4.48Å
579	Y	93.1	Very high	87.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.2	160.9	-57.2	-82	0	0	0	108.4	V540 L544 L557 E560 Y577 F581 V585 L586 F599	V540-Y579 HydrophobicContact CB-CD1 4.39Å; V540-Y579 HydrophobicContact CB-CE1 4.17Å; V540-Y579 HydrophobicContact CG1-CD1 3.57Å; V540-Y579 HydrophobicContact CG1-CD2 4.11Å; V540-Y579 HydrophobicContact CG1-CE1 3.52Å; V540-Y579 HydrophobicContact CG1-CE2 4.07Å; V540-Y579 HydrophobicContact CG1-CG 3.88Å; V540-Y579 HydrophobicContact CG2-CD1 3.8Å; V540-Y579 HydrophobicContact CG2-CE1 3.6Å; L544-Y579 HydrophobicContact CD2-CD2 4.32Å; L544-Y579 HydrophobicContact CD2-CE2 3.78Å; L544-Y579 HydrophobicContact CG-CE2 4.23Å; L557-Y579 HydrophobicContact CD1-CD1 4.04Å; E560-Y579 HydrophobicContact CB-CD1 3.81Å; E560-Y579 HydrophobicContact CB-CE1 4.1Å; E560-Y579 VanDerWaalsContact OE2-CE1 3.3Å; E560-Y579 WeakPolarHBondContact OE2-CE1 3.36Å; Y577-Y579 HydrophobicContact CD1-CD1 4.43Å; Y577-Y579 HydrophobicContact CD1-CD2 4.24Å; Y577-Y579 AromaticContact CD1-CE1 3.95Å; Y577-Y579 HydrophobicContact CD1-CE1 3.95Å; Y577-Y579 AromaticContact CD1-CE2 3.73Å; Y577-Y579 HydrophobicContact CD1-CE2 3.73Å; Y577-Y579 AromaticContact CD1-CZ 3.57Å; Y577-Y579 HydrophobicContact CE1-CD1 4.02Å; Y577-Y579 AromaticContact CE1-CE1 3.44Å; Y577-Y579 HydrophobicContact CE1-CE1 3.44Å; Y577-Y579 VanDerWaalsContact CE1-CE1 3.44Å; Y577-Y579 HydrophobicContact CE1-CE2 4.11Å; Y577-Y579 AromaticContact CE1-CZ 3.48Å; Y577-Y579 VanDerWaalsContact CE1-CZ 3.48Å; Y579-F581 HydrophobicContact CG-CE2 4.46Å; Y579-V585 WeakPolarHBondContact O-CA 3.24Å; Y579-L586 HydrophobicContact CD2-CB 4.48Å; Y579-L586 PolarHBondContact N-O 3.44Å; Y579-L586 PolarHBondContact O-N 3.14Å; Y579-F599 VanDerWaalsContact OH-CD2 3.24Å; Y579-F599 WeakPolarHBondContact OH-CD2 3.44Å
580	L	94	Very high	87.8	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	116.3	171.8	171.3	65.7	0	0	0	108.6	I558 K559 V585 I607 W646 V649 I650 T653	I558-L580 HydrophobicContact CB-CD2 4.23Å; I558-L580 HydrophobicContact CB-CG 4.11Å; I558-L580 HydrophobicContact CG2-CD2 4.32Å; I558-L580 PolarHBondContact N-O 2.71Å; K559-L580 HydrophobicContact CB-CB 4.3Å; K559-L580 HydrophobicContact CB-CD2 4.3Å; K559-L580 PolarHBondContact N-O 3.38Å; K559-L580 PolarHBondContact O-N 2.59Å; L580-V585 HydrophobicContact CD1-CG2 3.69Å; L580-I607 HydrophobicContact CD1-CD1 3.9Å; L580-W646 HydrophobicContact CB-CZ3 4.07Å; L580-V649 HydrophobicContact CD2-CB 4.5Å; L580-V649 HydrophobicContact CD2-CG1 3.71Å; L580-I650 HydrophobicContact CD1-CG1 4.36Å; L580-I650 HydrophobicContact CD2-CG1 3.9Å; L580-T653 HydrophobicContact CD1-CG2 4.23Å
581	F	92.1	Very high	87.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	162.8	169.8	-61.5	-96.5	0	0	0	110.9	L537 V540 I550 N555 E556 L557 Y579 N583 M584 L586	L537-F581 HydrophobicContact CD1-CD1 4.41Å; L537-F581 HydrophobicContact CD1-CE1 3.92Å; L537-F581 HydrophobicContact CG-CE1 4.15Å; V540-F581 HydrophobicContact CG1-CZ 4.14Å; I550-F581 HydrophobicContact CD1-CE1 4.45Å; I550-F581 HydrophobicContact CD1-CZ 3.87Å; N555-F581 HydrophobicContact CB-CD1 4.37Å; E556-F581 CarbonylContact O-C 3.48Å; E556-F581 WeakPolarHBondContact O-CA 3.37Å; L557-F581 HydrophobicContact CB-CD1 4.22Å; L557-F581 HydrophobicContact CB-CE1 4.06Å; L557-F581 HydrophobicContact CD1-CD1 4.37Å; L557-F581 HydrophobicContact CD1-CE1 4.05Å; L557-F581 HydrophobicContact CD1-CE2 4.27Å; L557-F581 HydrophobicContact CD1-CZ 4Å; Y579-F581 HydrophobicContact CG-CE2 4.46Å; F581-N583 PolarHBondContact O-N 3.16Å; F581-N583 VanDerWaalsContact O-N 3.07Å; F581-M584 WeakPolarHBondContact CA-O 3.35Å; F581-M584 HydrophobicContact CB-CE 4.33Å; F581-M584 HydrophobicContact CB-CG 3.94Å; F581-M584 WeakPolarHBondContact CB-O 3.44Å; F581-M584 HydrophobicContact CD1-CE 4.29Å; F581-M584 HydrophobicContact CD2-CE 3.76Å; F581-M584 HydrophobicContact CD2-CG 3.97Å; F581-M584 HydrophobicContact CE2-CE 4.07Å; F581-M584 HydrophobicContact CG-CE 3.88Å; F581-M584 HydrophobicContact CG-CG 4.23Å; F581-M584 HydrophobicContact CZ-CE 4.47Å; F581-M584 PolarHBondContact N-O 3.4Å; F581-L586 HydrophobicContact CD2-CD1 4.41Å; F581-L586 HydrophobicContact CD2-CG 4.34Å; F581-L586 HydrophobicContact CE2-CD1 3.7Å; F581-L586 HydrophobicContact CE2-CG 4.05Å
582	N	89.3	Confident	87.1	Confident	36 Å²	36	33.9 Å²	33.9	19%	0.193	18%	0.182	C	C	.	.	S	Bend	trans	-55.7	-20.5	175	63.3	-22	0	0	0	115.5	A554 N555 E556 I558 H657	A554-N582 PolarHBondContact O-ND2 3.35Å; N555-N582 WeakPolarHBondContact CA-OD1 3.46Å; E556-N582 HydrophobicContact CB-CB 4Å; E556-N582 PolarHBondContact N-OD1 2.9Å; E556-N582 PolarHBondContact O-N 3.02Å; I558-N582 HydrophobicContact CD1-CB 4.3Å; N582-H657 PolarHBondContact O-CD2 2.9Å
583	N	86.1	Confident	85.6	Confident	43 Å²	43	36.6 Å²	36.6	23%	0.23	19%	0.185	C	C	.	.	S	Bend	trans	-125.8	-11.9	-178.7	62.6	-3.1	0	0	0	115.1	N555 F581 I607	N555-N583 PolarHBondContact OD1-ND2 2.68Å; F581-N583 PolarHBondContact O-N 3.16Å; F581-N583 VanDerWaalsContact O-N 3.07Å; N583-I607 PolarHBondContact O-N 3.05Å
584	M	91	Very high	83.6	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.7	-178.6	64	-173.4	167.4	0	0	113	I550 N555 F581 L586 R604 I605	I550-M584 HydrophobicContact CB-CE 4.13Å; I550-M584 HydrophobicContact CG2-CE 3.91Å; N555-M584 WeakPolarHBondContact ND2-CE 3.24Å; F581-M584 WeakPolarHBondContact CA-O 3.35Å; F581-M584 HydrophobicContact CB-CE 4.33Å; F581-M584 HydrophobicContact CB-CG 3.94Å; F581-M584 WeakPolarHBondContact CB-O 3.44Å; F581-M584 HydrophobicContact CD1-CE 4.29Å; F581-M584 HydrophobicContact CD2-CE 3.76Å; F581-M584 HydrophobicContact CD2-CG 3.97Å; F581-M584 HydrophobicContact CE2-CE 4.07Å; F581-M584 HydrophobicContact CG-CE 3.88Å; F581-M584 HydrophobicContact CG-CG 4.23Å; F581-M584 HydrophobicContact CZ-CE 4.47Å; F581-M584 PolarHBondContact N-O 3.4Å; M584-L586 HydrophobicContact CE-CD1 4.47Å; M584-L586 HydrophobicContact CG-CD2 4.37Å; M584-L586 HydrophobicContact SD-CD2 3.97Å; M584-L586 HydrophobicContact SD-CG 4.41Å; M584-R604 HydrophobicContact CB-CG 4.48Å; M584-R604 PolarHBondContact SD-NH1 3.14Å; M584-R604 VanDerWaalsContact SD-NH1 3.37Å; M584-I605 CarbonylContact C-O 3.58Å; M584-I605 WeakPolarHBondContact CA-O 3.43Å
585	V	93.4	Very high	81.3	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.4	165	-175.6	0	0	0	0	108.6	L578 Y579 L580 R604 I605 I607 M610	L578-V585 HydrophobicContact CD2-CG1 3.73Å; Y579-V585 WeakPolarHBondContact O-CA 3.24Å; L580-V585 HydrophobicContact CD1-CG2 3.69Å; V585-R604 WeakPolarHBondContact O-CA 3.35Å; V585-I605 HydrophobicContact CB-CB 4.47Å; V585-I605 PolarHBondContact N-O 3Å; V585-I605 PolarHBondContact O-N 3.47Å; V585-I607 HydrophobicContact CG2-CD1 3.98Å; V585-M610 HydrophobicContact CG2-CE 3.9Å; V585-M610 HydrophobicContact CG2-SD 3.71Å
586	L	91.9	Very high	79.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.3	172.5	-55.1	-177.1	0	0	0	109.8	L544 I550 Y579 F581 M584 V601 R604	L544-L586 HydrophobicContact CD1-CD1 3.97Å; I550-L586 HydrophobicContact CG2-CD1 3.69Å; Y579-L586 HydrophobicContact CD2-CB 4.48Å; Y579-L586 PolarHBondContact N-O 3.44Å; Y579-L586 PolarHBondContact O-N 3.14Å; F581-L586 HydrophobicContact CD2-CD1 4.41Å; F581-L586 HydrophobicContact CD2-CG 4.34Å; F581-L586 HydrophobicContact CE2-CD1 3.7Å; F581-L586 HydrophobicContact CE2-CG 4.05Å; M584-L586 HydrophobicContact CE-CD1 4.47Å; M584-L586 HydrophobicContact CG-CD2 4.37Å; M584-L586 HydrophobicContact SD-CD2 3.97Å; M584-L586 HydrophobicContact SD-CG 4.41Å; L586-V601 HydrophobicContact CB-CG2 4.21Å; L586-V601 HydrophobicContact CD1-CG2 4.13Å; L586-V601 HydrophobicContact CD2-CG1 4.42Å; L586-R604 HydrophobicContact CD2-CB 3.87Å; L586-R604 HydrophobicContact CD2-CG 3.8Å
587	Y	91.3	Very high	77.7	Confident	10 Å²	10	44.9 Å²	44.9	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	121.5	174.8	162.4	-95.6	0	0	0	110	K565 R576 L578 R602 E603 L633	K565-Y587 HydrophobicContact CB-CE2 3.93Å; K565-Y587 HydrophobicContact CD-CE1 4.19Å; K565-Y587 HydrophobicContact CD-CE2 3.84Å; K565-Y587 VanDerWaalsContact CD-CZ 3.49Å; K565-Y587 WeakPolarHBondContact CD-OH 3.36Å; K565-Y587 HydrophobicContact CG-CE2 4.41Å; R576-Y587 HydrophobicContact CB-CD2 4.46Å; R576-Y587 HydrophobicContact CB-CE2 3.72Å; R576-Y587 WeakPolarHBondContact CD-OH 3.36Å; R576-Y587 HydrophobicContact CG-CE2 3.59Å; R576-Y587 WeakPolarHBondContact CG-OH 3.42Å; R576-Y587 PolarHBondContact NE-OH 3.24Å; R576-Y587 VanDerWaalsContact NE-OH 3.14Å; L578-Y587 HydrophobicContact CD2-CD2 4.44Å; Y587-R602 HydrophobicContact CD1-CB 3.86Å; Y587-R602 HydrophobicContact CE1-CB 3.8Å; Y587-R602 HydrophobicContact CE1-CG 4.35Å; Y587-R602 PolarHBondContact O-N 3.32Å; Y587-E603 HydrophobicContact CD1-CB 3.79Å; Y587-E603 HydrophobicContact CG-CB 4.47Å; Y587-E603 PolarHBondContact N-O 2.95Å; Y587-E603 PolarHBondContact O-N 3.01Å; Y587-L633 HydrophobicContact CD1-CD2 4.42Å; Y587-L633 HydrophobicContact CD2-CD1 4.09Å; Y587-L633 HydrophobicContact CG-CD1 3.83Å; Y587-L633 HydrophobicContact CG-CD2 4.38Å
588	C	90.4	Very high	76.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.4	-165.9	-56.2	0	0	0	0	113.3	R576 Y577 F599 S600	R576-C588 WeakPolarHBondContact CB-O 3.4Å; R576-C588 WeakPolarHBondContact CD-O 3.32Å; Y577-C588 PolarHBondContact N-O 2.89Å; Y577-C588 VanDerWaalsContact N-O 3.08Å; Y577-C588 WeakPolarHBondContact O-CB 3.33Å; Y577-C588 PolarHBondContact O-N 3.4Å; C588-F599 HydrophobicContact CB-CB 4.14Å; C588-S600 CarbonylContact C-O 3.55Å; C588-S600 WeakPolarHBondContact CA-O 3.2Å
589	V	87.9	Confident	76.1	Confident	11 Å²	11	46.4 Å²	46.4	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	147.5	164.1	-65.1	0	0	0	0	110.1	F599 S600 R602	V589-F599 CarbonylContact O-C 3.48Å; V589-F599 WeakPolarHBondContact O-CA 3.43Å; V589-S600 PolarHBondContact N-O 3.31Å; V589-S600 PolarHBondContact O-N 2.68Å; V589-R602 HydrophobicContact CB-CG 4.3Å; V589-R602 HydrophobicContact CG1-CG 3.55Å; V589-R602 HydrophobicContact CG2-CG 3.94Å; V589-R602 VanDerWaalsContact CG2-NE 3.35Å
590	P	81	Confident	75.6	Confident	47 Å²	47	47.1 Å²	47.1	31%	0.305	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	134.4	158	-18.5	31.3	0	0	0	110.4	F599	P590-F599 HydrophobicContact CB-CE1 4.46Å; P590-F599 HydrophobicContact CG-CD1 4.49Å; P590-F599 HydrophobicContact CG-CE1 4.17Å
591	K	68.4	Low	75.3	Confident	56 Å²	56	48 Å²	48	24%	0.243	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	114.8	160.3	-84.6	175.4	175.5	150.3	0	106.5	E547 R593 K598 S600	E547-K591 IonicContact OE1-NZ 3.08Å; E547-K591 PolarHBondContact OE1-NZ 3.4Å; E547-K591 IonicContact OE2-NZ 3Å; E547-K591 PolarHBondContact OE2-NZ 3.09Å; K591-R593 PolarHBondContact O-N 3Å; K591-K598 PolarHBondContact N-O 3.35Å; K591-S600 VanDerWaalsContact CE-CB 3.41Å; K591-S600 VanDerWaalsContact CE-OG 3.23Å; K591-S600 WeakPolarHBondContact CE-OG 3.38Å; K591-S600 PolarHBondContact NZ-OG 3.31Å
592	L	55.6	Low	75	Confident	166 Å²	166	56.5 Å²	56.5	87%	0.869	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.7	166.5	-122.5	69.3	0	0	0	108.8
593	R	50	Low	74.9	Confident	117 Å²	117	56.5 Å²	56.5	44%	0.442	28%	0.282	S	S	.	.			trans	-139.8	158	168.3	-71.2	-172.9	179.3	157.3	6.2	107.1	E547 K591 M595	E547-R593 IonicContact OE1-CZ 2.64Å; E547-R593 IonicContact OE1-NH2 2.59Å; E547-R593 PolarHBondContact OE1-NH2 2.93Å; K591-R593 PolarHBondContact O-N 3Å; R593-M595 PolarHBondContact O-N 3.05Å; R593-M595 VanDerWaalsContact O-N 3.13Å
594	L	43	Very low	75.1	Confident	120 Å²	120	59.8 Å²	59.8	63%	0.628	29%	0.291	S	S	*	.	S	Bend	trans	-61.7	-19.7	179.7	-93.9	62.2	0	0	0	113.9	E810	L594-E810 HydrophobicContact CD2-CB 4.47Å; L594-E810 HydrophobicContact CD2-CG 4.1Å
595	M	40.2	Very low	75.1	Confident	143 Å²	143	60.3 Å²	60.3	70%	0.704	29%	0.294	S	S	*	.	S	Bend	trans	-108.8	68.6	-178.8	-71.1	-73.8	127.6	0	0	111.4	R593	R593-M595 PolarHBondContact O-N 3.05Å; R593-M595 VanDerWaalsContact O-N 3.13Å
596	G	51.3	Low	74.9	Confident	52 Å²	52	64.1 Å²	64.1	54%	0.536	31%	0.314	S	S	.	.	S	Bend	trans	76.3	170.2	173.7	0	0	0	0	0	115.8	K598	G596-K598 PolarHBondContact O-N 2.64Å; G596-K598 VanDerWaalsContact O-N 3.07Å
597	Q	55.8	Low	75	Confident	116 Å²	116	64.2 Å²	64.2	54%	0.542	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	96.5	179.3	-168.9	178.4	33.6	0	0	110.3	F599	Q597-F599 HydrophobicContact CG-CZ 4.48Å
598	K	69.8	Low	74.8	Confident	42 Å²	42	65.5 Å²	65.5	18%	0.183	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	149.1	173.8	-61.1	-151.7	173	-144.6	0	110.9	E542 R543 K591 G596	E542-K598 VanDerWaalsContact CG-NZ 3.29Å; E542-K598 PolarHBondContact O-NZ 3.03Å; E542-K598 IonicContact OE1-NZ 3.18Å; E542-K598 PolarHBondContact OE1-NZ 2.8Å; R543-K598 CarbonylContact O-C 3.55Å; R543-K598 WeakPolarHBondContact O-CA 3.49Å; R543-K598 WeakPolarHBondContact O-CB 3.43Å; K591-K598 PolarHBondContact N-O 3.35Å; G596-K598 PolarHBondContact O-N 2.64Å; G596-K598 VanDerWaalsContact O-N 3.07Å
599	F	83.2	Confident	74.4	Confident	11 Å²	11	68 Å²	68	5%	0.048	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	158.4	179.3	-67	-71.9	0	0	0	110.7	R543 L544 Y577 Y579 C588 V589 P590 Q597	R543-F599 HydrophobicContact CB-CD2 4.42Å; R543-F599 PolarHBondContact O-N 3.48Å; L544-F599 CarbonylContact C-O 3.52Å; L544-F599 WeakPolarHBondContact CA-O 3.39Å; L544-F599 HydrophobicContact CD2-CB 4.01Å; Y577-F599 VanDerWaalsContact CB-CE1 3.45Å; Y577-F599 HydrophobicContact CD1-CE2 4.38Å; Y577-F599 HydrophobicContact CD1-CZ 4.39Å; Y577-F599 AromaticContact CD2-CE1 3.91Å; Y577-F599 HydrophobicContact CD2-CE1 3.91Å; Y577-F599 HydrophobicContact CD2-CE2 4.17Å; Y577-F599 AromaticContact CD2-CZ 3.54Å; Y577-F599 HydrophobicContact CD2-CZ 3.54Å; Y577-F599 HydrophobicContact CE2-CE2 4.43Å; Y577-F599 HydrophobicContact CE2-CZ 4.1Å; Y577-F599 HydrophobicContact CG-CD1 4.25Å; Y577-F599 AromaticContact CG-CE1 3.77Å; Y577-F599 HydrophobicContact CG-CE1 3.77Å; Y577-F599 HydrophobicContact CG-CE2 4.14Å; Y577-F599 AromaticContact CG-CZ 3.71Å; Y577-F599 HydrophobicContact CG-CZ 3.71Å; Y579-F599 VanDerWaalsContact OH-CD2 3.24Å; Y579-F599 WeakPolarHBondContact OH-CD2 3.44Å; C588-F599 HydrophobicContact CB-CB 4.14Å; V589-F599 CarbonylContact O-C 3.48Å; V589-F599 WeakPolarHBondContact O-CA 3.43Å; P590-F599 HydrophobicContact CB-CE1 4.46Å; P590-F599 HydrophobicContact CG-CD1 4.49Å; P590-F599 HydrophobicContact CG-CE1 4.17Å; Q597-F599 HydrophobicContact CG-CZ 4.48Å
600	S	82.3	Confident	74.7	Confident	15 Å²	15	67.7 Å²	67.7	11%	0.105	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	125.7	171.5	-169.7	0	0	0	0	108.6	C588 V589 K591 R602	C588-S600 CarbonylContact C-O 3.55Å; C588-S600 WeakPolarHBondContact CA-O 3.2Å; V589-S600 PolarHBondContact N-O 3.31Å; V589-S600 PolarHBondContact O-N 2.68Å; K591-S600 VanDerWaalsContact CE-CB 3.41Å; K591-S600 VanDerWaalsContact CE-OG 3.23Å; K591-S600 WeakPolarHBondContact CE-OG 3.38Å; K591-S600 PolarHBondContact NZ-OG 3.31Å; S600-R602 PolarHBondContact O-N 2.83Å
601	V	86.5	Confident	75.2	Confident	19 Å²	19	71 Å²	71	12%	0.115	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	136.6	166.2	-177	0	0	0	0	108.4	L544 E548 L586	L544-V601 HydrophobicContact CD1-CG2 4.12Å; L544-V601 HydrophobicContact CD2-CG2 3.82Å; E548-V601 HydrophobicContact CG-CB 4.06Å; E548-V601 HydrophobicContact CG-CG2 3.74Å; L586-V601 HydrophobicContact CB-CG2 4.21Å; L586-V601 HydrophobicContact CD1-CG2 4.13Å; L586-V601 HydrophobicContact CD2-CG1 4.42Å
602	R	87.3	Confident	76.3	Confident	179 Å²	179	69.2 Å²	69.2	68%	0.675	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	-28.9	167.3	-71.7	-62.1	-168.5	148.7	1.6	111.6	Y587 V589 S600	Y587-R602 HydrophobicContact CD1-CB 3.86Å; Y587-R602 HydrophobicContact CE1-CB 3.8Å; Y587-R602 HydrophobicContact CE1-CG 4.35Å; Y587-R602 PolarHBondContact O-N 3.32Å; V589-R602 HydrophobicContact CB-CG 4.3Å; V589-R602 HydrophobicContact CG1-CG 3.55Å; V589-R602 HydrophobicContact CG2-CG 3.94Å; V589-R602 VanDerWaalsContact CG2-NE 3.35Å; S600-R602 PolarHBondContact O-N 2.83Å
603	E	86.8	Confident	77.9	Confident	37 Å²	37	64.6 Å²	64.6	17%	0.173	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	132.9	-171.2	-158.3	142.3	-133.5	0	0	109	K565 Y587 R631 L633	K565-E603 IonicContact NZ-OE2 2.66Å; Y587-E603 HydrophobicContact CD1-CB 3.79Å; Y587-E603 HydrophobicContact CG-CB 4.47Å; Y587-E603 PolarHBondContact N-O 2.95Å; Y587-E603 PolarHBondContact O-N 3.01Å; E603-R631 WeakPolarHBondContact OE1-CD 3.24Å; E603-R631 WeakPolarHBondContact OE1-CG 3.42Å; E603-R631 IonicContact OE1-NE 2.84Å; E603-R631 PolarHBondContact OE1-NE 2.87Å; E603-R631 VanDerWaalsContact OE1-NE 3.08Å; E603-L633 WeakPolarHBondContact OE2-CD2 3.41Å
604	R	89.4	Confident	79.5	Confident	112 Å²	112	64 Å²	64	42%	0.423	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.5	175	169.8	178.7	171.8	141.6	6	108	M584 V585 L586 D606	M584-R604 HydrophobicContact CB-CG 4.48Å; M584-R604 PolarHBondContact SD-NH1 3.14Å; M584-R604 VanDerWaalsContact SD-NH1 3.37Å; V585-R604 WeakPolarHBondContact O-CA 3.35Å; L586-R604 HydrophobicContact CD2-CB 3.87Å; L586-R604 HydrophobicContact CD2-CG 3.8Å; R604-D606 IonicContact CZ-OD1 3.83Å; R604-D606 IonicContact NE-OD1 3.92Å; R604-D606 PolarHBondContact NE-OD1 3.01Å; R604-D606 IonicContact NH2-OD1 3.8Å; R604-D606 PolarHBondContact NH2-OD1 3.32Å; R604-D606 VanDerWaalsContact NH2-OD1 3.16Å
605	I	91.4	Very high	80.6	Confident	11 Å²	11	61.3 Å²	61.3	6%	0.056	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	111.4	177	-57.2	178.5	0	0	0	107.9	M584 V585 M610 I626 L633	M584-I605 CarbonylContact C-O 3.58Å; M584-I605 WeakPolarHBondContact CA-O 3.43Å; V585-I605 HydrophobicContact CB-CB 4.47Å; V585-I605 PolarHBondContact N-O 3Å; V585-I605 PolarHBondContact O-N 3.47Å; I605-M610 HydrophobicContact CB-SD 4.34Å; I605-M610 HydrophobicContact CG2-CB 4.35Å; I605-M610 HydrophobicContact CG2-CG 3.8Å; I605-M610 HydrophobicContact CG2-SD 3.6Å; I605-I626 HydrophobicContact CD1-CG2 4.12Å; I605-L633 HydrophobicContact CD1-CD1 3.75Å; I605-L633 HydrophobicContact CD1-CG 4.01Å
606	D	90.4	Very high	81.5	Confident	82 Å²	82	60.2 Å²	60.2	44%	0.439	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	137.7	175.9	-55.6	-48.6	0	0	0	110.3	R604 A608	R604-D606 IonicContact CZ-OD1 3.83Å; R604-D606 IonicContact NE-OD1 3.92Å; R604-D606 PolarHBondContact NE-OD1 3.01Å; R604-D606 IonicContact NH2-OD1 3.8Å; R604-D606 PolarHBondContact NH2-OD1 3.32Å; R604-D606 VanDerWaalsContact NH2-OD1 3.16Å; D606-A608 PolarHBondContact O-N 2.81Å
607	I	92.3	Very high	81.8	Confident	2 Å²	2	63 Å²	63	1%	0.01	32%	0.318	C	S	.	.	S	Bend	trans	-60.7	-29.4	-177.1	-66.1	-69.2	0	0	0	112.1	L580 N583 V585 G609 M610 T653 I654 H657	L580-I607 HydrophobicContact CD1-CD1 3.9Å; N583-I607 PolarHBondContact O-N 3.05Å; V585-I607 HydrophobicContact CG2-CD1 3.98Å; I607-G609 PolarHBondContact O-N 2.88Å; I607-M610 HydrophobicContact CD1-CE 3.52Å; I607-M610 HydrophobicContact CD1-SD 4.16Å; I607-M610 WeakPolarHBondContact O-CB 3.46Å; I607-M610 PolarHBondContact O-N 3.46Å; I607-T653 HydrophobicContact CD1-CG2 4.05Å; I607-T653 HydrophobicContact CG1-CG2 4.32Å; I607-I654 HydrophobicContact CG2-CB 4.4Å; I607-I654 HydrophobicContact CG2-CG1 4.1Å; I607-H657 HydrophobicContact CG2-CB 3.66Å
608	A	87.4	Confident	81.8	Confident	37 Å²	37	66.9 Å²	66.9	31%	0.306	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	101.4	-179.8	0	0	0	0	0	111.3	D606 K629	D606-A608 PolarHBondContact O-N 2.81Å; A608-K629 WeakPolarHBondContact O-CD 3.38Å; A608-K629 WeakPolarHBondContact O-CE 3.4Å; A608-K629 PolarHBondContact O-NZ 3.08Å
609	G	83.3	Confident	81.5	Confident	54 Å²	54	72.3 Å²	72.3	56%	0.557	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	32.7	-173.3	0	0	0	0	0	113	I607	I607-G609 PolarHBondContact O-N 2.88Å
610	M	92.9	Very high	80.9	Confident	4 Å²	4	73.5 Å²	73.5	2%	0.02	38%	0.375	C	S	.	.			trans	-96.1	140	162.7	-168	-179.3	83.1	0	0	109.4	V585 I605 I607 I626 I627 I650 I654	V585-M610 HydrophobicContact CG2-CE 3.9Å; V585-M610 HydrophobicContact CG2-SD 3.71Å; I605-M610 HydrophobicContact CB-SD 4.34Å; I605-M610 HydrophobicContact CG2-CB 4.35Å; I605-M610 HydrophobicContact CG2-CG 3.8Å; I605-M610 HydrophobicContact CG2-SD 3.6Å; I607-M610 HydrophobicContact CD1-CE 3.52Å; I607-M610 HydrophobicContact CD1-SD 4.16Å; I607-M610 WeakPolarHBondContact O-CB 3.46Å; I607-M610 PolarHBondContact O-N 3.46Å; M610-I626 HydrophobicContact CE-CG2 4.16Å; M610-I626 HydrophobicContact CG-CG2 3.75Å; M610-I626 HydrophobicContact SD-CG2 3.43Å; M610-I626 WeakPolarHBondContact SD-CG2 3.29Å; M610-I627 CarbonylContact C-O 3.54Å; M610-I627 VanDerWaalsContact CA-O 3.3Å; M610-I627 WeakPolarHBondContact CA-O 3.11Å; M610-I627 WeakPolarHBondContact CG-O 3.41Å; M610-I650 HydrophobicContact CE-CG2 3.46Å; M610-I650 VanDerWaalsContact CE-CG2 3.46Å; M610-I654 HydrophobicContact CE-CD1 3.85Å; M610-I654 HydrophobicContact CE-CG1 3.97Å; M610-I654 WeakPolarHBondContact O-CD1 3.41Å
611	E	91.1	Very high	80.9	Confident	115 Å²	115	76.7 Å²	76.7	54%	0.537	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	151.4	170.6	-67.3	176.1	-164	0	0	109.1	Q613 I627	E611-Q613 PolarHBondContact OE2-NE2 3.3Å; E611-I627 HydrophobicContact CB-CB 4.46Å; E611-I627 PolarHBondContact N-O 2.88Å; E611-I627 PolarHBondContact O-N 3.34Å
612	V	92.6	Very high	80.9	Confident	20 Å²	20	79.1 Å²	79.1	12%	0.121	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121	166.8	60.4	0	0	0	0	108.6	F624 V625 I626 I647 I650 K651 I654	V612-F624 HydrophobicContact CG2-CD2 4.1Å; V612-V625 WeakPolarHBondContact CA-O 3.45Å; V612-I626 HydrophobicContact CG2-CG1 4.48Å; V612-I647 HydrophobicContact CG2-CG1 4.34Å; V612-I650 HydrophobicContact CB-CG2 3.81Å; V612-I650 HydrophobicContact CG1-CB 4.31Å; V612-I650 HydrophobicContact CG1-CG2 3.72Å; V612-I650 HydrophobicContact CG2-CG2 4.41Å; V612-K651 HydrophobicContact CG1-CG 3.57Å; V612-I654 HydrophobicContact CG1-CD1 4.36Å
613	Q	88.2	Confident	81	Confident	68 Å²	68	71.2 Å²	71.2	32%	0.318	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.2	-179.6	-66	-172	3	0	0	109.7	E611 N615 V625 I627	E611-Q613 PolarHBondContact OE2-NE2 3.3Å; Q613-N615 HydrophobicContact CB-CB 4.32Å; Q613-N615 PolarHBondContact O-N 2.77Å; Q613-N615 PolarHBondContact OE1-ND2 2.84Å; Q613-V625 PolarHBondContact N-O 2.91Å; Q613-V625 PolarHBondContact O-N 2.86Å; Q613-I627 HydrophobicContact CB-CD1 4.46Å; Q613-I627 VanDerWaalsContact CD-CD1 3.41Å; Q613-I627 HydrophobicContact CG-CD1 3.92Å
614	E	83.7	Confident	81.3	Confident	104 Å²	104	69.4 Å²	69.4	49%	0.486	37%	0.368	S	S	.	.			trans	-81.1	99.1	167.1	-176.4	174.8	-171.5	0	0	107.9	K643 I647	E614-K643 WeakPolarHBondContact OE1-CE 3.31Å; E614-K643 IonicContact OE1-NZ 2.67Å; E614-K643 PolarHBondContact OE1-NZ 2.79Å; E614-I647 HydrophobicContact CB-CD1 4.33Å; E614-I647 HydrophobicContact CG-CD1 4.35Å
615	N	66.3	Low	81.4	Confident	64 Å²	64	65.2 Å²	65.2	34%	0.342	36%	0.355	S	S	.	.			trans	-157.7	150.1	-167.1	-98.9	-24.8	0	0	0	110.6	Q613	Q613-N615 HydrophobicContact CB-CB 4.32Å; Q613-N615 PolarHBondContact O-N 2.77Å; Q613-N615 PolarHBondContact OE1-ND2 2.84Å
616	V	58.7	Low	81.5	Confident	121 Å²	121	64.7 Å²	64.7	73%	0.733	35%	0.352	S	S	*	.			cis	-155.5	7.1	-28.7	90.4	0	0	0	0	112.2	Q618	V616-Q618 PolarHBondContact O-N 3.45Å
617	K	58.1	Low	81.5	Confident	111 Å²	111	63.3 Å²	63.3	48%	0.483	35%	0.345	S	S	.	.			trans	-85.5	113	-174.3	-61.1	171.5	-169.8	162.7	0	109.6	N619 V620 E634	K617-N619 PolarHBondContact O-N 3.14Å; K617-V620 PolarHBondContact O-N 3.32Å; K617-E634 WeakPolarHBondContact CE-OE1 3.21Å; K617-E634 IonicContact NZ-OE1 2.66Å; K617-E634 PolarHBondContact NZ-OE1 3.43Å; K617-E634 IonicContact NZ-OE2 2.7Å; K617-E634 PolarHBondContact NZ-OE2 2.97Å
618	Q	57	Low	81.4	Confident	196 Å²	196	63.8 Å²	63.8	92%	0.916	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-20.9	-179.9	-70.8	166.1	-46	0	0	113.9	V616 V620	V616-Q618 PolarHBondContact O-N 3.45Å; Q618-V620 PolarHBondContact O-N 3.11Å
619	N	62.3	Low	81.2	Confident	156 Å²	156	69.7 Å²	69.7	83%	0.834	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-1.1	-176.9	-66.4	8.3	0	0	0	115.2	K617	K617-N619 PolarHBondContact O-N 3.14Å
620	V	71.6	Confident	80.9	Confident	37 Å²	37	75.5 Å²	75.5	22%	0.224	38%	0.381	C	S	.	.	S	Bend	trans	-136.9	113.7	178.4	-167.6	0	0	0	0	110.7	M566 K617 Q618 T623	M566-V620 HydrophobicContact CE-CG1 4.04Å; K617-V620 PolarHBondContact O-N 3.32Å; Q618-V620 PolarHBondContact O-N 3.11Å; V620-T623 HydrophobicContact CB-CG2 3.83Å; V620-T623 HydrophobicContact CG1-CG2 3.49Å; V620-T623 VanDerWaalsContact CG1-CG2 3.49Å; V620-T623 PolarHBondContact O-OG1 2.8Å
621	P	80.8	Confident	80.5	Confident	82 Å²	82	82.9 Å²	82.9	53%	0.532	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	156.5	-179.6	30.9	-35.4	0	0	0	112.2	T623 Q636	P621-T623 VanDerWaalsContact C-N 3.26Å; P621-T623 PolarHBondContact O-N 2.93Å; P621-Q636 PolarHBondContact O-NE2 2.84Å
622	H	87.4	Confident	80.4	Confident	70 Å²	70	80.9 Å²	80.9	32%	0.324	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	25.5	173.9	-40.7	-50.8	0	0	0	115.7	A637 A640 K643	H622-A637 PolarHBondContact O-N 3.36Å; H622-A640 WeakPolarHBondContact ND1-CA 3.3Å; H622-A640 PolarHBondContact ND1-N 2.74Å; H622-K643 HydrophobicContact CB-CB 4.49Å
623	T	89.4	Confident	80.3	Confident	12 Å²	12	80 Å²	80	7%	0.074	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	154	176.3	54.4	0	0	0	0	114.7	M566 V620 P621 L635 Q636 K643	M566-T623 HydrophobicContact CG-CG2 4.41Å; V620-T623 HydrophobicContact CB-CG2 3.83Å; V620-T623 HydrophobicContact CG1-CG2 3.49Å; V620-T623 VanDerWaalsContact CG1-CG2 3.49Å; V620-T623 PolarHBondContact O-OG1 2.8Å; P621-T623 VanDerWaalsContact C-N 3.26Å; P621-T623 PolarHBondContact O-N 2.93Å; T623-L635 CarbonylContact C-O 3.6Å; T623-L635 WeakPolarHBondContact CA-O 3.19Å; T623-L635 WeakPolarHBondContact CB-O 3.45Å; T623-Q636 HydrophobicContact CG2-CB 4.08Å; T623-Q636 HydrophobicContact CG2-CG 4.37Å; T623-K643 WeakPolarHBondContact O-CE 3.26Å
624	F	92.3	Very high	80.4	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	167.1	168.7	63.3	-82	0	0	0	110.9	I563 V612 I626 L635 K643 W646 I647 I650	I563-F624 HydrophobicContact CD1-CE1 3.99Å; I563-F624 HydrophobicContact CD1-CZ 4.05Å; V612-F624 HydrophobicContact CG2-CD2 4.1Å; F624-I626 HydrophobicContact CD2-CG1 4.35Å; F624-I626 HydrophobicContact CE2-CD1 4.26Å; F624-I626 HydrophobicContact CE2-CG1 4.1Å; F624-L635 HydrophobicContact CD1-CB 4.41Å; F624-L635 HydrophobicContact CD2-CB 4.43Å; F624-L635 HydrophobicContact CD2-CD1 4.49Å; F624-L635 HydrophobicContact CE1-CB 4.09Å; F624-L635 HydrophobicContact CE2-CB 4.12Å; F624-L635 HydrophobicContact CE2-CD1 3.73Å; F624-L635 HydrophobicContact CZ-CB 3.94Å; F624-L635 HydrophobicContact CZ-CD1 3.97Å; F624-L635 PolarHBondContact N-O 3.32Å; F624-L635 PolarHBondContact O-N 3.2Å; F624-K643 HydrophobicContact CD1-CG 4.09Å; F624-W646 HydrophobicContact CE1-CB 4.41Å; F624-W646 HydrophobicContact CZ-CB 3.95Å; F624-W646 HydrophobicContact CZ-CG 4.37Å; F624-I647 HydrophobicContact CB-CD1 3.87Å; F624-I647 HydrophobicContact CB-CG1 4.09Å; F624-I647 HydrophobicContact CD2-CG1 4.26Å; F624-I647 HydrophobicContact CG-CD1 4.3Å; F624-I647 HydrophobicContact CG-CG1 4.08Å; F624-I650 HydrophobicContact CE2-CD1 4.34Å
625	V	92	Very high	80.8	Confident	24 Å²	24	73.4 Å²	73.4	15%	0.145	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.1	-178.9	-172.1	0	0	0	0	110.7	V612 Q613 I627 L633 E634	V612-V625 WeakPolarHBondContact CA-O 3.45Å; Q613-V625 PolarHBondContact N-O 2.91Å; Q613-V625 PolarHBondContact O-N 2.86Å; V625-I627 HydrophobicContact CG1-CD1 4.42Å; V625-I627 HydrophobicContact CG1-CG1 3.79Å; V625-L633 WeakPolarHBondContact CA-O 3.41Å; V625-E634 HydrophobicContact CG2-CG 4.31Å
626	I	93.6	Very high	82	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.9	165.7	-60	176.6	0	0	0	107.9	I605 M610 V612 F624 S632 L633 L635 I650	I605-I626 HydrophobicContact CD1-CG2 4.12Å; M610-I626 HydrophobicContact CE-CG2 4.16Å; M610-I626 HydrophobicContact CG-CG2 3.75Å; M610-I626 HydrophobicContact SD-CG2 3.43Å; M610-I626 WeakPolarHBondContact SD-CG2 3.29Å; V612-I626 HydrophobicContact CG2-CG1 4.48Å; F624-I626 HydrophobicContact CD2-CG1 4.35Å; F624-I626 HydrophobicContact CE2-CD1 4.26Å; F624-I626 HydrophobicContact CE2-CG1 4.1Å; I626-S632 CarbonylContact O-C 3.44Å; I626-S632 WeakPolarHBondContact O-CA 3.45Å; I626-S632 WeakPolarHBondContact O-CB 3.49Å; I626-L633 HydrophobicContact CB-CB 4.5Å; I626-L633 PolarHBondContact N-O 3.32Å; I626-L633 PolarHBondContact O-N 3.26Å; I626-L635 HydrophobicContact CD1-CD1 3.59Å; I626-L635 HydrophobicContact CG1-CD1 3.96Å; I626-I650 HydrophobicContact CD1-CD1 3.74Å; I626-I650 HydrophobicContact CG1-CD1 4.25Å
627	I	91.1	Very high	83.6	Confident	53 Å²	53	66.3 Å²	66.3	27%	0.272	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.4	-180	-55.1	-179.6	0	0	0	108.4	M610 E611 Q613 V625	M610-I627 CarbonylContact C-O 3.54Å; M610-I627 VanDerWaalsContact CA-O 3.3Å; M610-I627 WeakPolarHBondContact CA-O 3.11Å; M610-I627 WeakPolarHBondContact CG-O 3.41Å; E611-I627 HydrophobicContact CB-CB 4.46Å; E611-I627 PolarHBondContact N-O 2.88Å; E611-I627 PolarHBondContact O-N 3.34Å; Q613-I627 HydrophobicContact CB-CD1 4.46Å; Q613-I627 VanDerWaalsContact CD-CD1 3.41Å; Q613-I627 HydrophobicContact CG-CD1 3.92Å; V625-I627 HydrophobicContact CG1-CD1 4.42Å; V625-I627 HydrophobicContact CG1-CG1 3.79Å
628	G	88.9	Confident	85.2	Confident	12 Å²	12	68.7 Å²	68.7	12%	0.124	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	165.4	171.9	0	0	0	0	0	112.4	Q630 R631	G628-Q630 PolarHBondContact O-N 3.39Å; G628-R631 CarbonylContact C-O 3.55Å; G628-R631 WeakPolarHBondContact CA-O 3.2Å; G628-R631 PolarHBondContact N-O 2.79Å; G628-R631 PolarHBondContact O-N 3.37Å; G628-R631 VanDerWaalsContact O-O 3.04Å
629	K	83.8	Confident	86.8	Confident	161 Å²	161	62.2 Å²	62.2	70%	0.7	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.5	-24.2	-179.4	-76.8	170.1	167.1	157.1	0	117.5	A608	A608-K629 WeakPolarHBondContact O-CD 3.38Å; A608-K629 WeakPolarHBondContact O-CE 3.4Å; A608-K629 PolarHBondContact O-NZ 3.08Å
630	Q	78.1	Confident	88.1	Confident	176 Å²	176	57.6 Å²	57.6	82%	0.822	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	-15.4	-176.4	-58.4	-174.8	13.6	0	0	114	G628	G628-Q630 PolarHBondContact O-N 3.39Å
631	R	83.2	Confident	89.1	Confident	158 Å²	158	63.4 Å²	63.4	60%	0.596	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.7	148.3	-158.2	-75.7	-66.8	-164.2	-111	-1.7	110.6	E603 G628	E603-R631 WeakPolarHBondContact OE1-CD 3.24Å; E603-R631 WeakPolarHBondContact OE1-CG 3.42Å; E603-R631 IonicContact OE1-NE 2.84Å; E603-R631 PolarHBondContact OE1-NE 2.87Å; E603-R631 VanDerWaalsContact OE1-NE 3.08Å; G628-R631 CarbonylContact C-O 3.55Å; G628-R631 WeakPolarHBondContact CA-O 3.2Å; G628-R631 PolarHBondContact N-O 2.79Å; G628-R631 PolarHBondContact O-N 3.37Å; G628-R631 VanDerWaalsContact O-O 3.04Å
632	S	88.6	Confident	89.7	Confident	74 Å²	74	61.6 Å²	61.6	52%	0.517	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	153.4	169.7	55	0	0	0	0	111.9	I626	I626-S632 CarbonylContact O-C 3.44Å; I626-S632 WeakPolarHBondContact O-CA 3.45Å; I626-S632 WeakPolarHBondContact O-CB 3.49Å
633	L	90.6	Very high	89.9	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	113.5	179.9	-68.3	178.1	0	0	0	109.2	K565 Y587 E603 I605 V625 I626 L635	K565-L633 HydrophobicContact CD-CD2 3.99Å; Y587-L633 HydrophobicContact CD1-CD2 4.42Å; Y587-L633 HydrophobicContact CD2-CD1 4.09Å; Y587-L633 HydrophobicContact CG-CD1 3.83Å; Y587-L633 HydrophobicContact CG-CD2 4.38Å; E603-L633 WeakPolarHBondContact OE2-CD2 3.41Å; I605-L633 HydrophobicContact CD1-CD1 3.75Å; I605-L633 HydrophobicContact CD1-CG 4.01Å; V625-L633 WeakPolarHBondContact CA-O 3.41Å; I626-L633 HydrophobicContact CB-CB 4.5Å; I626-L633 PolarHBondContact N-O 3.32Å; I626-L633 PolarHBondContact O-N 3.26Å; L633-L635 HydrophobicContact CB-CD1 4.35Å; L633-L635 HydrophobicContact CB-CD2 4.3Å; L633-L635 HydrophobicContact CB-CG 4.12Å
634	E	91.3	Very high	90.1	Very high	34 Å²	34	62.5 Å²	62.5	16%	0.159	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122	166.6	-169.7	177	176.3	0	0	108.7	M566 K617 V625	M566-E634 HydrophobicContact CB-CB 4.14Å; M566-E634 HydrophobicContact CB-CG 3.83Å; M566-E634 HydrophobicContact CG-CG 4.07Å; M566-E634 PolarHBondContact N-O 2.88Å; K617-E634 WeakPolarHBondContact CE-OE1 3.21Å; K617-E634 IonicContact NZ-OE1 2.66Å; K617-E634 PolarHBondContact NZ-OE1 3.43Å; K617-E634 IonicContact NZ-OE2 2.7Å; K617-E634 PolarHBondContact NZ-OE2 2.97Å; V625-E634 HydrophobicContact CG2-CG 4.31Å
635	L	92.3	Very high	90.2	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	154.7	-168.2	-63.9	173.9	0	0	0	110.8	I563 K564 K565 L578 T623 F624 I626 L633	I563-L635 HydrophobicContact CG1-CB 4.04Å; I563-L635 HydrophobicContact CG1-CD2 4.17Å; I563-L635 HydrophobicContact CG1-CG 4.47Å; I563-L635 HydrophobicContact CG2-CD2 4Å; K564-L635 CarbonylContact O-C 3.58Å; K564-L635 VanDerWaalsContact O-CA 3.31Å; K564-L635 WeakPolarHBondContact O-CA 3.27Å; K565-L635 HydrophobicContact CB-CD2 4.27Å; L578-L635 HydrophobicContact CD1-CD1 4.03Å; T623-L635 CarbonylContact C-O 3.6Å; T623-L635 WeakPolarHBondContact CA-O 3.19Å; T623-L635 WeakPolarHBondContact CB-O 3.45Å; F624-L635 HydrophobicContact CD1-CB 4.41Å; F624-L635 HydrophobicContact CD2-CB 4.43Å; F624-L635 HydrophobicContact CD2-CD1 4.49Å; F624-L635 HydrophobicContact CE1-CB 4.09Å; F624-L635 HydrophobicContact CE2-CB 4.12Å; F624-L635 HydrophobicContact CE2-CD1 3.73Å; F624-L635 HydrophobicContact CZ-CB 3.94Å; F624-L635 HydrophobicContact CZ-CD1 3.97Å; F624-L635 PolarHBondContact N-O 3.32Å; F624-L635 PolarHBondContact O-N 3.2Å; I626-L635 HydrophobicContact CD1-CD1 3.59Å; I626-L635 HydrophobicContact CG1-CD1 3.96Å; L633-L635 HydrophobicContact CB-CD1 4.35Å; L633-L635 HydrophobicContact CB-CD2 4.3Å; L633-L635 HydrophobicContact CB-CG 4.12Å
636	Q	91.1	Very high	90.4	Very high	31 Å²	31	64.6 Å²	64.6	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.6	176.9	178.8	-178.4	51.7	0	0	109.9	I563 K564 M566 P621 T623	I563-Q636 VanDerWaalsContact CD1-O 3.27Å; I563-Q636 WeakPolarHBondContact CD1-O 3.26Å; I563-Q636 WeakPolarHBondContact CG1-O 3.49Å; K564-Q636 HydrophobicContact CB-CB 4.06Å; K564-Q636 PolarHBondContact N-O 3.4Å; K564-Q636 PolarHBondContact O-N 2.81Å; M566-Q636 HydrophobicContact CG-CB 4.44Å; M566-Q636 HydrophobicContact SD-CB 3.94Å; P621-Q636 PolarHBondContact O-NE2 2.84Å; T623-Q636 HydrophobicContact CG2-CB 4.08Å; T623-Q636 HydrophobicContact CG2-CG 4.37Å
637	A	92.5	Very high	90.4	Very high	5 Å²	5	64.6 Å²	64.6	4%	0.041	32%	0.315	C	S	.	.			trans	-88.4	167	170.7	0	0	0	0	0	111.8	I563 H622 E642 K643	I563-A637 HydrophobicContact CD1-CB 4.26Å; H622-A637 PolarHBondContact O-N 3.36Å; A637-E642 HydrophobicContact CB-CB 4.06Å; A637-E642 HydrophobicContact CB-CG 3.96Å; A637-K643 HydrophobicContact CB-CB 3.83Å
638	R	90.3	Very high	90.6	Very high	161 Å²	161	67.2 Å²	67.2	61%	0.608	33%	0.326	S	S	*	.	S	Bend	trans	-76.2	-32.7	178.4	-60	172.7	172.6	-161.2	-4	112.3	E642	R638-E642 WeakPolarHBondContact CB-OE2 3.49Å; R638-E642 WeakPolarHBondContact CG-OE2 3.36Å; R638-E642 PolarHBondContact N-OE2 2.66Å
639	T	91	Very high	91	Very high	61 Å²	61	68.4 Å²	68.4	37%	0.374	33%	0.331	S	S	.	.	S	Bend	trans	-133.3	167	179.6	69.3	0	0	0	0	111.4	E641 E642 K643	T639-E641 VanDerWaalsContact C-N 3.31Å; T639-E642 WeakPolarHBondContact OG1-CB 3.27Å; T639-E642 PolarHBondContact OG1-N 3.46Å; T639-K643 PolarHBondContact O-N 2.7Å; T639-K643 VanDerWaalsContact O-N 3.14Å
640	A	90.1	Very high	91.5	Very high	58 Å²	58	60.8 Å²	60.8	48%	0.479	30%	0.298	S	S	.	.	H	α-helix	trans	-63.7	-37.6	172	0	0	0	0	0	112.2	H622 K643 E644	H622-A640 WeakPolarHBondContact ND1-CA 3.3Å; H622-A640 PolarHBondContact ND1-N 2.74Å; A640-K643 WeakPolarHBondContact O-CB 3.22Å; A640-K643 PolarHBondContact O-N 2.94Å; A640-E644 PolarHBondContact O-N 3.43Å
641	E	92.1	Very high	92.3	Very high	160 Å²	160	57.1 Å²	57.1	75%	0.748	28%	0.279	S	S	*	.	H	α-helix	trans	-64.3	-48.1	177.3	-62.9	166.8	179.2	0	0	111.4	T639 K643 E644 D645	T639-E641 VanDerWaalsContact C-N 3.31Å; E641-K643 VanDerWaalsContact C-N 3.31Å; E641-K643 PolarHBondContact O-N 2.9Å; E641-E644 PolarHBondContact O-N 3.48Å; E641-E644 VanDerWaalsContact O-N 3.16Å; E641-D645 VanDerWaalsContact O-CB 3.29Å; E641-D645 WeakPolarHBondContact O-CB 3.44Å; E641-D645 PolarHBondContact O-N 3.32Å
642	E	93.7	Very high	92.8	Very high	44 Å²	44	52.4 Å²	52.4	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-38.4	177.8	-179.2	-178.2	-138.6	0	0	111.2	A637 R638 T639 W646	A637-E642 HydrophobicContact CB-CB 4.06Å; A637-E642 HydrophobicContact CB-CG 3.96Å; R638-E642 WeakPolarHBondContact CB-OE2 3.49Å; R638-E642 WeakPolarHBondContact CG-OE2 3.36Å; R638-E642 PolarHBondContact N-OE2 2.66Å; T639-E642 WeakPolarHBondContact OG1-CB 3.27Å; T639-E642 PolarHBondContact OG1-N 3.46Å; E642-W646 WeakPolarHBondContact O-CB 3.29Å; E642-W646 PolarHBondContact O-N 2.83Å
643	K	92.6	Very high	93.1	Very high	35 Å²	35	49 Å²	49	15%	0.152	25%	0.25	C	C	.	.	H	α-helix	trans	-57	-52.9	171.7	167.4	-171.2	160.2	-160.9	0	110.6	E614 H622 T623 F624 A637 T639 A640 E641 W646 I647	E614-K643 WeakPolarHBondContact OE1-CE 3.31Å; E614-K643 IonicContact OE1-NZ 2.67Å; E614-K643 PolarHBondContact OE1-NZ 2.79Å; H622-K643 HydrophobicContact CB-CB 4.49Å; T623-K643 WeakPolarHBondContact O-CE 3.26Å; F624-K643 HydrophobicContact CD1-CG 4.09Å; A637-K643 HydrophobicContact CB-CB 3.83Å; T639-K643 PolarHBondContact O-N 2.7Å; T639-K643 VanDerWaalsContact O-N 3.14Å; A640-K643 WeakPolarHBondContact O-CB 3.22Å; A640-K643 PolarHBondContact O-N 2.94Å; E641-K643 VanDerWaalsContact C-N 3.31Å; E641-K643 PolarHBondContact O-N 2.9Å; K643-W646 PolarHBondContact O-N 3.08Å; K643-I647 HydrophobicContact CD-CD1 4.23Å; K643-I647 HydrophobicContact CG-CD1 3.62Å; K643-I647 HydrophobicContact CG-CG1 4.42Å; K643-I647 VanDerWaalsContact O-CG1 3.27Å; K643-I647 WeakPolarHBondContact O-CG1 3.37Å; K643-I647 PolarHBondContact O-N 2.74Å
644	E	93	Very high	93.2	Very high	65 Å²	65	50.7 Å²	50.7	30%	0.304	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-41.1	-172.6	-176.4	55	-159.1	0	0	111.7	A640 E641 I647 Q648	A640-E644 PolarHBondContact O-N 3.43Å; E641-E644 PolarHBondContact O-N 3.48Å; E641-E644 VanDerWaalsContact O-N 3.16Å; E644-I647 PolarHBondContact O-N 2.91Å; E644-Q648 HydrophobicContact CG-CG 4.3Å; E644-Q648 WeakPolarHBondContact O-CB 3.46Å; E644-Q648 VanDerWaalsContact O-CG 3.32Å; E644-Q648 WeakPolarHBondContact O-CG 3.48Å; E644-Q648 PolarHBondContact O-N 3.44Å; E644-Q648 VanDerWaalsContact OE1-CG 3.26Å; E644-Q648 WeakPolarHBondContact OE1-CG 3.24Å; E644-Q648 PolarHBondContact OE1-NE2 3.38Å
645	D	95.4	Very high	93.2	Very high	65 Å²	65	52.5 Å²	52.5	35%	0.348	27%	0.267	S	S	.	.	H	α-helix	trans	-55.2	-51	170.7	169.3	14.8	0	0	0	111.8	K559 E641 I647 Q648 V649	K559-D645 WeakPolarHBondContact CE-OD1 3.42Å; K559-D645 WeakPolarHBondContact CE-OD2 3.18Å; K559-D645 IonicContact NZ-OD1 3.17Å; K559-D645 PolarHBondContact NZ-OD1 2.87Å; K559-D645 IonicContact NZ-OD2 2.68Å; K559-D645 PolarHBondContact NZ-OD2 2.81Å; E641-D645 VanDerWaalsContact O-CB 3.29Å; E641-D645 WeakPolarHBondContact O-CB 3.44Å; E641-D645 PolarHBondContact O-N 3.32Å; D645-I647 VanDerWaalsContact C-N 3.35Å; D645-I647 PolarHBondContact O-N 3.14Å; D645-Q648 PolarHBondContact O-N 3.38Å; D645-V649 WeakPolarHBondContact O-CB 3.4Å; D645-V649 VanDerWaalsContact O-CG2 3.27Å; D645-V649 WeakPolarHBondContact O-CG2 3.31Å; D645-V649 PolarHBondContact O-N 3.03Å; D645-V649 WeakPolarHBondContact OD1-CG2 3.33Å
646	W	95.5	Very high	93.1	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.011	28%	0.283	C	S	.	.	H	α-helix	trans	-58	-44.9	173.6	-85.1	112.5	0	0	0	112.5	K559 L578 L580 F624 E642 K643 I650	K559-W646 HydrophobicContact CB-CH2 4.02Å; K559-W646 HydrophobicContact CB-CZ3 3.9Å; K559-W646 HydrophobicContact CD-CD2 3.84Å; K559-W646 HydrophobicContact CD-CE3 3.68Å; K559-W646 HydrophobicContact CD-CH2 3.91Å; K559-W646 HydrophobicContact CD-CZ2 4.07Å; K559-W646 HydrophobicContact CD-CZ3 3.72Å; K559-W646 HydrophobicContact CG-CE3 4.38Å; K559-W646 HydrophobicContact CG-CH2 3.74Å; K559-W646 HydrophobicContact CG-CZ2 4.1Å; K559-W646 HydrophobicContact CG-CZ3 3.9Å; L578-W646 HydrophobicContact CB-CH2 3.83Å; L578-W646 HydrophobicContact CB-CZ2 4.35Å; L578-W646 HydrophobicContact CB-CZ3 4.27Å; L578-W646 HydrophobicContact CD1-CZ3 4.48Å; L580-W646 HydrophobicContact CB-CZ3 4.07Å; F624-W646 HydrophobicContact CE1-CB 4.41Å; F624-W646 HydrophobicContact CZ-CB 3.95Å; F624-W646 HydrophobicContact CZ-CG 4.37Å; E642-W646 WeakPolarHBondContact O-CB 3.29Å; E642-W646 PolarHBondContact O-N 2.83Å; K643-W646 PolarHBondContact O-N 3.08Å; W646-I650 HydrophobicContact CE3-CD1 4.26Å; W646-I650 VanDerWaalsContact O-CB 3.27Å; W646-I650 WeakPolarHBondContact O-CB 3.48Å; W646-I650 VanDerWaalsContact O-CD1 3.32Å; W646-I650 WeakPolarHBondContact O-CD1 3.36Å; W646-I650 WeakPolarHBondContact O-CG1 3.3Å; W646-I650 PolarHBondContact O-N 3.36Å
647	I	94	Very high	92.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-46.7	179.5	-71.6	171	0	0	0	111.1	V612 E614 F624 K643 E644 D645 I650 K651	V612-I647 HydrophobicContact CG2-CG1 4.34Å; E614-I647 HydrophobicContact CB-CD1 4.33Å; E614-I647 HydrophobicContact CG-CD1 4.35Å; F624-I647 HydrophobicContact CB-CD1 3.87Å; F624-I647 HydrophobicContact CB-CG1 4.09Å; F624-I647 HydrophobicContact CD2-CG1 4.26Å; F624-I647 HydrophobicContact CG-CD1 4.3Å; F624-I647 HydrophobicContact CG-CG1 4.08Å; K643-I647 HydrophobicContact CD-CD1 4.23Å; K643-I647 HydrophobicContact CG-CD1 3.62Å; K643-I647 HydrophobicContact CG-CG1 4.42Å; K643-I647 VanDerWaalsContact O-CG1 3.27Å; K643-I647 WeakPolarHBondContact O-CG1 3.37Å; K643-I647 PolarHBondContact O-N 2.74Å; E644-I647 PolarHBondContact O-N 2.91Å; D645-I647 VanDerWaalsContact C-N 3.35Å; D645-I647 PolarHBondContact O-N 3.14Å; I647-I650 PolarHBondContact O-N 3.32Å; I647-K651 HydrophobicContact CG2-CD 3.79Å; I647-K651 HydrophobicContact CG2-CG 4.39Å; I647-K651 WeakPolarHBondContact O-CB 3.44Å; I647-K651 VanDerWaalsContact O-CG 3.26Å; I647-K651 WeakPolarHBondContact O-CG 3.31Å; I647-K651 PolarHBondContact O-N 3.49Å
648	Q	95	Very high	92.7	Very high	108 Å²	108	61.8 Å²	61.8	51%	0.505	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-48.4	-179.3	-72.6	-176.9	12.7	0	0	111.8	E644 D645 I650 K651 A652	E644-Q648 HydrophobicContact CG-CG 4.3Å; E644-Q648 WeakPolarHBondContact O-CB 3.46Å; E644-Q648 VanDerWaalsContact O-CG 3.32Å; E644-Q648 WeakPolarHBondContact O-CG 3.48Å; E644-Q648 PolarHBondContact O-N 3.44Å; E644-Q648 VanDerWaalsContact OE1-CG 3.26Å; E644-Q648 WeakPolarHBondContact OE1-CG 3.24Å; E644-Q648 PolarHBondContact OE1-NE2 3.38Å; D645-Q648 PolarHBondContact O-N 3.38Å; Q648-I650 VanDerWaalsContact C-N 3.29Å; Q648-I650 PolarHBondContact O-N 2.75Å; Q648-K651 PolarHBondContact O-N 3.38Å; Q648-A652 WeakPolarHBondContact O-CB 3.39Å; Q648-A652 PolarHBondContact O-N 3.18Å
649	V	96.1	Very high	92.5	Very high	38 Å²	38	58.8 Å²	58.8	23%	0.23	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-34.3	-179.8	-179.8	0	0	0	0	111.2	I558 K559 L580 D645 T653	I558-V649 HydrophobicContact CG2-CG1 3.53Å; K559-V649 HydrophobicContact CB-CG1 4.39Å; K559-V649 HydrophobicContact CD-CB 4.4Å; K559-V649 HydrophobicContact CD-CG1 4.38Å; K559-V649 HydrophobicContact CD-CG2 4.47Å; L580-V649 HydrophobicContact CD2-CB 4.5Å; L580-V649 HydrophobicContact CD2-CG1 3.71Å; D645-V649 WeakPolarHBondContact O-CB 3.4Å; D645-V649 VanDerWaalsContact O-CG2 3.27Å; D645-V649 WeakPolarHBondContact O-CG2 3.31Å; D645-V649 PolarHBondContact O-N 3.03Å; D645-V649 WeakPolarHBondContact OD1-CG2 3.33Å; V649-T653 VanDerWaalsContact O-CB 3.31Å; V649-T653 WeakPolarHBondContact O-CB 3.23Å; V649-T653 PolarHBondContact O-N 3.39Å; V649-T653 PolarHBondContact O-OG1 2.86Å
650	I	95.1	Very high	92	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-67.7	-50	172.2	-69.7	167.1	0	0	0	111.3	L580 M610 V612 F624 I626 W646 I647 Q648 A652 T653 I654	L580-I650 HydrophobicContact CD1-CG1 4.36Å; L580-I650 HydrophobicContact CD2-CG1 3.9Å; M610-I650 HydrophobicContact CE-CG2 3.46Å; M610-I650 VanDerWaalsContact CE-CG2 3.46Å; V612-I650 HydrophobicContact CB-CG2 3.81Å; V612-I650 HydrophobicContact CG1-CB 4.31Å; V612-I650 HydrophobicContact CG1-CG2 3.72Å; V612-I650 HydrophobicContact CG2-CG2 4.41Å; F624-I650 HydrophobicContact CE2-CD1 4.34Å; I626-I650 HydrophobicContact CD1-CD1 3.74Å; I626-I650 HydrophobicContact CG1-CD1 4.25Å; W646-I650 HydrophobicContact CE3-CD1 4.26Å; W646-I650 VanDerWaalsContact O-CB 3.27Å; W646-I650 WeakPolarHBondContact O-CB 3.48Å; W646-I650 VanDerWaalsContact O-CD1 3.32Å; W646-I650 WeakPolarHBondContact O-CD1 3.36Å; W646-I650 WeakPolarHBondContact O-CG1 3.3Å; W646-I650 PolarHBondContact O-N 3.36Å; I647-I650 PolarHBondContact O-N 3.32Å; Q648-I650 VanDerWaalsContact C-N 3.29Å; Q648-I650 PolarHBondContact O-N 2.75Å; I650-A652 VanDerWaalsContact C-N 3.35Å; I650-A652 PolarHBondContact O-N 2.79Å; I650-T653 PolarHBondContact O-N 3.05Å; I650-T653 VanDerWaalsContact O-N 3.13Å; I650-I654 HydrophobicContact CG2-CD1 3.75Å; I650-I654 HydrophobicContact CG2-CG1 4.43Å; I650-I654 WeakPolarHBondContact O-CG1 3.12Å; I650-I654 PolarHBondContact O-N 3.02Å
651	K	94.3	Very high	91.4	Very high	98 Å²	98	60.5 Å²	60.5	43%	0.426	30%	0.3	S	S	.	.	H	α-helix	trans	-54.4	-49.1	176.6	-76.3	169.7	179.8	164.7	0	111.1	V612 I647 Q648 T653 I654 E655	V612-K651 HydrophobicContact CG1-CG 3.57Å; I647-K651 HydrophobicContact CG2-CD 3.79Å; I647-K651 HydrophobicContact CG2-CG 4.39Å; I647-K651 WeakPolarHBondContact O-CB 3.44Å; I647-K651 VanDerWaalsContact O-CG 3.26Å; I647-K651 WeakPolarHBondContact O-CG 3.31Å; I647-K651 PolarHBondContact O-N 3.49Å; Q648-K651 PolarHBondContact O-N 3.38Å; K651-T653 VanDerWaalsContact C-N 3.33Å; K651-T653 PolarHBondContact O-N 2.67Å; K651-I654 PolarHBondContact O-N 2.87Å; K651-E655 PolarHBondContact O-N 3.47Å
652	A	94.4	Very high	90.6	Very high	59 Å²	59	56.2 Å²	56.2	49%	0.488	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-36.2	178.2	0	0	0	0	0	112.8	Q648 I650 R656	Q648-A652 WeakPolarHBondContact O-CB 3.39Å; Q648-A652 PolarHBondContact O-N 3.18Å; I650-A652 VanDerWaalsContact C-N 3.35Å; I650-A652 PolarHBondContact O-N 2.79Å; A652-R656 VanDerWaalsContact O-CB 3.22Å; A652-R656 WeakPolarHBondContact O-CB 3.22Å; A652-R656 PolarHBondContact O-N 3.43Å
653	T	93.8	Very high	89.4	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-69.6	-40.9	176.8	-61.3	0	0	0	0	112.1	L580 I607 V649 I650 K651 H657	L580-T653 HydrophobicContact CD1-CG2 4.23Å; I607-T653 HydrophobicContact CD1-CG2 4.05Å; I607-T653 HydrophobicContact CG1-CG2 4.32Å; V649-T653 VanDerWaalsContact O-CB 3.31Å; V649-T653 WeakPolarHBondContact O-CB 3.23Å; V649-T653 PolarHBondContact O-N 3.39Å; V649-T653 PolarHBondContact O-OG1 2.86Å; I650-T653 PolarHBondContact O-N 3.05Å; I650-T653 VanDerWaalsContact O-N 3.13Å; K651-T653 VanDerWaalsContact C-N 3.33Å; K651-T653 PolarHBondContact O-N 2.67Å; T653-H657 WeakPolarHBondContact O-CB 3.35Å; T653-H657 PolarHBondContact O-N 2.86Å
654	I	93.4	Very high	87.7	Confident	36 Å²	36	63.3 Å²	63.3	19%	0.185	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-49.7	174.4	-64.6	158.4	0	0	0	110.7	I607 M610 V612 I650 K651 H657 K658	I607-I654 HydrophobicContact CG2-CB 4.4Å; I607-I654 HydrophobicContact CG2-CG1 4.1Å; M610-I654 HydrophobicContact CE-CD1 3.85Å; M610-I654 HydrophobicContact CE-CG1 3.97Å; M610-I654 WeakPolarHBondContact O-CD1 3.41Å; V612-I654 HydrophobicContact CG1-CD1 4.36Å; I650-I654 HydrophobicContact CG2-CD1 3.75Å; I650-I654 HydrophobicContact CG2-CG1 4.43Å; I650-I654 WeakPolarHBondContact O-CG1 3.12Å; I650-I654 PolarHBondContact O-N 3.02Å; K651-I654 PolarHBondContact O-N 2.87Å; I654-H657 PolarHBondContact O-N 3.37Å; I654-K658 WeakPolarHBondContact O-CB 3.28Å; I654-K658 PolarHBondContact O-N 3.42Å
655	E	92.1	Very high	86.2	Confident	71 Å²	71	64.7 Å²	64.7	33%	0.332	33%	0.327	S	S	.	.	H	α-helix	trans	-68.3	-40.6	-177.4	-176.2	55.4	-149.4	0	0	112	K651 H657 K658 Q659	K651-E655 PolarHBondContact O-N 3.47Å; E655-H657 VanDerWaalsContact C-N 3.35Å; E655-H657 PolarHBondContact O-N 3.14Å; E655-K658 WeakPolarHBondContact O-CB 3.49Å; E655-K658 PolarHBondContact O-N 3.4Å; E655-K658 IonicContact OE1-NZ 3.87Å; E655-K658 PolarHBondContact OE1-NZ 2.95Å; E655-K658 IonicContact OE2-NZ 3.9Å; E655-K658 PolarHBondContact OE2-NZ 3.41Å; E655-Q659 WeakPolarHBondContact O-CG 3.01Å; E655-Q659 PolarHBondContact O-N 3.15Å; E655-Q659 WeakPolarHBondContact OE1-CG 3.33Å; E655-Q659 PolarHBondContact OE1-NE2 2.94Å
656	R	89.4	Confident	84.7	Confident	88 Å²	88	67.6 Å²	67.6	33%	0.332	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-41.7	172.6	-178	173.5	62.1	127.2	1	112.1	E556 A652 Q659 N660	E556-R656 IonicContact OE2-CZ 3.28Å; E556-R656 IonicContact OE2-NH1 3.46Å; E556-R656 PolarHBondContact OE2-NH1 3.13Å; E556-R656 IonicContact OE2-NH2 2.71Å; E556-R656 PolarHBondContact OE2-NH2 3.48Å; A652-R656 VanDerWaalsContact O-CB 3.22Å; A652-R656 WeakPolarHBondContact O-CB 3.22Å; A652-R656 PolarHBondContact O-N 3.43Å; R656-Q659 PolarHBondContact O-N 3.31Å; R656-N660 WeakPolarHBondContact O-CB 3.36Å; R656-N660 VanDerWaalsContact O-CG 3.25Å; R656-N660 PolarHBondContact O-N 2.95Å; R656-N660 PolarHBondContact O-ND2 3.07Å
657	H	87.9	Confident	82.5	Confident	56 Å²	56	70.2 Å²	70.2	26%	0.259	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-43.2	175	-179	-68.9	0	0	0	111.3	N582 I607 T653 I654 E655 S661	N582-H657 PolarHBondContact O-CD2 2.9Å; I607-H657 HydrophobicContact CG2-CB 3.66Å; T653-H657 WeakPolarHBondContact O-CB 3.35Å; T653-H657 PolarHBondContact O-N 2.86Å; I654-H657 PolarHBondContact O-N 3.37Å; E655-H657 VanDerWaalsContact C-N 3.35Å; E655-H657 PolarHBondContact O-N 3.14Å; H657-S661 WeakPolarHBondContact O-CB 3.36Å; H657-S661 PolarHBondContact O-N 3.35Å; H657-S661 PolarHBondContact O-OG 3.39Å
658	K	87.4	Confident	80.1	Confident	87 Å²	87	76.2 Å²	76.2	38%	0.378	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-52.2	175.3	171.4	173.3	149.2	-106.8	0	111.3	I654 E655 N660 S661 E662	I654-K658 WeakPolarHBondContact O-CB 3.28Å; I654-K658 PolarHBondContact O-N 3.42Å; E655-K658 WeakPolarHBondContact O-CB 3.49Å; E655-K658 PolarHBondContact O-N 3.4Å; E655-K658 IonicContact OE1-NZ 3.87Å; E655-K658 PolarHBondContact OE1-NZ 2.95Å; E655-K658 IonicContact OE2-NZ 3.9Å; E655-K658 PolarHBondContact OE2-NZ 3.41Å; K658-N660 PolarHBondContact O-N 2.64Å; K658-S661 CarbonylContact O-C 3.55Å; K658-S661 PolarHBondContact O-N 3Å; K658-S661 VanDerWaalsContact O-N 3.08Å; K658-S661 PolarHBondContact O-OG 3.48Å; K658-E662 VanDerWaalsContact CE-OE1 3.31Å; K658-E662 WeakPolarHBondContact CE-OE1 3.39Å; K658-E662 PolarHBondContact O-N 3.07Å
659	Q	86.4	Confident	77.6	Confident	99 Å²	99	74.7 Å²	74.7	46%	0.463	39%	0.387	S	S	.	.	H	α-helix	trans	-59.1	-41.5	179.2	-70.3	173.2	7.9	0	0	113	E655 R656 E662 T663	E655-Q659 WeakPolarHBondContact O-CG 3.01Å; E655-Q659 PolarHBondContact O-N 3.15Å; E655-Q659 WeakPolarHBondContact OE1-CG 3.33Å; E655-Q659 PolarHBondContact OE1-NE2 2.94Å; R656-Q659 PolarHBondContact O-N 3.31Å; Q659-E662 PolarHBondContact O-N 3.49Å; Q659-T663 WeakPolarHBondContact O-CB 3.49Å; Q659-T663 PolarHBondContact O-N 3.32Å; Q659-T663 PolarHBondContact O-OG1 2.96Å
660	N	80.1	Confident	75.1	Confident	105 Å²	105	76.4 Å²	76.4	56%	0.561	40%	0.4	S	S	*	.	H	α-helix	trans	-61.6	-44.4	173.8	-73.6	-12.7	0	0	0	111.6	R656 K658 T663 F664	R656-N660 WeakPolarHBondContact O-CB 3.36Å; R656-N660 VanDerWaalsContact O-CG 3.25Å; R656-N660 PolarHBondContact O-N 2.95Å; R656-N660 PolarHBondContact O-ND2 3.07Å; K658-N660 PolarHBondContact O-N 2.64Å; N660-T663 PolarHBondContact O-N 2.79Å; N660-F664 PolarHBondContact O-N 3.44Å
661	S	77.3	Confident	72.6	Confident	49 Å²	49	80.6 Å²	80.6	34%	0.343	43%	0.43	S	S	.	.	H	α-helix	trans	-67.3	-37.1	178.1	76.8	0	0	0	0	112.9	H657 K658 N665	H657-S661 WeakPolarHBondContact O-CB 3.36Å; H657-S661 PolarHBondContact O-N 3.35Å; H657-S661 PolarHBondContact O-OG 3.39Å; K658-S661 CarbonylContact O-C 3.55Å; K658-S661 PolarHBondContact O-N 3Å; K658-S661 VanDerWaalsContact O-N 3.08Å; K658-S661 PolarHBondContact O-OG 3.48Å; S661-N665 WeakPolarHBondContact O-CB 3.38Å; S661-N665 VanDerWaalsContact O-CG 3.27Å; S661-N665 PolarHBondContact O-N 2.94Å; S661-N665 PolarHBondContact O-ND2 3.49Å
662	E	75.1	Confident	69.9	Low	71 Å²	71	83.9 Å²	83.9	33%	0.332	44%	0.444	S	S	.	.	H	α-helix	trans	-66.8	-41.9	173.6	-78.1	-170.6	-146.2	0	0	112.1	K658 Q659 F664 N665 K666	K658-E662 VanDerWaalsContact CE-OE1 3.31Å; K658-E662 WeakPolarHBondContact CE-OE1 3.39Å; K658-E662 PolarHBondContact O-N 3.07Å; Q659-E662 PolarHBondContact O-N 3.49Å; E662-F664 VanDerWaalsContact C-N 3.33Å; E662-F664 PolarHBondContact O-N 3.29Å; E662-N665 PolarHBondContact O-N 3.41Å; E662-K666 HydrophobicContact CB-CD 4.5Å; E662-K666 VanDerWaalsContact O-CB 3.29Å; E662-K666 WeakPolarHBondContact O-CB 3.45Å; E662-K666 WeakPolarHBondContact O-CD 3.49Å; E662-K666 VanDerWaalsContact O-CG 3.22Å; E662-K666 WeakPolarHBondContact O-CG 3.34Å; E662-K666 PolarHBondContact O-N 3.42Å; E662-K666 IonicContact OE2-NZ 2.61Å; E662-K666 PolarHBondContact OE2-NZ 2.71Å
663	T	69.3	Low	67.4	Low	91 Å²	91	85.9 Å²	85.9	56%	0.558	45%	0.454	S	S	*	.	H	α-helix	trans	-63.6	-42.2	179	-56.5	0	0	0	0	110.6	Q659 N660 K666 A667	Q659-T663 WeakPolarHBondContact O-CB 3.49Å; Q659-T663 PolarHBondContact O-N 3.32Å; Q659-T663 PolarHBondContact O-OG1 2.96Å; N660-T663 PolarHBondContact O-N 2.79Å; T663-K666 PolarHBondContact O-N 3.11Å; T663-A667 WeakPolarHBondContact O-CB 3.29Å; T663-A667 PolarHBondContact O-N 2.94Å
664	F	56.4	Low	65	Low	137 Å²	137	97 Å²	97	60%	0.601	50%	0.496	S	S	*	.	H	α-helix	trans	-60.5	-49	171.9	-175.5	-93.6	0	0	0	112	N660 E662 K666 A667 F668	N660-F664 PolarHBondContact O-N 3.44Å; E662-F664 VanDerWaalsContact C-N 3.33Å; E662-F664 PolarHBondContact O-N 3.29Å; F664-K666 VanDerWaalsContact C-N 3.34Å; F664-K666 PolarHBondContact O-N 3.14Å; F664-A667 PolarHBondContact O-N 2.77Å; F664-F668 HydrophobicContact CZ-CD2 4.46Å; F664-F668 PolarHBondContact O-N 2.87Å
665	N	61.8	Low	62.5	Low	93 Å²	93	104.4 Å²	104.4	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-63.4	-36.7	178.1	-75.7	-40.7	0	0	0	112.9	S661 E662 S669	S661-N665 WeakPolarHBondContact O-CB 3.38Å; S661-N665 VanDerWaalsContact O-CG 3.27Å; S661-N665 PolarHBondContact O-N 2.94Å; S661-N665 PolarHBondContact O-ND2 3.49Å; E662-N665 PolarHBondContact O-N 3.41Å; N665-S669 VanDerWaalsContact O-CB 3.28Å; N665-S669 WeakPolarHBondContact O-CB 3.35Å; N665-S669 PolarHBondContact O-N 2.87Å; N665-S669 PolarHBondContact O-OG 2.59Å
666	K	63.7	Low	60	Low	127 Å²	127	108.8 Å²	108.8	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-65.5	-47	175.8	-77.1	159.9	176.5	159.4	0	110.9	E662 T663 F664 F668 S669 S670	E662-K666 HydrophobicContact CB-CD 4.5Å; E662-K666 VanDerWaalsContact O-CB 3.29Å; E662-K666 WeakPolarHBondContact O-CB 3.45Å; E662-K666 WeakPolarHBondContact O-CD 3.49Å; E662-K666 VanDerWaalsContact O-CG 3.22Å; E662-K666 WeakPolarHBondContact O-CG 3.34Å; E662-K666 PolarHBondContact O-N 3.42Å; E662-K666 IonicContact OE2-NZ 2.61Å; E662-K666 PolarHBondContact OE2-NZ 2.71Å; T663-K666 PolarHBondContact O-N 3.11Å; F664-K666 VanDerWaalsContact C-N 3.34Å; F664-K666 PolarHBondContact O-N 3.14Å; K666-F668 VanDerWaalsContact C-N 3.35Å; K666-F668 PolarHBondContact O-N 3.43Å; K666-S669 PolarHBondContact O-N 3.27Å; K666-S670 WeakPolarHBondContact O-CB 3.18Å; K666-S670 PolarHBondContact O-N 3.23Å; K666-S670 PolarHBondContact O-OG 2.68Å
667	A	49.1	Very low	57.2	Low	57 Å²	57	111.2 Å²	111.2	47%	0.471	58%	0.575	S	S	.	*	H	α-helix	trans	-63.5	-36.9	175.7	0	0	0	0	0	113.3	T663 F664 S670 S671	T663-A667 WeakPolarHBondContact O-CB 3.29Å; T663-A667 PolarHBondContact O-N 2.94Å; F664-A667 PolarHBondContact O-N 2.77Å; A667-S670 PolarHBondContact O-OG 3.13Å; A667-S670 VanDerWaalsContact O-OG 3.08Å; A667-S671 PolarHBondContact O-OG 2.87Å
668	F	44	Very low	54.6	Low	127 Å²	127	117.5 Å²	117.5	56%	0.557	61%	0.605	S	S	*	*	H	α-helix	trans	-71.5	-37	175.7	-144.2	-87.9	0	0	0	111.9	F664 K666 F672	F664-F668 HydrophobicContact CZ-CD2 4.46Å; F664-F668 PolarHBondContact O-N 2.87Å; K666-F668 VanDerWaalsContact C-N 3.35Å; K666-F668 PolarHBondContact O-N 3.43Å; F668-F672 HydrophobicContact CD1-CE2 4.33Å; F668-F672 HydrophobicContact CE1-CE2 4Å
669	S	43.4	Very low	52.4	Low	76 Å²	76	119.3 Å²	119.3	53%	0.531	62%	0.622	S	S	.	*	H	α-helix	trans	-73.3	-40.6	179.1	-57.2	0	0	0	0	112.8	N665 K666 S671 F672	N665-S669 VanDerWaalsContact O-CB 3.28Å; N665-S669 WeakPolarHBondContact O-CB 3.35Å; N665-S669 PolarHBondContact O-N 2.87Å; N665-S669 PolarHBondContact O-OG 2.59Å; K666-S669 PolarHBondContact O-N 3.27Å; S669-S671 PolarHBondContact O-N 2.84Å; S669-S671 VanDerWaalsContact O-N 3.16Å; S669-F672 PolarHBondContact O-N 3.17Å; S669-F672 VanDerWaalsContact O-N 3.12Å
670	S	42.8	Very low	50.4	Low	73 Å²	73	119.9 Å²	119.9	51%	0.51	64%	0.635	S	S	.	*	H	α-helix	trans	-63.1	-20.3	176.9	58.7	0	0	0	0	113.3	K666 A667 F672	K666-S670 WeakPolarHBondContact O-CB 3.18Å; K666-S670 PolarHBondContact O-N 3.23Å; K666-S670 PolarHBondContact O-OG 2.68Å; A667-S670 PolarHBondContact O-OG 3.13Å; A667-S670 VanDerWaalsContact O-OG 3.08Å; S670-F672 VanDerWaalsContact C-N 3.28Å; S670-F672 PolarHBondContact O-N 2.71Å
671	S	41.8	Very low	47.9	Very low	90 Å²	90	123.3 Å²	123.3	63%	0.629	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-7.5	177.7	-58.5	0	0	0	0	113.9	A667 S669	A667-S671 PolarHBondContact O-OG 2.87Å; S669-S671 PolarHBondContact O-N 2.84Å; S669-S671 VanDerWaalsContact O-N 3.16Å
672	F	38.4	Very low	45.8	Very low	167 Å²	167	126 Å²	126	73%	0.732	67%	0.666	S	S	*	*	S	Bend	trans	-119.1	1.7	179.4	-77.5	-77.9	0	0	0	114.7	F668 S669 S670	F668-F672 HydrophobicContact CD1-CE2 4.33Å; F668-F672 HydrophobicContact CE1-CE2 4Å; S669-F672 PolarHBondContact O-N 3.17Å; S669-F672 VanDerWaalsContact O-N 3.12Å; S670-F672 VanDerWaalsContact C-N 3.28Å; S670-F672 PolarHBondContact O-N 2.71Å
673	S	42.1	Very low	44.5	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	69%	0.691	S	S	*	*			trans	-118.1	43.9	-177.9	-56.1	0	0	0	0	112.2
674	R	43.4	Very low	42.5	Very low	236 Å²	236	128 Å²	128	89%	0.891	70%	0.7	S	S	*	*			trans	-133.6	52.1	-178.4	-94.3	-168.6	156.5	-164.4	-6.6	113.3
675	E	41.8	Very low	42	Very low	192 Å²	192	126.8 Å²	126.8	90%	0.897	71%	0.706	S	S	*	*	S	Bend	trans	-146.8	146.4	155.9	-107.8	168.1	167.1	0	0	107.6
676	D	38.8	Very low	40.4	Very low	164 Å²	164	129.2 Å²	129.2	88%	0.877	72%	0.719	S	S	*	*			trans	61.8	88.2	-172.3	-116.1	-45.7	0	0	0	116.6
677	D	30	Very low	38.7	Very low	139 Å²	139	127.8 Å²	127.8	74%	0.743	73%	0.725	S	S	*	*				-157.6	129.7	118.8	-142.9	-34.1	0	0	0	110.5
678	H	34.4	Very low	37.7	Very low	188 Å²	188	133.7 Å²	133.7	87%	0.87	74%	0.741	S	S	*	*			trans	-140.8	103.3	178.4	-97.5	-57.8	0	0	0	109.6
679	V	41.4	Very low	37.1	Very low	124 Å²	124	134.8 Å²	134.8	75%	0.752	75%	0.749	S	S	*	*			trans	-116.8	127.5	-179	-178.3	0	0	0	0	111.1
680	P	42.9	Very low	36.3	Very low	112 Å²	112	137.9 Å²	137.9	73%	0.727	76%	0.76	S	S	*	*			trans	-95.4	117.8	168.2	33.5	-28.4	0	0	0	112.8
681	E	28.7	Very low	35.7	Very low	176 Å²	176	139.3 Å²	139.3	82%	0.822	77%	0.77	S	S	*	*			trans	35.8	113.5	146.8	-59.3	-168.6	99.4	0	0	122.5
682	S	33.2	Very low	35	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	78%	0.781	S	S	*	*				70	164.4	118.5	-57.9	0	0	0	0	121.3
683	P	46.4	Very low	34.6	Very low	131 Å²	131	138.2 Å²	138.2	85%	0.851	78%	0.782	S	S	*	*			cis	-134.5	165.1	-44	37.5	-23.1	0	0	0	113.3
684	G	29	Very low	34	Very low	74 Å²	74	140.5 Å²	140.5	76%	0.763	79%	0.786	S	S	*	*			trans	168.7	125.8	166.8	0	0	0	0	0	115.5
685	P	45.1	Very low	33.4	Very low	111 Å²	111	137 Å²	137	72%	0.721	78%	0.779	S	S	*	*			trans	-104.9	147.8	178.7	37.8	-31.8	0	0	0	113.7
686	N	28.8	Very low	32.8	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	77%	0.766	S	S	*	*				162.8	125.7	121.7	-84.4	-23.8	0	0	0	115.2
687	S	27.7	Very low	32.3	Very low	97 Å²	97	135.1 Å²	135.1	68%	0.678	76%	0.757	S	S	*	*				72.9	154	129.4	75.3	0	0	0	0	124.6
688	F	27.2	Very low	32.3	Very low	180 Å²	180	137.9 Å²	137.9	79%	0.789	76%	0.763	S	S	*	*			trans	73.3	105.8	159.2	-70.7	-69.9	0	0	0	123.1
689	M	31.2	Very low	32.1	Very low	151 Å²	151	134.4 Å²	134.4	74%	0.744	76%	0.759	S	S	*	*				66.8	108.2	123.4	-80.3	-177.1	119.5	0	0	123.3
690	D	27.2	Very low	31.6	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	76%	0.76	S	S	*	*				89.4	156.7	101.5	-148.3	10.8	0	0	0	121.4
691	S	29.9	Very low	31.2	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	77%	0.769	S	S	*	*			trans	74.8	113.2	166.1	-140.1	0	0	0	0	121.3
692	D	28.4	Very low	31.5	Very low	161 Å²	161	137.6 Å²	137.6	86%	0.861	76%	0.763	S	S	*	*			trans	10.8	146.2	134.6	-159.7	15.3	0	0	0	121.4
693	G	29	Very low	31.7	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	77%	0.769	S	S	*	*			trans	169	106.5	176.6	0	0	0	0	0	114.7
694	L	30.2	Very low	31.3	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	76%	0.763	S	S	*	*			trans	-94.3	150.5	-170.5	-168.9	67.8	0	0	0	114.7
695	H	30.5	Very low	31.9	Very low	164 Å²	164	149 Å²	149	76%	0.759	77%	0.767	S	S	*	*			trans	90.2	137.5	156.7	-79	-45.2	0	0	0	124.1
696	E	28.9	Very low	32.3	Very low	133 Å²	133	151.8 Å²	151.8	62%	0.621	77%	0.77	S	S	*	*			trans	87.1	121.3	147.1	-75.1	-123.7	93.1	0	0	123.7
697	R	28.6	Very low	33.6	Very low	183 Å²	183	153.1 Å²	153.1	69%	0.691	77%	0.769	S	S	*	*			trans	79.8	106.2	143.4	-67.9	172.3	-171	172.9	16.8	121.8
698	K	28.7	Very low	35.7	Very low	197 Å²	197	153.4 Å²	153.4	86%	0.857	76%	0.76	S	S	*	*				57	105.7	127	-61.3	174.1	179.6	173.2	0	118.5
699	S	30.4	Very low	38.4	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	74%	0.739	S	S	*	*				-148.1	141.3	112.5	74.3	0	0	0	0	111.3
700	S	31.3	Very low	40.9	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	70%	0.704	S	S	*	*			trans	-111.6	110.2	177	42.4	0	0	0	0	109.7	K702	S700-K702 VanDerWaalsContact C-N 3.28Å; S700-K702 PolarHBondContact O-N 2.81Å
701	K	34.8	Very low	43.6	Very low	208 Å²	208	140.1 Å²	140.1	90%	0.904	69%	0.692	S	S	*	*			trans	-70.2	84.8	176.8	-80.4	-174.7	175.4	177.3	0	110.9	K703	K701-K703 PolarHBondContact O-N 2.87Å
702	K	34	Very low	45.9	Very low	160 Å²	160	137.2 Å²	137.2	70%	0.696	68%	0.679	S	S	*	*			trans	-59.3	89.1	173.1	178.4	-153.6	174.1	-147.4	0	110.8	S700 E704	S700-K702 VanDerWaalsContact C-N 3.28Å; S700-K702 PolarHBondContact O-N 2.81Å; K702-E704 IonicContact NZ-OE1 3.77Å; K702-E704 PolarHBondContact NZ-OE1 3.09Å; K702-E704 PolarHBondContact O-N 3.14Å
703	K	39.3	Very low	48.6	Very low	201 Å²	201	131.8 Å²	131.8	87%	0.874	65%	0.653	S	S	*	*			trans	-65.2	122.5	162.2	-159.8	169.4	-171.4	173.5	0	107.5	K701 K705	K701-K703 PolarHBondContact O-N 2.87Å; K703-K705 PolarHBondContact O-N 2.71Å; K703-K705 VanDerWaalsContact O-N 3.14Å
704	E	36.3	Very low	50.9	Low	152 Å²	152	134.6 Å²	134.6	71%	0.71	65%	0.646	S	S	*	*			trans	-68.7	115.3	-170.2	-65.1	-148.2	109.3	0	0	111.7	K702 E706	K702-E704 IonicContact NZ-OE1 3.77Å; K702-E704 PolarHBondContact NZ-OE1 3.09Å; K702-E704 PolarHBondContact O-N 3.14Å; E704-E706 PolarHBondContact O-N 2.8Å
705	K	43.4	Very low	53.3	Low	197 Å²	197	131.8 Å²	131.8	86%	0.857	63%	0.629	S	S	*	*			trans	-73.8	106.4	163.9	-76.1	-177.1	175.5	177.1	0	108	K703 K707	K703-K705 PolarHBondContact O-N 2.71Å; K703-K705 VanDerWaalsContact O-N 3.14Å; K705-K707 PolarHBondContact O-N 3.21Å
706	E	52.6	Low	55.8	Low	169 Å²	169	126.9 Å²	126.9	79%	0.79	61%	0.613	S	S	*	*			trans	-45.2	126.5	168.7	-173	-178.1	-151.1	0	0	110.1	E704 Q708	E704-E706 PolarHBondContact O-N 2.8Å; E706-Q708 PolarHBondContact O-N 3.05Å
707	K	56.4	Low	58.3	Low	173 Å²	173	122.5 Å²	122.5	75%	0.752	59%	0.592	S	S	*	*			trans	-74.7	90.9	-170.9	-70.4	179.4	-176.3	170.6	0	110.1	K705 T709	K705-K707 PolarHBondContact O-N 3.21Å; K707-T709 WeakPolarHBondContact O-CG2 3.27Å; K707-T709 PolarHBondContact O-N 2.99Å; K707-T709 VanDerWaalsContact O-N 3.17Å
708	Q	70.6	Confident	60.6	Low	104 Å²	104	117.7 Å²	117.7	49%	0.486	58%	0.58	S	S	.	*			trans	-45.1	119.3	169.9	-67.3	-93.4	-64.2	0	0	110.9	E706 F717	E706-Q708 PolarHBondContact O-N 3.05Å; Q708-F717 WeakPolarHBondContact O-CD2 3.41Å
709	T	84.5	Confident	62.4	Low	55 Å²	55	118.2 Å²	118.2	34%	0.337	58%	0.582	S	S	.	*	B	Isolated β-bridge	trans	-106	165.4	-179.9	53.6	0	0	0	0	111.9	K707 H714 E715 F717 P732	K707-T709 WeakPolarHBondContact O-CG2 3.27Å; K707-T709 PolarHBondContact O-N 2.99Å; K707-T709 VanDerWaalsContact O-N 3.17Å; T709-H714 WeakPolarHBondContact CB-O 3.48Å; T709-H714 VanDerWaalsContact CG2-O 3.23Å; T709-H714 WeakPolarHBondContact CG2-O 3.25Å; T709-E715 CarbonylContact C-O 3.53Å; T709-E715 VanDerWaalsContact CA-O 3.31Å; T709-E715 WeakPolarHBondContact CA-O 3.31Å; T709-E715 WeakPolarHBondContact CB-O 3.36Å; T709-F717 VanDerWaalsContact C-CE2 3.42Å; T709-F717 WeakPolarHBondContact O-CE2 3.43Å; T709-P732 WeakPolarHBondContact O-CG 3.48Å
710	C	83	Confident	64.3	Low	1 Å²	1	118.7 Å²	118.7	1%	0.007	58%	0.581	C	S	.	*			trans	-72.8	123	173.6	176.4	0	0	0	0	111	G712 C713 H714 E715 F717 C734	C710-G712 PolarHBondContact O-N 3.11Å; C710-G712 VanDerWaalsContact O-N 3.09Å; C710-G712 PolarHBondContact SG-N 3.37Å; C710-C713 VanDerWaalsContact CB-SG 3.52Å; C710-C713 PolarHBondContact O-N 2.96Å; C710-H714 WeakPolarHBondContact O-CA 3.48Å; C710-H714 PolarHBondContact O-N 2.93Å; C710-E715 PolarHBondContact N-O 3.48Å; C710-F717 HydrophobicContact CB-CE1 4.1Å; C710-F717 HydrophobicContact CB-CZ 3.86Å; C710-C734 HydrophobicContact CB-CB 4.37Å; C710-C734 PolarHBondContact SG-N 2.99Å
711	R	83.9	Confident	66.3	Low	136 Å²	136	116.9 Å²	116.9	51%	0.513	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60	-21.2	178.2	-179.4	57.5	-179.3	-154.8	0.5	114.3	V731 P732 I733 E751	R711-V731 HydrophobicContact CB-CB 4.18Å; R711-V731 HydrophobicContact CB-CG2 3.96Å; R711-V731 HydrophobicContact CG-CB 4.22Å; R711-V731 HydrophobicContact CG-CG2 3.91Å; R711-P732 PolarHBondContact N-O 3.31Å; R711-I733 HydrophobicContact CB-CG2 4.31Å; R711-E751 IonicContact NE-OE1 3.93Å; R711-E751 IonicContact NH2-OE1 3.47Å
712	G	79.6	Confident	68.3	Low	42 Å²	42	115.9 Å²	115.9	43%	0.433	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-14.2	-178.9	0	0	0	0	0	116.4	C710	C710-G712 PolarHBondContact O-N 3.11Å; C710-G712 VanDerWaalsContact O-N 3.09Å; C710-G712 PolarHBondContact SG-N 3.37Å
713	C	83.8	Confident	70.7	Confident	46 Å²	46	112.2 Å²	112.2	31%	0.311	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.2	0	176.8	64.9	0	0	0	0	114.4	C710 E715	C710-C713 VanDerWaalsContact CB-SG 3.52Å; C710-C713 PolarHBondContact O-N 2.96Å; C713-E715 HydrophobicContact CB-CG 4.25Å; C713-E715 PolarHBondContact O-N 3.31Å; C713-E715 PolarHBondContact SG-OE2 3.16Å; C713-E715 VanDerWaalsContact SG-OE2 3.35Å
714	H	77.3	Confident	72.9	Confident	134 Å²	134	105.1 Å²	105.1	62%	0.62	50%	0.503	S	S	*	.			trans	57.1	4.3	-178.3	-61	-90.6	0	0	0	116.4	T709 C710	T709-H714 WeakPolarHBondContact CB-O 3.48Å; T709-H714 VanDerWaalsContact CG2-O 3.23Å; T709-H714 WeakPolarHBondContact CG2-O 3.25Å; C710-H714 WeakPolarHBondContact O-CA 3.48Å; C710-H714 PolarHBondContact O-N 2.93Å
715	E	82.1	Confident	75.1	Confident	88 Å²	88	103.1 Å²	103.1	41%	0.411	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-72.2	148.6	174.1	-54.4	-177.1	110.9	0	0	112.4	T709 C710 C713 K721	T709-E715 CarbonylContact C-O 3.53Å; T709-E715 VanDerWaalsContact CA-O 3.31Å; T709-E715 WeakPolarHBondContact CA-O 3.31Å; T709-E715 WeakPolarHBondContact CB-O 3.36Å; C710-E715 PolarHBondContact N-O 3.48Å; C713-E715 HydrophobicContact CB-CG 4.25Å; C713-E715 PolarHBondContact O-N 3.31Å; C713-E715 PolarHBondContact SG-OE2 3.16Å; C713-E715 VanDerWaalsContact SG-OE2 3.35Å; E715-K721 IonicContact OE1-NZ 2.77Å; E715-K721 PolarHBondContact OE1-NZ 3.26Å; E715-K721 IonicContact OE2-NZ 2.72Å; E715-K721 PolarHBondContact OE2-NZ 3.49Å
716	S	81.4	Confident	77.1	Confident	60 Å²	60	93.9 Å²	93.9	42%	0.42	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-75.7	142.2	173.5	56.2	0	0	0	0	112.3
717	F	82.2	Confident	78.5	Confident	42 Å²	42	93 Å²	93	18%	0.184	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-70.8	145.6	174.7	-59.3	-74.8	0	0	0	111.6	Q708 T709 C710 K721 K723 P732 C734	Q708-F717 WeakPolarHBondContact O-CD2 3.41Å; T709-F717 VanDerWaalsContact C-CE2 3.42Å; T709-F717 WeakPolarHBondContact O-CE2 3.43Å; C710-F717 HydrophobicContact CB-CE1 4.1Å; C710-F717 HydrophobicContact CB-CZ 3.86Å; F717-K721 WeakPolarHBondContact CA-O 3.3Å; F717-K721 WeakPolarHBondContact CB-O 3.22Å; F717-K721 WeakPolarHBondContact CD1-O 3.33Å; F717-K723 HydrophobicContact CB-CB 4.4Å; F717-K723 HydrophobicContact CD1-CB 3.91Å; F717-K723 HydrophobicContact CD1-CG 4.34Å; F717-K723 HydrophobicContact CD2-CB 4.13Å; F717-K723 HydrophobicContact CD2-CD 4.3Å; F717-K723 HydrophobicContact CD2-CG 3.96Å; F717-K723 HydrophobicContact CE1-CB 4.2Å; F717-K723 HydrophobicContact CE1-CG 4.22Å; F717-K723 HydrophobicContact CE2-CB 4.43Å; F717-K723 HydrophobicContact CE2-CD 4.35Å; F717-K723 HydrophobicContact CE2-CG 3.86Å; F717-K723 HydrophobicContact CG-CB 3.87Å; F717-K723 HydrophobicContact CG-CG 4.21Å; F717-K723 HydrophobicContact CZ-CB 4.45Å; F717-K723 HydrophobicContact CZ-CG 3.99Å; F717-P732 HydrophobicContact CE2-CB 3.81Å; F717-P732 HydrophobicContact CE2-CG 4.47Å; F717-P732 HydrophobicContact CZ-CB 3.93Å; F717-C734 HydrophobicContact CE1-CB 4Å
718	N	76.6	Confident	79.5	Confident	82 Å²	82	88.4 Å²	88.4	44%	0.439	44%	0.437	S	S	.	.			trans	-152.1	-173.8	178.3	66.5	25.2	0	0	0	110	T720 K721	N718-T720 VanDerWaalsContact C-N 3.27Å; N718-T720 PolarHBondContact O-N 3.13Å; N718-T720 PolarHBondContact OD1-N 2.88Å; N718-T720 VanDerWaalsContact OD1-N 3.1Å; N718-T720 PolarHBondContact OD1-OG1 3.35Å; N718-K721 PolarHBondContact N-O 2.88Å; N718-K721 VanDerWaalsContact N-O 3.14Å; N718-K721 CarbonylContact O-C 3.55Å; N718-K721 PolarHBondContact O-N 3.18Å; N718-K721 WeakPolarHBondContact OD1-CB 3.32Å; N718-K721 PolarHBondContact OD1-N 3.3Å
719	F	66.7	Low	80.1	Confident	207 Å²	207	86.2 Å²	86.2	91%	0.908	43%	0.433	S	S	*	.	S	Bend	trans	-59.9	-30.4	-176	-69.5	-78.3	0	0	0	114.6
720	T	71.1	Confident	79.9	Confident	125 Å²	125	85.8 Å²	85.8	77%	0.767	44%	0.439	S	S	*	.	S	Bend	trans	-90.3	-29.4	175.8	59.1	0	0	0	0	112.5	N718	N718-T720 VanDerWaalsContact C-N 3.27Å; N718-T720 PolarHBondContact O-N 3.13Å; N718-T720 PolarHBondContact OD1-N 2.88Å; N718-T720 VanDerWaalsContact OD1-N 3.1Å; N718-T720 PolarHBondContact OD1-OG1 3.35Å
721	K	73	Confident	80	Confident	72 Å²	72	87.6 Å²	87.6	31%	0.313	45%	0.45	S	S	.	.	S	Bend	trans	-102.6	78.8	175	-63	-177	-175.5	-178.6	0	110.3	E715 F717 N718	E715-K721 IonicContact OE1-NZ 2.77Å; E715-K721 PolarHBondContact OE1-NZ 3.26Å; E715-K721 IonicContact OE2-NZ 2.72Å; E715-K721 PolarHBondContact OE2-NZ 3.49Å; F717-K721 WeakPolarHBondContact CA-O 3.3Å; F717-K721 WeakPolarHBondContact CB-O 3.22Å; F717-K721 WeakPolarHBondContact CD1-O 3.33Å; N718-K721 PolarHBondContact N-O 2.88Å; N718-K721 VanDerWaalsContact N-O 3.14Å; N718-K721 CarbonylContact O-C 3.55Å; N718-K721 PolarHBondContact O-N 3.18Å; N718-K721 WeakPolarHBondContact OD1-CB 3.32Å; N718-K721 PolarHBondContact OD1-N 3.3Å
722	R	76.4	Confident	80.1	Confident	188 Å²	188	82.3 Å²	82.3	71%	0.709	43%	0.433	S	S	*	.			trans	-60.5	142.6	177.6	-63	-175.5	-178.1	-175.7	0.9	111.7
723	K	84.2	Confident	80.6	Confident	83 Å²	83	80.3 Å²	80.3	36%	0.361	41%	0.413	S	S	.	.			trans	-78.2	126.8	175.4	-170.8	-177.4	-168.2	-168.8	0	110.3	F717 H725 P732	F717-K723 HydrophobicContact CB-CB 4.4Å; F717-K723 HydrophobicContact CD1-CB 3.91Å; F717-K723 HydrophobicContact CD1-CG 4.34Å; F717-K723 HydrophobicContact CD2-CB 4.13Å; F717-K723 HydrophobicContact CD2-CD 4.3Å; F717-K723 HydrophobicContact CD2-CG 3.96Å; F717-K723 HydrophobicContact CE1-CB 4.2Å; F717-K723 HydrophobicContact CE1-CG 4.22Å; F717-K723 HydrophobicContact CE2-CB 4.43Å; F717-K723 HydrophobicContact CE2-CD 4.35Å; F717-K723 HydrophobicContact CE2-CG 3.86Å; F717-K723 HydrophobicContact CG-CB 3.87Å; F717-K723 HydrophobicContact CG-CG 4.21Å; F717-K723 HydrophobicContact CZ-CB 4.45Å; F717-K723 HydrophobicContact CZ-CG 3.99Å; K723-H725 VanDerWaalsContact CE-NE2 3.27Å; K723-H725 WeakPolarHBondContact CE-NE2 3.29Å; K723-H725 PolarHBondContact NZ-NE2 3.48Å; K723-P732 HydrophobicContact CD-CB 4.45Å; K723-P732 HydrophobicContact CG-CB 4.32Å
724	H	85.1	Confident	80.8	Confident	52 Å²	52	78.5 Å²	78.5	24%	0.241	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	164.8	164	-52.2	-77.5	0	0	0	108.9	P732 I733	H724-P732 CarbonylContact O-C 3.53Å; H724-P732 WeakPolarHBondContact O-CA 3.2Å; H724-I733 CarbonylContact C-O 3.14Å; H724-I733 WeakPolarHBondContact CA-O 3.34Å; H724-I733 HydrophobicContact CB-CG1 4.41Å; H724-I733 WeakPolarHBondContact CB-O 3.39Å; H724-I733 PolarHBondContact N-O 3.41Å; H724-I733 PolarHBondContact O-N 2.73Å
725	H	83.4	Confident	81.1	Confident	109 Å²	109	74.7 Å²	74.7	51%	0.505	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	139.9	175.6	-58.8	91.7	0	0	0	108.6	K723 K727 G730	K723-H725 VanDerWaalsContact CE-NE2 3.27Å; K723-H725 WeakPolarHBondContact CE-NE2 3.29Å; K723-H725 PolarHBondContact NZ-NE2 3.48Å; H725-K727 PolarHBondContact O-N 3.49Å; H725-G730 PolarHBondContact CD2-O 2.77Å
726	C	84.5	Confident	81.1	Confident	4 Å²	4	80.2 Å²	80.2	3%	0.027	42%	0.415	C	S	.	.			trans	-65.8	127.1	174.8	178.4	0	0	0	0	110.2	S728 C729 G730 V731 I733 C749	C726-S728 PolarHBondContact O-N 3.31Å; C726-C729 PolarHBondContact SG-SG 2.89Å; C726-G730 VanDerWaalsContact O-CA 3.26Å; C726-G730 WeakPolarHBondContact O-CA 3.4Å; C726-G730 PolarHBondContact O-N 2.96Å; C726-V731 HydrophobicContact CB-CG2 3.99Å; C726-V731 PolarHBondContact N-O 3.31Å; C726-I733 HydrophobicContact CB-CD1 4.14Å; C726-C749 HydrophobicContact CB-CB 4.36Å; C726-C749 PolarHBondContact SG-N 3.04Å
727	K	83.2	Confident	81.2	Confident	150 Å²	150	78.4 Å²	78.4	65%	0.652	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-32.1	179.5	-171.8	178.2	179.3	-172.3	0	113.2	H725 S746 R747 V748	H725-K727 PolarHBondContact O-N 3.49Å; K727-S746 WeakPolarHBondContact CD-OG 3.37Å; K727-S746 PolarHBondContact NZ-OG 3Å; K727-R747 WeakPolarHBondContact CB-O 3.5Å; K727-R747 PolarHBondContact N-O 2.88Å; K727-V748 HydrophobicContact CB-CG1 4.3Å
728	S	77.3	Confident	81.3	Confident	77 Å²	77	77 Å²	77	54%	0.538	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-32.5	-173.8	-47.6	0	0	0	0	114.4	C726 V748	C726-S728 PolarHBondContact O-N 3.31Å; S728-V748 WeakPolarHBondContact OG-CG1 3.48Å
729	C	83.3	Confident	81.5	Confident	58 Å²	58	76.7 Å²	76.7	39%	0.392	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	6.9	-174.6	65.6	0	0	0	0	114.8	C726 V731	C726-C729 PolarHBondContact SG-SG 2.89Å; C729-V731 PolarHBondContact O-N 2.87Å; C729-V731 VanDerWaalsContact SG-CG2 3.55Å
730	G	80.6	Confident	81.9	Confident	46 Å²	46	70.7 Å²	70.7	47%	0.474	37%	0.373	S	S	.	.			trans	71.1	-17.1	175.5	0	0	0	0	0	116.4	H725 C726	H725-G730 PolarHBondContact CD2-O 2.77Å; C726-G730 VanDerWaalsContact O-CA 3.26Å; C726-G730 WeakPolarHBondContact O-CA 3.4Å; C726-G730 PolarHBondContact O-N 2.96Å
731	V	84.8	Confident	81.3	Confident	39 Å²	39	67.1 Å²	67.1	24%	0.236	35%	0.349	C	S	.	.			trans	-59	144.1	-173.1	-54.2	0	0	0	0	112.5	R711 C726 C729 I733 C749	R711-V731 HydrophobicContact CB-CB 4.18Å; R711-V731 HydrophobicContact CB-CG2 3.96Å; R711-V731 HydrophobicContact CG-CB 4.22Å; R711-V731 HydrophobicContact CG-CG2 3.91Å; C726-V731 HydrophobicContact CB-CG2 3.99Å; C726-V731 PolarHBondContact N-O 3.31Å; C729-V731 PolarHBondContact O-N 2.87Å; C729-V731 VanDerWaalsContact SG-CG2 3.55Å; V731-I733 HydrophobicContact CG2-CG2 4.28Å; V731-C749 HydrophobicContact CG2-CB 4.37Å
732	P	85.9	Confident	80.4	Confident	24 Å²	24	70.9 Å²	70.9	16%	0.156	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.1	-176.4	33.1	-37.6	0	0	0	111.8	T709 R711 F717 K723 H724	T709-P732 WeakPolarHBondContact O-CG 3.48Å; R711-P732 PolarHBondContact N-O 3.31Å; F717-P732 HydrophobicContact CE2-CB 3.81Å; F717-P732 HydrophobicContact CE2-CG 4.47Å; F717-P732 HydrophobicContact CZ-CB 3.93Å; K723-P732 HydrophobicContact CD-CB 4.45Å; K723-P732 HydrophobicContact CG-CB 4.32Å; H724-P732 CarbonylContact O-C 3.53Å; H724-P732 WeakPolarHBondContact O-CA 3.2Å
733	I	89.3	Confident	79.4	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.9	-178.2	56.7	-177.2	0	0	0	111.3	R711 H724 C726 V731 C749	R711-I733 HydrophobicContact CB-CG2 4.31Å; H724-I733 CarbonylContact C-O 3.14Å; H724-I733 WeakPolarHBondContact CA-O 3.34Å; H724-I733 HydrophobicContact CB-CG1 4.41Å; H724-I733 WeakPolarHBondContact CB-O 3.39Å; H724-I733 PolarHBondContact N-O 3.41Å; H724-I733 PolarHBondContact O-N 2.73Å; C726-I733 HydrophobicContact CB-CD1 4.14Å; V731-I733 HydrophobicContact CG2-CG2 4.28Å; I733-C749 HydrophobicContact CD1-CB 4.35Å; I733-C749 HydrophobicContact CG2-CB 4.05Å
734	C	88.4	Confident	78.2	Confident	9 Å²	9	74.1 Å²	74.1	6%	0.061	40%	0.397	C	S	.	.			trans	-86.3	164.2	172.2	79.5	0	0	0	0	110.5	C710 F717 K736 C737 S738	C710-C734 HydrophobicContact CB-CB 4.37Å; C710-C734 PolarHBondContact SG-N 2.99Å; F717-C734 HydrophobicContact CE1-CB 4Å; C734-K736 PolarHBondContact O-N 2.84Å; C734-K736 VanDerWaalsContact O-N 3.14Å; C734-C737 CarbonylContact O-C 3.52Å; C734-C737 PolarHBondContact O-N 2.78Å; C734-S738 PolarHBondContact O-N 3Å
735	A	82.8	Confident	77	Confident	54 Å²	54	77.8 Å²	77.8	45%	0.446	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-59.7	-26.6	-177.3	0	0	0	0	0	114.4	S738	A735-S738 PolarHBondContact O-OG 3.43Å; A735-S738 VanDerWaalsContact O-OG 3.13Å
736	K	82.3	Confident	76.4	Confident	204 Å²	204	73.5 Å²	73.5	89%	0.887	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-78.3	-23.6	174.8	-64.9	-169.8	176.5	-170	0	113.5	C734	C734-K736 PolarHBondContact O-N 2.84Å; C734-K736 VanDerWaalsContact O-N 3.14Å
737	C	83.4	Confident	76.4	Confident	21 Å²	21	77.8 Å²	77.8	14%	0.142	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-100.5	10.6	178.3	-62.5	0	0	0	0	112.7	C734	C734-C737 CarbonylContact O-C 3.52Å; C734-C737 PolarHBondContact O-N 2.78Å
738	S	85.6	Confident	76.5	Confident	14 Å²	14	71 Å²	71	10%	0.098	39%	0.393	C	S	.	.			trans	-108.9	121.3	175.2	67.3	0	0	0	0	111	C734 A735 R747 V748	C734-S738 PolarHBondContact O-N 3Å; A735-S738 PolarHBondContact O-OG 3.43Å; A735-S738 VanDerWaalsContact O-OG 3.13Å; S738-R747 PolarHBondContact OG-NH1 2.88Å; S738-V748 CarbonylContact C-O 3.5Å; S738-V748 VanDerWaalsContact CA-O 3.29Å; S738-V748 WeakPolarHBondContact CA-O 3.29Å
739	K	79.9	Confident	76.9	Confident	75 Å²	75	67.5 Å²	67.5	33%	0.326	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	158.6	165.6	-59.7	-177.8	-178	178.1	0	109	V748 F753 E754	K739-V748 PolarHBondContact N-O 3.22Å; K739-V748 PolarHBondContact O-N 3.32Å; K739-F753 HydrophobicContact CB-CB 4.03Å; K739-F753 HydrophobicContact CB-CD1 4.18Å; K739-F753 HydrophobicContact CB-CD2 3.51Å; K739-F753 HydrophobicContact CB-CE1 4.49Å; K739-F753 HydrophobicContact CB-CE2 3.92Å; K739-F753 HydrophobicContact CB-CG 3.64Å; K739-F753 HydrophobicContact CB-CZ 4.38Å; K739-F753 HydrophobicContact CD-CB 3.77Å; K739-F753 HydrophobicContact CD-CD1 3.24Å; K739-F753 HydrophobicContact CD-CD2 4.21Å; K739-F753 HydrophobicContact CD-CE1 3.75Å; K739-F753 HydrophobicContact CD-CG 3.48Å; K739-F753 VanDerWaalsContact CD-CG 3.48Å; K739-F753 HydrophobicContact CD-CZ 4.43Å; K739-F753 HydrophobicContact CG-CB 4.44Å; K739-F753 HydrophobicContact CG-CD1 4.32Å; K739-F753 HydrophobicContact CG-CD2 4.5Å; K739-F753 HydrophobicContact CG-CG 4.18Å; K739-E754 IonicContact NZ-OE1 3.36Å; K739-E754 PolarHBondContact NZ-OE1 2.92Å
740	T	74.9	Confident	76.7	Confident	81 Å²	81	66.7 Å²	66.7	50%	0.497	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.9	179.1	48.3	0	0	0	0	110	S746 R747	T740-S746 WeakPolarHBondContact CA-O 3.15Å; T740-R747 HydrophobicContact CG2-CG 4.2Å
741	L	58.8	Low	76.6	Confident	50 Å²	50	69.6 Å²	69.6	26%	0.262	36%	0.363	S	S	.	.			trans	-91.9	164.1	173	-158.8	66.8	0	0	0	110	N743 F753	L741-N743 VanDerWaalsContact C-N 3.27Å; L741-N743 PolarHBondContact O-N 2.82Å; L741-F753 HydrophobicContact CD1-CD2 4.43Å; L741-F753 HydrophobicContact CD1-CE2 4.01Å
742	D	54.5	Low	76.3	Confident	150 Å²	150	68.9 Å²	68.9	80%	0.802	36%	0.36	S	S	*	.	S	Bend	trans	-71.4	64	-164.7	-75.9	-70.9	0	0	0	117
743	N	54.7	Low	76.1	Confident	121 Å²	121	69.5 Å²	69.5	65%	0.647	36%	0.36	S	S	*	.	S	Bend	trans	-157.8	126.4	138.2	-98.9	-77.2	0	0	0	106.8	L741 T745 S746	L741-N743 VanDerWaalsContact C-N 3.27Å; L741-N743 PolarHBondContact O-N 2.82Å; N743-T745 PolarHBondContact O-N 3.23Å; N743-S746 PolarHBondContact O-N 3.17Å
744	K	58.7	Low	75.3	Confident	218 Å²	218	74.1 Å²	74.1	95%	0.948	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	14	-154.6	-66.9	-176.9	176.5	177.4	0	118.6
745	T	61.3	Low	74.5	Confident	130 Å²	130	76.7 Å²	76.7	80%	0.798	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-11.6	179.8	57.4	0	0	0	0	114.4	N743	N743-T745 PolarHBondContact O-N 3.23Å
746	S	70.7	Confident	73.6	Confident	19 Å²	19	75.6 Å²	75.6	13%	0.133	39%	0.392	C	S	.	.			trans	-98.4	111.4	-172.7	-61.2	0	0	0	0	112.8	K727 T740 N743	K727-S746 WeakPolarHBondContact CD-OG 3.37Å; K727-S746 PolarHBondContact NZ-OG 3Å; T740-S746 WeakPolarHBondContact CA-O 3.15Å; N743-S746 PolarHBondContact O-N 3.17Å
747	R	83.2	Confident	72.5	Confident	94 Å²	94	69.7 Å²	69.7	36%	0.355	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.4	174.3	-72.1	-177.3	-174.2	-95.5	-3.3	111.6	K727 S738 T740	K727-R747 WeakPolarHBondContact CB-O 3.5Å; K727-R747 PolarHBondContact N-O 2.88Å; S738-R747 PolarHBondContact OG-NH1 2.88Å; T740-R747 HydrophobicContact CG2-CG 4.2Å
748	V	85.2	Confident	70.8	Confident	8 Å²	8	73 Å²	73	5%	0.048	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.8	177.2	-69.2	0	0	0	0	111.6	K727 S728 S738 K739 C752 F753	K727-V748 HydrophobicContact CB-CG1 4.3Å; S728-V748 WeakPolarHBondContact OG-CG1 3.48Å; S738-V748 CarbonylContact C-O 3.5Å; S738-V748 VanDerWaalsContact CA-O 3.29Å; S738-V748 WeakPolarHBondContact CA-O 3.29Å; K739-V748 PolarHBondContact N-O 3.22Å; K739-V748 PolarHBondContact O-N 3.32Å; V748-C752 HydrophobicContact CB-CB 4.32Å; V748-F753 HydrophobicContact CG2-CB 3.88Å; V748-F753 HydrophobicContact CG2-CD2 3.84Å; V748-F753 HydrophobicContact CG2-CG 4.36Å
749	C	86.1	Confident	69.1	Low	2 Å²	2	77.5 Å²	77.5	1%	0.014	42%	0.42	C	S	.	.			trans	-72.8	165.5	170.6	65.6	0	0	0	0	110.9	C726 V731 I733 E751 C752 F753	C726-C749 HydrophobicContact CB-CB 4.36Å; C726-C749 PolarHBondContact SG-N 3.04Å; V731-C749 HydrophobicContact CG2-CB 4.37Å; I733-C749 HydrophobicContact CD1-CB 4.35Å; I733-C749 HydrophobicContact CG2-CB 4.05Å; C749-E751 PolarHBondContact O-N 2.78Å; C749-C752 PolarHBondContact O-N 2.84Å; C749-F753 PolarHBondContact O-N 3.39Å; C749-F753 VanDerWaalsContact O-N 3.07Å
750	P	79.1	Confident	67.1	Low	42 Å²	42	78.9 Å²	78.9	27%	0.273	43%	0.428	S	S	.	.	H	α-helix	trans	-59	-45.3	-179.1	-24.2	35.8	0	0	0	112.7	C752 F753 E754	P750-C752 PolarHBondContact O-N 3.31Å; P750-F753 WeakPolarHBondContact O-CB 3.47Å; P750-F753 PolarHBondContact O-N 3.29Å; P750-E754 PolarHBondContact O-N 3.27Å
751	E	78.5	Confident	65.2	Low	107 Å²	107	82.8 Å²	82.8	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-50.3	-51.5	176.6	-57.3	164	172	0	0	111.6	R711 C749 F753 A755	R711-E751 IonicContact NE-OE1 3.93Å; R711-E751 IonicContact NH2-OE1 3.47Å; C749-E751 PolarHBondContact O-N 2.78Å; E751-F753 VanDerWaalsContact C-N 3.35Å; E751-F753 PolarHBondContact O-N 2.96Å; E751-A755 WeakPolarHBondContact O-CB 3.34Å; E751-A755 PolarHBondContact O-N 2.89Å; E751-A755 VanDerWaalsContact O-N 3.14Å
752	C	80	Confident	64.1	Low	24 Å²	24	88.3 Å²	88.3	16%	0.162	47%	0.469	C	S	.	.	H	α-helix	trans	-74.3	-21.7	179.6	-66.8	0	0	0	0	113.9	V748 C749 P750 S756	V748-C752 HydrophobicContact CB-CB 4.32Å; C749-C752 PolarHBondContact O-N 2.84Å; P750-C752 PolarHBondContact O-N 3.31Å; C752-S756 PolarHBondContact O-N 3.24Å; C752-S756 PolarHBondContact O-OG 2.94Å
753	F	80.3	Confident	62.9	Low	36 Å²	36	87.1 Å²	87.1	16%	0.158	47%	0.471	C	S	.	.	H	α-helix	trans	-77.3	-43.9	176.6	-173.8	-95.6	0	0	0	111.4	K739 L741 V748 C749 P750 E751 A755 S756 L757	K739-F753 HydrophobicContact CB-CB 4.03Å; K739-F753 HydrophobicContact CB-CD1 4.18Å; K739-F753 HydrophobicContact CB-CD2 3.51Å; K739-F753 HydrophobicContact CB-CE1 4.49Å; K739-F753 HydrophobicContact CB-CE2 3.92Å; K739-F753 HydrophobicContact CB-CG 3.64Å; K739-F753 HydrophobicContact CB-CZ 4.38Å; K739-F753 HydrophobicContact CD-CB 3.77Å; K739-F753 HydrophobicContact CD-CD1 3.24Å; K739-F753 HydrophobicContact CD-CD2 4.21Å; K739-F753 HydrophobicContact CD-CE1 3.75Å; K739-F753 HydrophobicContact CD-CG 3.48Å; K739-F753 VanDerWaalsContact CD-CG 3.48Å; K739-F753 HydrophobicContact CD-CZ 4.43Å; K739-F753 HydrophobicContact CG-CB 4.44Å; K739-F753 HydrophobicContact CG-CD1 4.32Å; K739-F753 HydrophobicContact CG-CD2 4.5Å; K739-F753 HydrophobicContact CG-CG 4.18Å; L741-F753 HydrophobicContact CD1-CD2 4.43Å; L741-F753 HydrophobicContact CD1-CE2 4.01Å; V748-F753 HydrophobicContact CG2-CB 3.88Å; V748-F753 HydrophobicContact CG2-CD2 3.84Å; V748-F753 HydrophobicContact CG2-CG 4.36Å; C749-F753 PolarHBondContact O-N 3.39Å; C749-F753 VanDerWaalsContact O-N 3.07Å; P750-F753 WeakPolarHBondContact O-CB 3.47Å; P750-F753 PolarHBondContact O-N 3.29Å; E751-F753 VanDerWaalsContact C-N 3.35Å; E751-F753 PolarHBondContact O-N 2.96Å; F753-A755 VanDerWaalsContact C-N 3.31Å; F753-A755 PolarHBondContact O-N 3.03Å; F753-S756 WeakPolarHBondContact O-CA 3.49Å; F753-S756 VanDerWaalsContact O-CB 3.31Å; F753-S756 WeakPolarHBondContact O-CB 3.49Å; F753-S756 PolarHBondContact O-N 3.01Å; F753-L757 HydrophobicContact CD1-CD1 3.92Å; F753-L757 HydrophobicContact CD1-CG 4.24Å; F753-L757 HydrophobicContact CE1-CD1 3.61Å; F753-L757 HydrophobicContact CE1-CD2 4.39Å; F753-L757 HydrophobicContact CE1-CG 4.03Å; F753-L757 HydrophobicContact CZ-CD1 4.48Å; F753-L757 PolarHBondContact O-N 2.99Å
754	E	72.8	Confident	61.5	Low	98 Å²	98	85.6 Å²	85.6	46%	0.458	48%	0.483	S	S	.	.	H	α-helix	trans	-66	-35.5	174.1	-78	136.7	-130.1	0	0	111.6	K739 P750 S756 S758	K739-E754 IonicContact NZ-OE1 3.36Å; K739-E754 PolarHBondContact NZ-OE1 2.92Å; P750-E754 PolarHBondContact O-N 3.27Å; E754-S756 PolarHBondContact O-N 2.87Å; E754-S758 WeakPolarHBondContact O-CB 3.39Å; E754-S758 PolarHBondContact O-N 2.99Å; E754-S758 VanDerWaalsContact O-N 3.1Å; E754-S758 PolarHBondContact O-OG 2.8Å
755	A	70.7	Confident	59.9	Low	63 Å²	63	78.8 Å²	78.8	52%	0.521	48%	0.475	S	S	.	.	H	α-helix	trans	-64.9	-20.8	168.1	0	0	0	0	0	114	E751 F753	E751-A755 WeakPolarHBondContact O-CB 3.34Å; E751-A755 PolarHBondContact O-N 2.89Å; E751-A755 VanDerWaalsContact O-N 3.14Å; F753-A755 VanDerWaalsContact C-N 3.31Å; F753-A755 PolarHBondContact O-N 3.03Å
756	S	64.3	Low	58.4	Low	30 Å²	30	82.4 Å²	82.4	21%	0.21	48%	0.483	C	S	.	.	H	α-helix	trans	-82.3	-49.8	174.5	-55.4	0	0	0	0	111.2	C752 F753 E754 S758 V759 E760	C752-S756 PolarHBondContact O-N 3.24Å; C752-S756 PolarHBondContact O-OG 2.94Å; F753-S756 WeakPolarHBondContact O-CA 3.49Å; F753-S756 VanDerWaalsContact O-CB 3.31Å; F753-S756 WeakPolarHBondContact O-CB 3.49Å; F753-S756 PolarHBondContact O-N 3.01Å; E754-S756 PolarHBondContact O-N 2.87Å; S756-S758 PolarHBondContact O-N 3.1Å; S756-V759 WeakPolarHBondContact O-CB 3.34Å; S756-V759 PolarHBondContact O-N 2.86Å; S756-E760 PolarHBondContact O-N 2.86Å
757	L	60.1	Low	56.6	Low	80 Å²	80	89.1 Å²	89.1	42%	0.419	51%	0.512	S	S	.	.	H	α-helix	trans	-56.6	-33.9	176.6	-67.9	177.3	0	0	0	112.5	F753 V759 E760	F753-L757 HydrophobicContact CD1-CD1 3.92Å; F753-L757 HydrophobicContact CD1-CG 4.24Å; F753-L757 HydrophobicContact CE1-CD1 3.61Å; F753-L757 HydrophobicContact CE1-CD2 4.39Å; F753-L757 HydrophobicContact CE1-CG 4.03Å; F753-L757 HydrophobicContact CZ-CD1 4.48Å; F753-L757 PolarHBondContact O-N 2.99Å; L757-V759 PolarHBondContact O-N 2.89Å; L757-V759 VanDerWaalsContact O-N 3.14Å; L757-E760 PolarHBondContact O-N 2.95Å
758	S	47.3	Very low	53.8	Low	92 Å²	92	94.9 Å²	94.9	64%	0.643	54%	0.54	S	S	*	.	H	α-helix	trans	-63.2	-15.4	176.8	-58.1	0	0	0	0	114.1	E754 S756	E754-S758 WeakPolarHBondContact O-CB 3.39Å; E754-S758 PolarHBondContact O-N 2.99Å; E754-S758 VanDerWaalsContact O-N 3.1Å; E754-S758 PolarHBondContact O-OG 2.8Å; S756-S758 PolarHBondContact O-N 3.1Å
759	V	49.2	Very low	51.4	Low	107 Å²	107	104.3 Å²	104.3	65%	0.648	58%	0.575	S	S	*	*	H	α-helix	trans	-97.3	-30.9	178.3	-179.1	0	0	0	0	111.7	S756 L757 M761 M762	S756-V759 WeakPolarHBondContact O-CB 3.34Å; S756-V759 PolarHBondContact O-N 2.86Å; L757-V759 PolarHBondContact O-N 2.89Å; L757-V759 VanDerWaalsContact O-N 3.14Å; V759-M761 PolarHBondContact O-N 2.87Å; V759-M762 PolarHBondContact O-N 3.41Å
760	E	39.7	Very low	48.5	Very low	105 Å²	105	114 Å²	114	49%	0.491	62%	0.616	S	S	.	*	H	α-helix	trans	-69.3	-21	-176.1	-67.9	174.9	166.3	0	0	113	S756 L757 M762	S756-E760 PolarHBondContact O-N 2.86Å; L757-E760 PolarHBondContact O-N 2.95Å; E760-M762 PolarHBondContact O-N 2.82Å
761	M	34.3	Very low	45.9	Very low	162 Å²	162	116.8 Å²	116.8	80%	0.798	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-8.6	178	-152.3	80.5	165.3	0	0	114.9	V759	V759-M761 PolarHBondContact O-N 2.87Å
762	M	36.3	Very low	43.4	Very low	167 Å²	167	116 Å²	116	82%	0.823	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	3.6	-170.6	-74.7	-78.7	95.4	0	0	115.8	V759 E760	V759-M762 PolarHBondContact O-N 3.41Å; E760-M762 PolarHBondContact O-N 2.82Å
763	C	29.1	Very low	41	Very low	125 Å²	125	121 Å²	121	85%	0.845	69%	0.687	S	S	*	*			trans	-154.6	78	175.8	-138.6	0	0	0	0	113.4
764	G	23.8	Very low	38.4	Very low	88 Å²	88	128.5 Å²	128.5	91%	0.907	72%	0.723	S	S	*	*			trans	-96.1	118.9	173.5	0	0	0	0	0	112.5
765	G	26.8	Very low	36.4	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	74%	0.742	S	S	*	*			trans	-176.3	124.1	174.9	0	0	0	0	0	110.9
766	E	29	Very low	34.5	Very low	206 Å²	206	139.2 Å²	139.2	96%	0.963	75%	0.752	S	S	*	*			trans	-85.9	162	-162.6	-69.5	-169.6	90.7	0	0	116
767	Q	32.2	Very low	33.1	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	77%	0.771	S	S	*	*			trans	-91.2	154.8	-172.4	-56.9	176.6	7.3	0	0	113.6
768	K	25.5	Very low	32.1	Very low	216 Å²	216	144.7 Å²	144.7	94%	0.939	79%	0.787	S	S	*	*			trans	-141.7	135.4	139.7	-137.6	165.1	-171.5	169.6	0	111.6
769	R	34.6	Very low	32.2	Very low	205 Å²	205	142.3 Å²	142.3	77%	0.774	77%	0.767	S	S	*	*			trans	-91.5	145.8	-172.5	-52.8	172	-177.2	169.6	-1.3	111.6
770	K	25.6	Very low	32.2	Very low	205 Å²	205	141.1 Å²	141.1	89%	0.891	76%	0.76	S	S	*	*			trans	-175.4	153.1	130.7	-110	176	-179	-174	0	114.4
771	A	24.2	Very low	32.5	Very low	102 Å²	102	138.3 Å²	138.3	84%	0.843	76%	0.76	S	S	*	*			trans	63.4	154.8	157.3	0	0	0	0	0	119.4
772	A	26.4	Very low	33.3	Very low	89 Å²	89	137 Å²	137	74%	0.736	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-95.2	152.3	168	0	0	0	0	0	109.5
773	P	28.1	Very low	34.5	Very low	130 Å²	130	131 Å²	131	84%	0.844	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-77.2	131	179.8	30.6	-33.7	0	0	0	111.8
774	E	27.1	Very low	36.5	Very low	193 Å²	193	125.5 Å²	125.5	90%	0.902	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-71.1	149.6	158.9	-71.8	177.8	108	0	0	109.9	Q776	E774-Q776 PolarHBondContact O-N 2.83Å
775	R	30.7	Very low	39.1	Very low	231 Å²	231	124.4 Å²	124.4	87%	0.872	67%	0.666	S	S	*	*			trans	-86.3	92.7	-171.3	-161.6	176.3	-167.2	165.3	2.3	110.2	L777	R775-L777 PolarHBondContact O-N 3.16Å
776	Q	29.4	Very low	42	Very low	156 Å²	156	122.6 Å²	122.6	73%	0.729	64%	0.638	S	S	*	*			trans	-64.9	124.5	-177.2	-169.5	170.2	-0.3	0	0	111.7	E774	E774-Q776 PolarHBondContact O-N 2.83Å
777	L	36.6	Very low	44.8	Very low	116 Å²	116	114.7 Å²	114.7	61%	0.607	61%	0.605	S	S	*	*			trans	-84.2	126.2	176.1	-118.5	70.8	0	0	0	110.5	R775 L779	R775-L777 PolarHBondContact O-N 3.16Å; L777-L779 PolarHBondContact O-N 3.06Å
778	S	38.3	Very low	47.4	Very low	108 Å²	108	107.8 Å²	107.8	76%	0.755	58%	0.577	S	S	*	*			trans	-84.6	98.6	170.9	54.1	0	0	0	0	110.2	T780	S778-T780 PolarHBondContact O-N 2.92Å
779	L	50	Low	50.4	Low	42 Å²	42	103.3 Å²	103.3	22%	0.22	56%	0.555	C	S	.	*			trans	-75.1	100.1	178.6	-62.4	177.8	0	0	0	110.9	L777 A805 T807 Y815	L777-L779 PolarHBondContact O-N 3.06Å; L779-A805 HydrophobicContact CD1-CB 4.43Å; L779-T807 HydrophobicContact CD2-CG2 3.72Å; L779-Y815 HydrophobicContact CD1-CD1 4.43Å; L779-Y815 HydrophobicContact CD1-CD2 4.43Å; L779-Y815 HydrophobicContact CD1-CG 4.07Å
780	T	49.7	Very low	53	Low	83 Å²	83	93.7 Å²	93.7	51%	0.509	52%	0.519	S	S	.	.			trans	-87.1	146.2	168.4	54.4	0	0	0	0	110.6	S778 D782 S783	S778-T780 PolarHBondContact O-N 2.92Å; T780-D782 PolarHBondContact O-N 3.27Å; T780-D782 VanDerWaalsContact O-N 3.14Å; T780-S783 PolarHBondContact O-N 3.3Å; T780-S783 VanDerWaalsContact O-N 3.09Å; T780-S783 PolarHBondContact O-OG 2.86Å
781	G	45.9	Very low	56	Low	46 Å²	46	87.8 Å²	87.8	47%	0.474	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-55.7	-35.3	-171.6	0	0	0	0	0	114.5	S783 C784	G781-S783 PolarHBondContact O-N 3.06Å; G781-S783 VanDerWaalsContact O-N 3.1Å; G781-C784 WeakPolarHBondContact O-CB 3.39Å; G781-C784 PolarHBondContact O-N 2.84Å
782	D	50.1	Low	59.1	Low	135 Å²	135	83 Å²	83	72%	0.722	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.8	-178.1	-41.7	-53.3	0	0	0	113.2	T780 K808	T780-D782 PolarHBondContact O-N 3.27Å; T780-D782 VanDerWaalsContact O-N 3.14Å; D782-K808 PolarHBondContact O-NZ 3.41Å
783	S	61.3	Low	62	Low	39 Å²	39	81.4 Å²	81.4	27%	0.273	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-86.1	-4.9	178.6	71.7	0	0	0	0	114.4	T780 G781 T807 K808	T780-S783 PolarHBondContact O-N 3.3Å; T780-S783 VanDerWaalsContact O-N 3.09Å; T780-S783 PolarHBondContact O-OG 2.86Å; G781-S783 PolarHBondContact O-N 3.06Å; G781-S783 VanDerWaalsContact O-N 3.1Å; S783-T807 WeakPolarHBondContact O-CA 3.33Å; S783-K808 PolarHBondContact O-N 3.4Å
784	C	71.9	Confident	64.8	Low	11 Å²	11	76.9 Å²	76.9	7%	0.074	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	144.7	-178	-63.3	0	0	0	0	112.7	G781 C787 L806 K808	G781-C784 WeakPolarHBondContact O-CB 3.39Å; G781-C784 PolarHBondContact O-N 2.84Å; C784-C787 HydrophobicContact CB-CB 3.81Å; C784-C787 VanDerWaalsContact CB-SG 3.55Å; C784-L806 CarbonylContact C-O 3.5Å; C784-L806 VanDerWaalsContact CA-O 3.29Å; C784-L806 WeakPolarHBondContact CA-O 3.46Å; C784-K808 WeakPolarHBondContact O-CE 3.36Å
785	L	77.6	Confident	67.2	Low	65 Å²	65	75.6 Å²	75.6	34%	0.34	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-45.3	164.7	-78	167.2	0	0	0	110.5	L806 T807 K808 P811 P888	L785-L806 HydrophobicContact CB-CB 4.49Å; L785-L806 PolarHBondContact N-O 3.29Å; L785-T807 WeakPolarHBondContact CD1-O 3.42Å; L785-K808 HydrophobicContact CD2-CG 3.8Å; L785-K808 HydrophobicContact CG-CB 4.38Å; L785-K808 HydrophobicContact CG-CG 3.76Å; L785-P811 HydrophobicContact CD1-CB 3.67Å; L785-P888 HydrophobicContact CD1-CG 4.46Å
786	L	87.3	Confident	68.9	Low	36 Å²	36	68.7 Å²	68.7	19%	0.188	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	128.3	173.6	-173.3	59.4	0	0	0	108	L806 W875 V878	L786-L806 PolarHBondContact O-N 3.03Å; L786-W875 HydrophobicContact CB-CH2 4.33Å; L786-W875 HydrophobicContact CB-CZ3 4.43Å; L786-W875 HydrophobicContact CD2-CB 4.45Å; L786-W875 HydrophobicContact CD2-CD2 3.45Å; L786-W875 VanDerWaalsContact CD2-CD2 3.45Å; L786-W875 HydrophobicContact CD2-CE3 3.65Å; L786-W875 HydrophobicContact CD2-CG 3.83Å; L786-W875 HydrophobicContact CD2-CH2 4.34Å; L786-W875 HydrophobicContact CD2-CZ2 4.19Å; L786-W875 HydrophobicContact CD2-CZ3 4.09Å; L786-W875 HydrophobicContact CG-CD2 4.01Å; L786-W875 HydrophobicContact CG-CE3 4.18Å; L786-W875 HydrophobicContact CG-CH2 3.95Å; L786-W875 HydrophobicContact CG-CZ2 3.77Å; L786-W875 HydrophobicContact CG-CZ3 4.15Å; L786-W875 WeakPolarHBondContact O-CH2 3.22Å; L786-V878 HydrophobicContact CD2-CB 4.35Å; L786-V878 HydrophobicContact CD2-CG2 4.28Å
787	C	88.8	Confident	71.3	Confident	40 Å²	40	67 Å²	67	27%	0.27	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.2	175	61.8	0	0	0	0	111.4	C784 W803 V804 A805	C784-C787 HydrophobicContact CB-CB 3.81Å; C784-C787 VanDerWaalsContact CB-SG 3.55Å; C787-W803 HydrophobicContact CB-CH2 4.29Å; C787-W803 HydrophobicContact CB-CZ2 3.66Å; C787-V804 CarbonylContact C-O 3.5Å; C787-V804 WeakPolarHBondContact CA-O 3.45Å; C787-A805 HydrophobicContact CB-CB 3.76Å
788	G	86.8	Confident	73.4	Confident	15 Å²	15	66 Å²	66	16%	0.155	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.1	173.9	-178.3	0	0	0	0	0	112.4	W803 V804	G788-W803 VanDerWaalsContact C-CE3 3.4Å; G788-W803 VanDerWaalsContact CA-CZ3 3.46Å; G788-V804 PolarHBondContact N-O 3.21Å; G788-V804 PolarHBondContact O-N 2.88Å
789	Y	88.4	Confident	75.7	Confident	122 Å²	122	63.8 Å²	63.8	48%	0.478	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	124.8	169	-72.1	-77.3	0	0	0	110.2	K801 M802 W803	Y789-K801 VanDerWaalsContact CB-CE 3.49Å; Y789-K801 HydrophobicContact CD1-CD 4.47Å; Y789-K801 HydrophobicContact CD1-CG 4.12Å; Y789-M802 WeakPolarHBondContact CA-O 3.48Å; Y789-W803 HydrophobicContact CD1-CB 4.17Å; Y789-W803 HydrophobicContact CD1-CE3 4.02Å; Y789-W803 AromaticContact CD2-CE3 3.57Å; Y789-W803 HydrophobicContact CD2-CE3 3.57Å; Y789-W803 AromaticContact CD2-CZ3 3.73Å; Y789-W803 HydrophobicContact CD2-CZ3 3.73Å; Y789-W803 HydrophobicContact CE1-CB 3.84Å; Y789-W803 AromaticContact CE1-CE3 3.94Å; Y789-W803 HydrophobicContact CE1-CE3 3.94Å; Y789-W803 AromaticContact CE2-CE3 3.46Å; Y789-W803 HydrophobicContact CE2-CE3 3.46Å; Y789-W803 VanDerWaalsContact CE2-CE3 3.46Å; Y789-W803 AromaticContact CE2-CZ3 3.68Å; Y789-W803 HydrophobicContact CE2-CZ3 3.68Å; Y789-W803 AromaticContact CG-CE3 3.84Å; Y789-W803 HydrophobicContact CG-CE3 3.84Å; Y789-W803 HydrophobicContact CG-CZ3 4.37Å; Y789-W803 AromaticContact CZ-CE3 3.65Å
790	L	89.8	Confident	77.4	Confident	3 Å²	3	64 Å²	64	2%	0.016	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	154.5	169.8	-63.1	178.6	0	0	0	109.6	V792 M802 V804 F853 L864 S865 A866 W875	L790-V792 HydrophobicContact CB-CG2 4.17Å; L790-M802 PolarHBondContact N-O 3.3Å; L790-M802 PolarHBondContact O-N 3.17Å; L790-V804 HydrophobicContact CB-CG2 3.94Å; L790-V804 HydrophobicContact CD1-CB 4.15Å; L790-V804 HydrophobicContact CD1-CG1 4.21Å; L790-V804 HydrophobicContact CD1-CG2 4.09Å; L790-V804 HydrophobicContact CG-CB 4.38Å; L790-V804 HydrophobicContact CG-CG2 4.18Å; L790-F853 HydrophobicContact CD1-CZ 4.1Å; L790-L864 HydrophobicContact CD1-CB 4.48Å; L790-L864 HydrophobicContact CD1-CD2 3.78Å; L790-S865 WeakPolarHBondContact CD2-O 3.48Å; L790-A866 HydrophobicContact CD2-CB 3.98Å; L790-W875 HydrophobicContact CD1-CD2 3.99Å; L790-W875 HydrophobicContact CD1-CG 4.21Å; L790-W875 HydrophobicContact CD1-CZ2 4.26Å
791	Q	89	Confident	79.1	Confident	81 Å²	81	66.1 Å²	66.1	38%	0.379	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.6	158.4	-61.4	-159.1	49.2	0	0	108	W799 L864 S865	Q791-W799 HydrophobicContact CB-CE3 3.77Å; Q791-W799 HydrophobicContact CB-CZ3 4.24Å; Q791-L864 CarbonylContact O-C 3.46Å; Q791-L864 WeakPolarHBondContact O-CA 3.48Å; Q791-S865 PolarHBondContact N-O 3.38Å; Q791-S865 PolarHBondContact O-N 3.03Å
792	V	89.3	Confident	81.2	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.1	-178.9	-177.7	0	0	0	0	109.5	L790 A800 M802 V804 F862 L863 L864	L790-V792 HydrophobicContact CB-CG2 4.17Å; V792-A800 PolarHBondContact N-O 3.14Å; V792-A800 PolarHBondContact O-N 3.05Å; V792-M802 HydrophobicContact CB-CE 3.59Å; V792-M802 HydrophobicContact CG1-CE 3.6Å; V792-M802 HydrophobicContact CG2-CB 4.49Å; V792-M802 HydrophobicContact CG2-CE 4.12Å; V792-V804 HydrophobicContact CG2-CG2 4.11Å; V792-F862 HydrophobicContact CG1-CD1 4.33Å; V792-L863 CarbonylContact C-O 3.59Å; V792-L863 WeakPolarHBondContact CA-O 3.17Å; V792-L864 HydrophobicContact CG1-CG 4.38Å; V792-L864 HydrophobicContact CG2-CD2 4Å; V792-L864 HydrophobicContact CG2-CG 4.12Å
793	Q	87.4	Confident	82.9	Confident	54 Å²	54	61.5 Å²	61.5	25%	0.252	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.4	174.1	-173.6	-179.6	24.6	0	0	109.3	K797 W799 F862 L863	Q793-K797 VanDerWaalsContact CG-O 3.29Å; Q793-K797 WeakPolarHBondContact CG-O 3.17Å; Q793-K797 PolarHBondContact NE2-O 2.99Å; Q793-W799 HydrophobicContact CB-CD2 3.68Å; Q793-W799 HydrophobicContact CB-CE3 3.72Å; Q793-W799 HydrophobicContact CB-CG 4.16Å; Q793-W799 HydrophobicContact CB-CH2 4.33Å; Q793-W799 HydrophobicContact CB-CZ2 4.27Å; Q793-W799 HydrophobicContact CB-CZ3 4.06Å; Q793-F862 WeakPolarHBondContact O-CA 3.47Å; Q793-L863 HydrophobicContact CB-CB 4.37Å; Q793-L863 PolarHBondContact N-O 3.42Å; Q793-L863 PolarHBondContact O-N 3.22Å
794	E	85.8	Confident	84.3	Confident	35 Å²	35	59.7 Å²	59.7	16%	0.164	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	149.1	168.6	-54.8	-174.8	179.2	0	0	109.8	G796 K797 R827 F862	E794-G796 PolarHBondContact O-N 2.96Å; E794-K797 HydrophobicContact CB-CD 4.07Å; E794-K797 HydrophobicContact CB-CG 4.4Å; E794-K797 PolarHBondContact O-N 3.16Å; E794-K797 WeakPolarHBondContact OE2-CE 3.28Å; E794-K797 IonicContact OE2-NZ 2.64Å; E794-K797 PolarHBondContact OE2-NZ 3.32Å; E794-R827 IonicContact OE1-CZ 2.72Å; E794-R827 IonicContact OE1-NH1 3.87Å; E794-R827 PolarHBondContact OE1-NH1 3.21Å; E794-R827 IonicContact OE2-NH1 3.92Å; E794-R827 PolarHBondContact OE2-NH1 3.37Å; E794-F862 HydrophobicContact CG-CD1 3.83Å; E794-F862 HydrophobicContact CG-CE1 3.92Å
795	K	76.6	Confident	85.1	Confident	166 Å²	166	59.1 Å²	59.1	72%	0.722	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	112.3	177.3	-172.2	175.7	-177.3	175.8	0	112.1	T861	K795-T861 PolarHBondContact N-O 3.48Å
796	G	67.7	Low	85.5	Confident	86 Å²	86	56 Å²	56	89%	0.887	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	7.7	-179.9	0	0	0	0	0	116.3	E794	E794-G796 PolarHBondContact O-N 2.96Å
797	K	79.3	Confident	85.3	Confident	122 Å²	122	54.4 Å²	54.4	53%	0.53	29%	0.288	S	S	.	.	S	Bend	trans	-111.1	168	173.5	-61.4	-173.9	-173.4	163.7	0	111.7	Q793 E794	Q793-K797 VanDerWaalsContact CG-O 3.29Å; Q793-K797 WeakPolarHBondContact CG-O 3.17Å; Q793-K797 PolarHBondContact NE2-O 2.99Å; E794-K797 HydrophobicContact CB-CD 4.07Å; E794-K797 HydrophobicContact CB-CG 4.4Å; E794-K797 PolarHBondContact O-N 3.16Å; E794-K797 WeakPolarHBondContact OE2-CE 3.28Å; E794-K797 IonicContact OE2-NZ 2.64Å; E794-K797 PolarHBondContact OE2-NZ 3.32Å
798	S	81	Confident	84.6	Confident	95 Å²	95	58.3 Å²	58.3	66%	0.664	30%	0.3	S	S	*	.			trans	-72.8	162.8	163.5	58.8	0	0	0	0	111.2
799	W	85.6	Confident	84	Confident	61 Å²	61	61.8 Å²	61.8	23%	0.231	32%	0.319	C	S	.	.			trans	-57.7	141	164.1	-69.2	97.1	0	0	0	110.8	Q791 Q793 V849 V852 L863	Q791-W799 HydrophobicContact CB-CE3 3.77Å; Q791-W799 HydrophobicContact CB-CZ3 4.24Å; Q793-W799 HydrophobicContact CB-CD2 3.68Å; Q793-W799 HydrophobicContact CB-CE3 3.72Å; Q793-W799 HydrophobicContact CB-CG 4.16Å; Q793-W799 HydrophobicContact CB-CH2 4.33Å; Q793-W799 HydrophobicContact CB-CZ2 4.27Å; Q793-W799 HydrophobicContact CB-CZ3 4.06Å; W799-V849 HydrophobicContact CD2-CG1 4.36Å; W799-V849 HydrophobicContact CE3-CG1 4.47Å; W799-V849 HydrophobicContact CH2-CG1 3.96Å; W799-V849 HydrophobicContact CZ2-CG1 3.84Å; W799-V849 HydrophobicContact CZ3-CG1 4.29Å; W799-V852 HydrophobicContact CH2-CG1 4.17Å; W799-V852 HydrophobicContact CH2-CG2 4.38Å; W799-L863 HydrophobicContact CH2-CB 3.68Å; W799-L863 HydrophobicContact CZ2-CB 4.2Å; W799-L863 HydrophobicContact CZ2-CD2 4.4Å; W799-L863 HydrophobicContact CZ3-CB 4.33Å
800	A	85.4	Confident	83.5	Confident	46 Å²	46	59.1 Å²	59.1	38%	0.38	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	139.3	174.1	0	0	0	0	0	110.2	V792 M802	V792-A800 PolarHBondContact N-O 3.14Å; V792-A800 PolarHBondContact O-N 3.05Å; A800-M802 PolarHBondContact O-N 3.17Å
801	K	87.3	Confident	83	Confident	128 Å²	128	60 Å²	60	56%	0.557	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	117.9	171.8	-171.9	174.2	-177	174.9	0	108.9	Y789	Y789-K801 VanDerWaalsContact CB-CE 3.49Å; Y789-K801 HydrophobicContact CD1-CD 4.47Å; Y789-K801 HydrophobicContact CD1-CG 4.12Å
802	M	88.8	Confident	82.9	Confident	15 Å²	15	58.6 Å²	58.6	7%	0.074	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.5	176.3	-65.8	-156	-80	0	0	110.2	Y789 L790 V792 A800 V804 L816 Q817	Y789-M802 WeakPolarHBondContact CA-O 3.48Å; L790-M802 PolarHBondContact N-O 3.3Å; L790-M802 PolarHBondContact O-N 3.17Å; V792-M802 HydrophobicContact CB-CE 3.59Å; V792-M802 HydrophobicContact CG1-CE 3.6Å; V792-M802 HydrophobicContact CG2-CB 4.49Å; V792-M802 HydrophobicContact CG2-CE 4.12Å; A800-M802 PolarHBondContact O-N 3.17Å; M802-V804 HydrophobicContact CB-CG2 4.45Å; M802-L816 HydrophobicContact CE-CB 4.18Å; M802-L816 HydrophobicContact CE-CD1 4.17Å; M802-L816 HydrophobicContact CE-CD2 4.44Å; M802-L816 HydrophobicContact SD-CB 4.27Å; M802-Q817 CarbonylContact C-O 3.55Å; M802-Q817 WeakPolarHBondContact CA-O 3.5Å
803	W	87.1	Confident	82.7	Confident	69 Å²	69	59.6 Å²	59.6	26%	0.261	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128.8	161.4	-177.3	-107.1	0	0	0	107.9	C787 G788 Y789 Q817	C787-W803 HydrophobicContact CB-CH2 4.29Å; C787-W803 HydrophobicContact CB-CZ2 3.66Å; G788-W803 VanDerWaalsContact C-CE3 3.4Å; G788-W803 VanDerWaalsContact CA-CZ3 3.46Å; Y789-W803 HydrophobicContact CD1-CB 4.17Å; Y789-W803 HydrophobicContact CD1-CE3 4.02Å; Y789-W803 AromaticContact CD2-CE3 3.57Å; Y789-W803 HydrophobicContact CD2-CE3 3.57Å; Y789-W803 AromaticContact CD2-CZ3 3.73Å; Y789-W803 HydrophobicContact CD2-CZ3 3.73Å; Y789-W803 HydrophobicContact CE1-CB 3.84Å; Y789-W803 AromaticContact CE1-CE3 3.94Å; Y789-W803 HydrophobicContact CE1-CE3 3.94Å; Y789-W803 AromaticContact CE2-CE3 3.46Å; Y789-W803 HydrophobicContact CE2-CE3 3.46Å; Y789-W803 VanDerWaalsContact CE2-CE3 3.46Å; Y789-W803 AromaticContact CE2-CZ3 3.68Å; Y789-W803 HydrophobicContact CE2-CZ3 3.68Å; Y789-W803 AromaticContact CG-CE3 3.84Å; Y789-W803 HydrophobicContact CG-CE3 3.84Å; Y789-W803 HydrophobicContact CG-CZ3 4.37Å; Y789-W803 AromaticContact CZ-CE3 3.65Å; W803-Q817 HydrophobicContact CB-CB 4.34Å; W803-Q817 PolarHBondContact N-O 3Å; W803-Q817 PolarHBondContact O-N 2.91Å
804	V	90.6	Very high	82.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.5	-176.4	-175.8	0	0	0	0	107.9	C787 G788 L790 V792 M802 L814 Y815 L816 W875	C787-V804 CarbonylContact C-O 3.5Å; C787-V804 WeakPolarHBondContact CA-O 3.45Å; G788-V804 PolarHBondContact N-O 3.21Å; G788-V804 PolarHBondContact O-N 2.88Å; L790-V804 HydrophobicContact CB-CG2 3.94Å; L790-V804 HydrophobicContact CD1-CB 4.15Å; L790-V804 HydrophobicContact CD1-CG1 4.21Å; L790-V804 HydrophobicContact CD1-CG2 4.09Å; L790-V804 HydrophobicContact CG-CB 4.38Å; L790-V804 HydrophobicContact CG-CG2 4.18Å; V792-V804 HydrophobicContact CG2-CG2 4.11Å; M802-V804 HydrophobicContact CB-CG2 4.45Å; V804-L814 HydrophobicContact CG1-CD1 3.42Å; V804-L814 VanDerWaalsContact CG1-CD1 3.42Å; V804-L814 HydrophobicContact CG1-CD2 4.38Å; V804-L814 HydrophobicContact CG1-CG 4.04Å; V804-Y815 WeakPolarHBondContact CA-O 3.44Å; V804-L816 HydrophobicContact CB-CD2 4.37Å; V804-L816 HydrophobicContact CG1-CD2 3.96Å; V804-L816 HydrophobicContact CG2-CD2 3.75Å; V804-W875 HydrophobicContact CB-CH2 4.11Å; V804-W875 HydrophobicContact CB-CZ2 4.35Å; V804-W875 HydrophobicContact CG1-CH2 3.67Å; V804-W875 HydrophobicContact CG1-CZ2 4.3Å; V804-W875 HydrophobicContact CG1-CZ3 3.9Å
805	A	88.7	Confident	82.9	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	140.7	-176.9	0	0	0	0	0	113.1	L779 C787 Y815	L779-A805 HydrophobicContact CD1-CB 4.43Å; C787-A805 HydrophobicContact CB-CB 3.76Å; A805-Y815 PolarHBondContact N-O 2.83Å; A805-Y815 PolarHBondContact O-N 2.83Å
806	L	85.7	Confident	83.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.9	164.5	-67.7	168.9	0	0	0	107.8	C784 L785 L786 L814 L831 W875 V878 L879	C784-L806 CarbonylContact C-O 3.5Å; C784-L806 VanDerWaalsContact CA-O 3.29Å; C784-L806 WeakPolarHBondContact CA-O 3.46Å; L785-L806 HydrophobicContact CB-CB 4.49Å; L785-L806 PolarHBondContact N-O 3.29Å; L786-L806 PolarHBondContact O-N 3.03Å; L806-L814 HydrophobicContact CD2-CB 4.16Å; L806-L814 HydrophobicContact CD2-CD1 3.77Å; L806-L814 HydrophobicContact CG-CD1 3.89Å; L806-L831 HydrophobicContact CD2-CD1 3.73Å; L806-W875 HydrophobicContact CD1-CE3 4.44Å; L806-W875 HydrophobicContact CD1-CZ3 3.91Å; L806-W875 HydrophobicContact CG-CZ3 4.12Å; L806-V878 HydrophobicContact CD1-CG1 3.5Å; L806-V878 VanDerWaalsContact CD1-CG1 3.5Å; L806-L879 HydrophobicContact CD1-CD2 4.05Å
807	T	82.4	Confident	84.3	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.1	-175.8	66.3	0	0	0	0	111.9	L779 S783 L785 T809 E810 P811 Y815	L779-T807 HydrophobicContact CD2-CG2 3.72Å; S783-T807 WeakPolarHBondContact O-CA 3.33Å; L785-T807 WeakPolarHBondContact CD1-O 3.42Å; T807-T809 PolarHBondContact O-N 3.26Å; T807-T809 PolarHBondContact OG1-OG1 3.16Å; T807-E810 CarbonylContact O-C 3.55Å; T807-E810 VanDerWaalsContact O-C 3.24Å; T807-E810 PolarHBondContact O-N 3.34Å; T807-E810 WeakPolarHBondContact OG1-CA 3.34Å; T807-E810 WeakPolarHBondContact OG1-CB 3.48Å; T807-E810 PolarHBondContact OG1-N 3.1Å; T807-P811 WeakPolarHBondContact O-CA 3.44Å; T807-P811 VanDerWaalsContact O-N 3.17Å; T807-Y815 HydrophobicContact CG2-CD2 4.18Å; T807-Y815 HydrophobicContact CG2-CE2 3.98Å
808	K	74.9	Confident	84.3	Confident	121 Å²	121	47.4 Å²	47.4	53%	0.526	25%	0.25	S	C	.	.	S	Bend	trans	-61.7	-26.9	171.7	-69.4	168.9	177.8	161.3	0	111.9	D782 S783 C784 L785	D782-K808 PolarHBondContact O-NZ 3.41Å; S783-K808 PolarHBondContact O-N 3.4Å; C784-K808 WeakPolarHBondContact O-CE 3.36Å; L785-K808 HydrophobicContact CD2-CG 3.8Å; L785-K808 HydrophobicContact CG-CB 4.38Å; L785-K808 HydrophobicContact CG-CG 3.76Å
809	T	72.9	Confident	83.3	Confident	88 Å²	88	46.9 Å²	46.9	54%	0.54	25%	0.246	S	C	.	.	S	Bend	trans	-82.3	-29.4	177.2	48.2	0	0	0	0	113.7	T807	T807-T809 PolarHBondContact O-N 3.26Å; T807-T809 PolarHBondContact OG1-OG1 3.16Å
810	E	78.8	Confident	81.7	Confident	67 Å²	67	46.5 Å²	46.5	31%	0.313	26%	0.261	S	S	.	.			trans	-136.4	70.5	-179.8	-55	-164.5	-178.1	0	0	110.8	L594 T807 L812 V813 Y815	L594-E810 HydrophobicContact CD2-CB 4.47Å; L594-E810 HydrophobicContact CD2-CG 4.1Å; T807-E810 CarbonylContact O-C 3.55Å; T807-E810 VanDerWaalsContact O-C 3.24Å; T807-E810 PolarHBondContact O-N 3.34Å; T807-E810 WeakPolarHBondContact OG1-CA 3.34Å; T807-E810 WeakPolarHBondContact OG1-CB 3.48Å; T807-E810 PolarHBondContact OG1-N 3.1Å; E810-L812 PolarHBondContact O-N 3.31Å; E810-V813 HydrophobicContact CB-CB 4.13Å; E810-V813 HydrophobicContact CB-CG2 4.17Å; E810-V813 PolarHBondContact O-N 3.13Å; E810-V813 VanDerWaalsContact O-N 3.16Å; E810-Y815 PolarHBondContact OE2-OH 2.87Å; E810-Y815 VanDerWaalsContact OE2-OH 3.05Å
811	P	79.6	Confident	79.6	Confident	21 Å²	21	53.9 Å²	53.9	14%	0.136	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.7	-177.6	21	-32.8	0	0	0	114.2	L785 T807 A882 A887	L785-P811 HydrophobicContact CD1-CB 3.67Å; T807-P811 WeakPolarHBondContact O-CA 3.44Å; T807-P811 VanDerWaalsContact O-N 3.17Å; P811-A882 WeakPolarHBondContact O-CB 3.42Å; P811-A887 HydrophobicContact CB-CB 4.34Å; P811-A887 HydrophobicContact CG-CB 3.88Å
812	L	85.6	Confident	77.4	Confident	51 Å²	51	54.7 Å²	54.7	27%	0.267	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	9	-176.2	-48.8	-176.3	0	0	0	113	E810 L831 P832 A882	E810-L812 PolarHBondContact O-N 3.31Å; L812-L831 PolarHBondContact O-N 3.17Å; L812-P832 HydrophobicContact CB-CG 4.13Å; L812-P832 HydrophobicContact CD1-CG 4.24Å; L812-P832 WeakPolarHBondContact O-CD 3.47Å; L812-A882 HydrophobicContact CD2-CB 4.24Å; L812-A882 WeakPolarHBondContact CD2-O 3.42Å
813	V	86.6	Confident	75.4	Confident	24 Å²	24	62.3 Å²	62.3	15%	0.145	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	114.1	-176.1	-177.7	0	0	0	0	110.8	E810 Y815 A828	E810-V813 HydrophobicContact CB-CB 4.13Å; E810-V813 HydrophobicContact CB-CG2 4.17Å; E810-V813 PolarHBondContact O-N 3.13Å; E810-V813 VanDerWaalsContact O-N 3.16Å; V813-Y815 HydrophobicContact CB-CE2 4.22Å; V813-Y815 HydrophobicContact CG1-CD2 4.31Å; V813-Y815 HydrophobicContact CG1-CE1 4.42Å; V813-Y815 HydrophobicContact CG1-CE2 3.84Å; V813-A828 HydrophobicContact CG1-CB 3.76Å
814	L	89.1	Confident	73.4	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.016	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.4	175.6	-171.5	67.2	0	0	0	110.3	V804 L806 L816 A828 V829 L831 L855 W875 L879	V804-L814 HydrophobicContact CG1-CD1 3.42Å; V804-L814 VanDerWaalsContact CG1-CD1 3.42Å; V804-L814 HydrophobicContact CG1-CD2 4.38Å; V804-L814 HydrophobicContact CG1-CG 4.04Å; L806-L814 HydrophobicContact CD2-CB 4.16Å; L806-L814 HydrophobicContact CD2-CD1 3.77Å; L806-L814 HydrophobicContact CG-CD1 3.89Å; L814-L816 HydrophobicContact CD2-CD2 4.16Å; L814-L816 HydrophobicContact CG-CD2 4.25Å; L814-A828 CarbonylContact O-C 3.57Å; L814-V829 HydrophobicContact CB-CB 4.39Å; L814-V829 PolarHBondContact N-O 2.89Å; L814-V829 PolarHBondContact O-N 3.16Å; L814-L831 HydrophobicContact CB-CD1 4.18Å; L814-L831 HydrophobicContact CB-CD2 3.91Å; L814-L831 HydrophobicContact CB-CG 4.05Å; L814-L831 HydrophobicContact CD2-CD2 4.32Å; L814-L855 HydrophobicContact CD2-CD2 4.01Å; L814-W875 HydrophobicContact CD1-CZ3 4.03Å; L814-L879 HydrophobicContact CD1-CD2 4Å; L814-L879 HydrophobicContact CD2-CD2 4.27Å
815	Y	87.9	Confident	71.8	Confident	33 Å²	33	71 Å²	71	13%	0.129	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.1	174	-66.8	-89.7	0	0	0	110.5	L779 V804 A805 T807 E810 V813 A828	L779-Y815 HydrophobicContact CD1-CD1 4.43Å; L779-Y815 HydrophobicContact CD1-CD2 4.43Å; L779-Y815 HydrophobicContact CD1-CG 4.07Å; V804-Y815 WeakPolarHBondContact CA-O 3.44Å; A805-Y815 PolarHBondContact N-O 2.83Å; A805-Y815 PolarHBondContact O-N 2.83Å; T807-Y815 HydrophobicContact CG2-CD2 4.18Å; T807-Y815 HydrophobicContact CG2-CE2 3.98Å; E810-Y815 PolarHBondContact OE2-OH 2.87Å; E810-Y815 VanDerWaalsContact OE2-OH 3.05Å; V813-Y815 HydrophobicContact CB-CE2 4.22Å; V813-Y815 HydrophobicContact CG1-CD2 4.31Å; V813-Y815 HydrophobicContact CG1-CE1 4.42Å; V813-Y815 HydrophobicContact CG1-CE2 3.84Å; Y815-A828 HydrophobicContact CD1-CB 4.17Å; Y815-A828 HydrophobicContact CE1-CB 3.96Å
816	L	88.3	Confident	70.8	Confident	6 Å²	6	73 Å²	73	3%	0.031	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.1	175.8	-58.4	175.7	0	0	0	109.8	M802 V804 L814 S826 R827 V829 F862	M802-L816 HydrophobicContact CE-CB 4.18Å; M802-L816 HydrophobicContact CE-CD1 4.17Å; M802-L816 HydrophobicContact CE-CD2 4.44Å; M802-L816 HydrophobicContact SD-CB 4.27Å; V804-L816 HydrophobicContact CB-CD2 4.37Å; V804-L816 HydrophobicContact CG1-CD2 3.96Å; V804-L816 HydrophobicContact CG2-CD2 3.75Å; L814-L816 HydrophobicContact CD2-CD2 4.16Å; L814-L816 HydrophobicContact CG-CD2 4.25Å; L816-S826 CarbonylContact O-C 3.45Å; L816-S826 WeakPolarHBondContact O-CA 3.44Å; L816-R827 HydrophobicContact CB-CB 4.41Å; L816-R827 PolarHBondContact N-O 2.87Å; L816-R827 PolarHBondContact O-N 2.86Å; L816-V829 HydrophobicContact CD1-CG2 3.97Å; L816-V829 HydrophobicContact CG-CG2 4.5Å; L816-F862 HydrophobicContact CD1-CD1 4.2Å; L816-F862 HydrophobicContact CD1-CE1 3.84Å
817	Q	85.6	Confident	70.6	Confident	83 Å²	83	77.7 Å²	77.7	39%	0.388	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	119.5	-179.2	-179.4	174.3	-14.8	0	0	111.5	M802 W803 S826	M802-Q817 CarbonylContact C-O 3.55Å; M802-Q817 WeakPolarHBondContact CA-O 3.5Å; W803-Q817 HydrophobicContact CB-CB 4.34Å; W803-Q817 PolarHBondContact N-O 3Å; W803-Q817 PolarHBondContact O-N 2.91Å; Q817-S826 PolarHBondContact OE1-OG 3.24Å; Q817-S826 VanDerWaalsContact OE1-OG 3.05Å
818	S	78.4	Confident	70.7	Confident	82 Å²	82	80.1 Å²	80.1	57%	0.573	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	141.5	176.8	-57.8	0	0	0	0	112	G820	S818-G820 VanDerWaalsContact C-N 3.26Å; S818-G820 PolarHBondContact O-N 2.95Å
819	S	59	Low	71.2	Confident	85 Å²	85	74.5 Å²	74.5	59%	0.594	42%	0.423	S	S	*	.			trans	-87.4	30.7	179.8	67.4	0	0	0	0	114.3
820	G	52.2	Low	71.9	Confident	53 Å²	53	74.5 Å²	74.5	55%	0.546	43%	0.425	S	S	.	.	S	Bend	trans	-97.1	163.4	-179.1	0	0	0	0	0	113	S818 D822	S818-G820 VanDerWaalsContact C-N 3.26Å; S818-G820 PolarHBondContact O-N 2.95Å; G820-D822 PolarHBondContact O-N 3.14Å
821	Q	42.7	Very low	72.3	Confident	200 Å²	200	71.3 Å²	71.3	94%	0.935	41%	0.41	S	S	*	.	S	Bend	trans	-71.7	-10.5	176	-71	-175.6	-11	0	0	113.9	L823	Q821-L823 PolarHBondContact O-N 2.8Å
822	D	41.1	Very low	72.6	Confident	146 Å²	146	73.2 Å²	73.2	78%	0.781	42%	0.422	S	S	*	.	S	Bend	trans	-70.3	110.1	171.4	-83.5	-47	0	0	0	111	G820 K824	G820-D822 PolarHBondContact O-N 3.14Å; D822-K824 PolarHBondContact O-N 2.99Å
823	L	45.5	Very low	72.4	Confident	175 Å²	175	73 Å²	73	92%	0.916	43%	0.432	S	S	*	.			trans	-71.5	45.8	175.9	-67.1	168.4	0	0	0	113.4	Q821	Q821-L823 PolarHBondContact O-N 2.8Å
824	K	46.3	Very low	72.4	Confident	192 Å²	192	72.3 Å²	72.3	84%	0.835	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-85.8	117.2	165.9	-95.8	174.2	175.2	167.7	0	108.7	D822	D822-K824 PolarHBondContact O-N 2.99Å
825	G	56.2	Low	72.3	Confident	60 Å²	60	78.5 Å²	78.5	62%	0.619	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-62.6	162	-165.6	0	0	0	0	0	115.8	R827	G825-R827 PolarHBondContact O-N 3Å
826	S	68.4	Low	72.4	Confident	42 Å²	42	78.4 Å²	78.4	29%	0.294	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-55.2	126.2	-179.5	-43.2	0	0	0	0	111.7	L816 Q817 A828	L816-S826 CarbonylContact O-C 3.45Å; L816-S826 WeakPolarHBondContact O-CA 3.44Å; Q817-S826 PolarHBondContact OE1-OG 3.24Å; Q817-S826 VanDerWaalsContact OE1-OG 3.05Å; S826-A828 PolarHBondContact O-N 3.16Å
827	R	80.6	Confident	72.3	Confident	97 Å²	97	80 Å²	80	37%	0.366	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.2	-179.8	176.5	-176.4	177.2	172.1	2.1	109.6	E794 L816 G825 V829	E794-R827 IonicContact OE1-CZ 2.72Å; E794-R827 IonicContact OE1-NH1 3.87Å; E794-R827 PolarHBondContact OE1-NH1 3.21Å; E794-R827 IonicContact OE2-NH1 3.92Å; E794-R827 PolarHBondContact OE2-NH1 3.37Å; L816-R827 HydrophobicContact CB-CB 4.41Å; L816-R827 PolarHBondContact N-O 2.87Å; L816-R827 PolarHBondContact O-N 2.86Å; G825-R827 PolarHBondContact O-N 3Å; R827-V829 HydrophobicContact CG-CG2 4.15Å
828	A	84.9	Confident	72.2	Confident	54 Å²	54	82.7 Å²	82.7	45%	0.446	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	136.2	165.7	0	0	0	0	0	110.6	V813 L814 Y815 S826	V813-A828 HydrophobicContact CG1-CB 3.76Å; L814-A828 CarbonylContact O-C 3.57Å; Y815-A828 HydrophobicContact CD1-CB 4.17Å; Y815-A828 HydrophobicContact CE1-CB 3.96Å; S826-A828 PolarHBondContact O-N 3.16Å
829	V	86.6	Confident	72.2	Confident	3 Å²	3	80.7 Å²	80.7	2%	0.018	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	111	173.5	-178.2	0	0	0	0	107.7	L814 L816 R827 L831 F834 F862	L814-V829 HydrophobicContact CB-CB 4.39Å; L814-V829 PolarHBondContact N-O 2.89Å; L814-V829 PolarHBondContact O-N 3.16Å; L816-V829 HydrophobicContact CD1-CG2 3.97Å; L816-V829 HydrophobicContact CG-CG2 4.5Å; R827-V829 HydrophobicContact CG-CG2 4.15Å; V829-L831 PolarHBondContact O-N 3.3Å; V829-F834 HydrophobicContact CG1-CE2 3.98Å; V829-F834 HydrophobicContact CG1-CZ 3.86Å; V829-F862 HydrophobicContact CG1-CE2 4.09Å; V829-F862 HydrophobicContact CG1-CZ 4.25Å; V829-F862 HydrophobicContact CG2-CZ 4.03Å
830	P	86.7	Confident	72.4	Confident	87 Å²	87	81.2 Å²	81.2	57%	0.565	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	127.5	175.1	28.9	-33	0	0	0	109.3	F834	P830-F834 WeakPolarHBondContact O-CD2 3.47Å; P830-F834 WeakPolarHBondContact O-CE2 3.34Å
831	L	86.6	Confident	72.6	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	48%	0.477	C	S	.	.			trans	-82	-27.3	-176	-67.3	177.6	0	0	0	116.5	L806 L812 L814 V829 G833 F834 L855 L879 A882 S883	L806-L831 HydrophobicContact CD2-CD1 3.73Å; L812-L831 PolarHBondContact O-N 3.17Å; L814-L831 HydrophobicContact CB-CD1 4.18Å; L814-L831 HydrophobicContact CB-CD2 3.91Å; L814-L831 HydrophobicContact CB-CG 4.05Å; L814-L831 HydrophobicContact CD2-CD2 4.32Å; V829-L831 PolarHBondContact O-N 3.3Å; L831-G833 PolarHBondContact O-N 3.06Å; L831-F834 WeakPolarHBondContact O-CB 3.4Å; L831-F834 WeakPolarHBondContact O-CD2 3.2Å; L831-F834 PolarHBondContact O-N 2.88Å; L831-L855 HydrophobicContact CD2-CD1 4.23Å; L831-L855 HydrophobicContact CD2-CD2 3.83Å; L831-L879 HydrophobicContact CD1-CD2 3.53Å; L831-L879 HydrophobicContact CD2-CD2 4.09Å; L831-L879 HydrophobicContact CG-CD2 4.49Å; L831-A882 HydrophobicContact CB-CB 4.37Å; L831-A882 HydrophobicContact CD1-CB 3.6Å; L831-S883 VanDerWaalsContact O-CA 3.3Å; L831-S883 WeakPolarHBondContact O-CA 3.4Å; L831-S883 VanDerWaalsContact O-CB 3.3Å; L831-S883 WeakPolarHBondContact O-CB 3.23Å
832	P	85.8	Confident	72.9	Confident	61 Å²	61	78.4 Å²	78.4	40%	0.396	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	125.3	-179.9	-31.7	38	0	0	0	112.9	L812 S883	L812-P832 HydrophobicContact CB-CG 4.13Å; L812-P832 HydrophobicContact CD1-CG 4.24Å; L812-P832 WeakPolarHBondContact O-CD 3.47Å; P832-S883 WeakPolarHBondContact CA-O 3.45Å
833	G	81.1	Confident	73.4	Confident	47 Å²	47	76.3 Å²	76.3	49%	0.485	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	1.6	-176.6	0	0	0	0	0	115.5	L831 H857 S883	L831-G833 PolarHBondContact O-N 3.06Å; G833-H857 PolarHBondContact O-CD2 2.94Å; G833-S883 PolarHBondContact N-O 2.88Å
834	F	87.8	Confident	73.4	Confident	9 Å²	9	70.5 Å²	70.5	4%	0.039	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-83.3	134.7	169.5	-81.1	-97.4	0	0	0	112.7	V829 P830 L831 L855 S856 H857 Q860 F862 S883	V829-F834 HydrophobicContact CG1-CE2 3.98Å; V829-F834 HydrophobicContact CG1-CZ 3.86Å; P830-F834 WeakPolarHBondContact O-CD2 3.47Å; P830-F834 WeakPolarHBondContact O-CE2 3.34Å; L831-F834 WeakPolarHBondContact O-CB 3.4Å; L831-F834 WeakPolarHBondContact O-CD2 3.2Å; L831-F834 PolarHBondContact O-N 2.88Å; F834-L855 HydrophobicContact CB-CD1 3.65Å; F834-L855 HydrophobicContact CB-CG 4.17Å; F834-L855 HydrophobicContact CD1-CD1 4.1Å; F834-L855 HydrophobicContact CD1-CD2 4.32Å; F834-L855 HydrophobicContact CD1-CG 3.63Å; F834-L855 HydrophobicContact CE1-CG 4.29Å; F834-L855 HydrophobicContact CG-CD1 4.14Å; F834-L855 HydrophobicContact CG-CG 4.13Å; F834-S856 CarbonylContact C-O 3.57Å; F834-S856 WeakPolarHBondContact CA-O 3.35Å; F834-S856 VanDerWaalsContact CD1-C 3.41Å; F834-H857 HydrophobicContact CB-CB 4.29Å; F834-H857 HydrophobicContact CD1-CB 3.39Å; F834-H857 HydrophobicContact CD2-CB 3.65Å; F834-H857 HydrophobicContact CE1-CB 3.5Å; F834-H857 HydrophobicContact CE2-CB 3.73Å; F834-H857 AromaticContact CE2-ND1 3.8Å; F834-H857 HydrophobicContact CG-CB 3.5Å; F834-H857 VanDerWaalsContact CG-CB 3.5Å; F834-H857 HydrophobicContact CZ-CB 3.68Å; F834-Q860 HydrophobicContact CE1-CB 4.29Å; F834-Q860 HydrophobicContact CZ-CB 4.3Å; F834-F862 HydrophobicContact CE1-CD2 4.09Å; F834-F862 AromaticContact CE1-CE2 3.86Å; F834-F862 HydrophobicContact CE1-CE2 3.86Å; F834-F862 HydrophobicContact CZ-CE2 4.05Å; F834-S883 WeakPolarHBondContact O-CB 3.43Å; F834-S883 PolarHBondContact O-OG 3.32Å
835	E	85.8	Confident	73.5	Confident	134 Å²	134	69.4 Å²	69.4	63%	0.626	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	127.6	167.4	-64.2	172.8	163.9	0	0	109.7	L855 S856	E835-L855 WeakPolarHBondContact O-CA 3.46Å; E835-S856 PolarHBondContact N-O 2.82Å; E835-S856 PolarHBondContact O-N 2.87Å
836	V	90.7	Very high	73.3	Confident	31 Å²	31	73 Å²	73	19%	0.188	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.4	169.3	-175	0	0	0	0	108.3	K854 L855 V876 L879 S880	V836-K854 WeakPolarHBondContact CA-O 3.3Å; V836-L855 HydrophobicContact CG2-CD1 3.75Å; V836-V876 HydrophobicContact CG1-CB 4.43Å; V836-V876 HydrophobicContact CG1-CG1 4Å; V836-V876 HydrophobicContact CG1-CG2 4.34Å; V836-L879 HydrophobicContact CG2-CB 3.95Å; V836-S880 WeakPolarHBondContact CB-OG 3.38Å
837	S	86.3	Confident	72.4	Confident	38 Å²	38	76.8 Å²	76.8	27%	0.266	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.5	-179.8	42.4	0	0	0	0	110.4	K854	S837-K854 PolarHBondContact N-O 2.73Å; S837-K854 PolarHBondContact O-N 3.36Å; S837-K854 PolarHBondContact OG-O 3.33Å
838	M	83.7	Confident	71.3	Confident	141 Å²	141	80 Å²	80	70%	0.695	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	138.6	170.6	-63.8	-169.7	-67.8	0	0	109.2	V876	M838-V876 HydrophobicContact CG-CG1 4.42Å; M838-V876 HydrophobicContact CG-CG2 4.49Å
839	V	78.9	Confident	70.4	Confident	39 Å²	39	78.2 Å²	78.2	24%	0.236	47%	0.468	C	S	.	.			trans	-104.9	115.5	178.8	-177.2	0	0	0	0	108.3	S841 V852 K854	V839-S841 PolarHBondContact O-N 2.88Å; V839-V852 HydrophobicContact CB-CB 4.4Å; V839-V852 HydrophobicContact CB-CG1 4.12Å; V839-V852 HydrophobicContact CG2-CG1 4.28Å; V839-V852 PolarHBondContact N-O 3.38Å; V839-K854 HydrophobicContact CG2-CB 3.69Å
840	P	63.4	Low	69.9	Low	96 Å²	96	84.6 Å²	84.6	62%	0.623	50%	0.496	S	S	*	.			trans	-58.9	137.2	176.8	-25.1	35	0	0	0	111.5	A842 T843	P840-A842 PolarHBondContact O-N 3.4Å; P840-T843 PolarHBondContact O-N 3.28Å; P840-T843 PolarHBondContact O-OG1 3.1Å
841	S	56.1	Low	69.8	Low	97 Å²	97	82.5 Å²	82.5	68%	0.678	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	1	-173.3	-167.2	0	0	0	0	115.4	V839	V839-S841 PolarHBondContact O-N 2.88Å
842	A	49.3	Very low	69.8	Low	97 Å²	97	83.2 Å²	83.2	80%	0.802	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-1.8	-179	0	0	0	0	0	114.3	P840	P840-A842 PolarHBondContact O-N 3.4Å
843	T	50.3	Low	70.1	Confident	102 Å²	102	80.3 Å²	80.3	63%	0.626	47%	0.465	S	S	*	.	S	Bend	trans	-117.9	14.9	-175.3	55.4	0	0	0	0	114.4	P840	P840-T843 PolarHBondContact O-N 3.28Å; P840-T843 PolarHBondContact O-OG1 3.1Å
844	A	45.2	Very low	70.6	Confident	54 Å²	54	81.1 Å²	81.1	45%	0.446	46%	0.456	S	S	.	.			trans	-106.5	110.5	177.4	0	0	0	0	0	111.2	K846	A844-K846 PolarHBondContact O-N 2.8Å
845	D	48.6	Very low	70.7	Confident	169 Å²	169	80.7 Å²	80.7	90%	0.904	45%	0.454	S	S	*	.	S	Bend	trans	-66.1	19.2	177.6	-68.5	-51.8	0	0	0	114.9
846	K	52.9	Low	70.7	Confident	136 Å²	136	74.9 Å²	74.9	59%	0.591	43%	0.428	S	S	*	.			trans	-143.9	122.4	176.7	-66.7	-163.7	174.1	-160.8	0	111.4	A844 E848	A844-K846 PolarHBondContact O-N 2.8Å; K846-E848 PolarHBondContact O-N 2.77Å; K846-E848 VanDerWaalsContact O-N 3.17Å
847	P	49.3	Very low	70.5	Confident	120 Å²	120	77.4 Å²	77.4	78%	0.779	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.1	-173.6	30.3	-36.7	0	0	0	115
848	E	56.8	Low	70.3	Confident	166 Å²	166	81 Å²	81	78%	0.776	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-16	-172.3	-60.6	-179.4	131.1	0	0	114.5	K846	K846-E848 PolarHBondContact O-N 2.77Å; K846-E848 VanDerWaalsContact O-N 3.17Å
849	V	66.3	Low	70	Confident	16 Å²	16	82.5 Å²	82.5	10%	0.097	47%	0.468	C	S	.	.			trans	-114.5	90.2	-171.4	-169.7	0	0	0	0	110.7	W799 V852 S865	W799-V849 HydrophobicContact CD2-CG1 4.36Å; W799-V849 HydrophobicContact CE3-CG1 4.47Å; W799-V849 HydrophobicContact CH2-CG1 3.96Å; W799-V849 HydrophobicContact CZ2-CG1 3.84Å; W799-V849 HydrophobicContact CZ3-CG1 4.29Å; V849-V852 HydrophobicContact CG1-CG2 3.93Å; V849-V852 WeakPolarHBondContact O-CG2 3.39Å; V849-S865 VanDerWaalsContact CG1-CB 3.43Å; V849-S865 WeakPolarHBondContact CG1-OG 3.38Å
850	K	76.6	Confident	70.2	Confident	136 Å²	136	84.9 Å²	84.9	59%	0.591	48%	0.477	S	S	*	.			trans	-87.4	174.2	175.6	-62.3	-175.7	-179.5	-178.7	0	111.4	V852 S865	K850-V852 PolarHBondContact O-N 2.85Å; K850-S865 PolarHBondContact O-OG 3.25Å
851	N	84.4	Confident	71.2	Confident	43 Å²	43	81.8 Å²	81.8	23%	0.23	46%	0.456	C	S	.	.	S	Bend	trans	56	49.3	170.9	-44.7	-32.7	0	0	0	113.7	A866 Q867 D868 Q872	N851-A866 WeakPolarHBondContact CB-O 3.35Å; N851-A866 PolarHBondContact ND2-O 3.38Å; N851-A866 PolarHBondContact O-N 3.42Å; N851-Q867 PolarHBondContact ND2-O 2.95Å; N851-D868 VanDerWaalsContact ND2-C 3.31Å; N851-D868 VanDerWaalsContact ND2-CA 3.29Å; N851-D868 WeakPolarHBondContact ND2-CA 3.45Å; N851-D868 PolarHBondContact ND2-N 3.23Å; N851-Q872 HydrophobicContact CB-CB 4.13Å; N851-Q872 HydrophobicContact CB-CG 4.33Å
852	V	87.2	Confident	72.8	Confident	15 Å²	15	77.4 Å²	77.4	9%	0.091	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.9	-173.4	-177.8	0	0	0	0	112.5	W799 V839 V849 K850 L863 L864 Q872	W799-V852 HydrophobicContact CH2-CG1 4.17Å; W799-V852 HydrophobicContact CH2-CG2 4.38Å; V839-V852 HydrophobicContact CB-CB 4.4Å; V839-V852 HydrophobicContact CB-CG1 4.12Å; V839-V852 HydrophobicContact CG2-CG1 4.28Å; V839-V852 PolarHBondContact N-O 3.38Å; V849-V852 HydrophobicContact CG1-CG2 3.93Å; V849-V852 WeakPolarHBondContact O-CG2 3.39Å; K850-V852 PolarHBondContact O-N 2.85Å; V852-L863 HydrophobicContact CG1-CB 4.38Å; V852-L863 HydrophobicContact CG1-CD2 4.24Å; V852-L864 CarbonylContact C-O 3.46Å; V852-L864 WeakPolarHBondContact CA-O 3.48Å; V852-Q872 PolarHBondContact O-NE2 3.5Å
853	F	92	Very high	74.8	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.3	170.8	59.9	-78	0	0	0	111	L790 L863 L864 Q872 W875 V876 L879	L790-F853 HydrophobicContact CD1-CZ 4.1Å; F853-L863 WeakPolarHBondContact O-CA 3.31Å; F853-L864 HydrophobicContact CD1-CB 4.19Å; F853-L864 WeakPolarHBondContact CD1-O 3.42Å; F853-L864 HydrophobicContact CD2-CB 4.1Å; F853-L864 HydrophobicContact CD2-CD1 4.31Å; F853-L864 HydrophobicContact CE1-CB 3.74Å; F853-L864 HydrophobicContact CE2-CB 3.6Å; F853-L864 HydrophobicContact CE2-CD1 4Å; F853-L864 HydrophobicContact CE2-CD2 4.11Å; F853-L864 HydrophobicContact CE2-CG 4.11Å; F853-L864 HydrophobicContact CG-CB 4.38Å; F853-L864 HydrophobicContact CZ-CB 3.43Å; F853-L864 VanDerWaalsContact CZ-CB 3.43Å; F853-L864 HydrophobicContact CZ-CD2 4.14Å; F853-L864 HydrophobicContact CZ-CG 4.26Å; F853-L864 PolarHBondContact N-O 2.95Å; F853-L864 PolarHBondContact O-N 3.25Å; F853-Q872 HydrophobicContact CD1-CG 3.83Å; F853-Q872 HydrophobicContact CE1-CG 4.39Å; F853-W875 HydrophobicContact CE1-CB 4.26Å; F853-W875 HydrophobicContact CE2-CB 4.21Å; F853-W875 HydrophobicContact CZ-CB 3.65Å; F853-W875 HydrophobicContact CZ-CG 4.21Å; F853-V876 HydrophobicContact CB-CG2 3.68Å; F853-V876 HydrophobicContact CD1-CG2 4.28Å; F853-V876 HydrophobicContact CD2-CG2 3.96Å; F853-V876 HydrophobicContact CG-CG2 3.73Å; F853-L879 HydrophobicContact CD2-CD1 4.4Å; F853-L879 HydrophobicContact CE2-CD1 3.57Å; F853-L879 HydrophobicContact CZ-CD1 4.38Å
854	K	90.2	Very high	76.7	Confident	65 Å²	65	70.2 Å²	70.2	28%	0.283	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.6	-173.8	166.9	-179.8	166	-98.7	0	110.1	V836 S837 V839 S856 T861 F862	V836-K854 WeakPolarHBondContact CA-O 3.3Å; S837-K854 PolarHBondContact N-O 2.73Å; S837-K854 PolarHBondContact O-N 3.36Å; S837-K854 PolarHBondContact OG-O 3.33Å; V839-K854 HydrophobicContact CG2-CB 3.69Å; K854-S856 WeakPolarHBondContact CE-OG 3.3Å; K854-S856 PolarHBondContact NZ-OG 2.79Å; K854-T861 HydrophobicContact CD-CG2 4.29Å; K854-T861 HydrophobicContact CG-CG2 4.06Å; K854-F862 WeakPolarHBondContact CA-O 3.4Å
855	L	91.3	Very high	78.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	109.3	176.6	-176.7	72.6	0	0	0	108	L814 L831 F834 E835 V836 T861 F862 L864	L814-L855 HydrophobicContact CD2-CD2 4.01Å; L831-L855 HydrophobicContact CD2-CD1 4.23Å; L831-L855 HydrophobicContact CD2-CD2 3.83Å; F834-L855 HydrophobicContact CB-CD1 3.65Å; F834-L855 HydrophobicContact CB-CG 4.17Å; F834-L855 HydrophobicContact CD1-CD1 4.1Å; F834-L855 HydrophobicContact CD1-CD2 4.32Å; F834-L855 HydrophobicContact CD1-CG 3.63Å; F834-L855 HydrophobicContact CE1-CG 4.29Å; F834-L855 HydrophobicContact CG-CD1 4.14Å; F834-L855 HydrophobicContact CG-CG 4.13Å; E835-L855 WeakPolarHBondContact O-CA 3.46Å; V836-L855 HydrophobicContact CG2-CD1 3.75Å; L855-T861 WeakPolarHBondContact O-CA 3.44Å; L855-F862 HydrophobicContact CB-CB 4.39Å; L855-F862 HydrophobicContact CD2-CD2 4.26Å; L855-F862 PolarHBondContact N-O 2.96Å; L855-F862 PolarHBondContact O-N 3.4Å; L855-L864 HydrophobicContact CB-CD1 3.96Å
856	S	86.3	Confident	80.8	Confident	11 Å²	11	60.2 Å²	60.2	8%	0.077	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.4	-174.3	41	0	0	0	0	114.1	F834 E835 K854 Q860	F834-S856 CarbonylContact C-O 3.57Å; F834-S856 WeakPolarHBondContact CA-O 3.35Å; F834-S856 VanDerWaalsContact CD1-C 3.41Å; E835-S856 PolarHBondContact N-O 2.82Å; E835-S856 PolarHBondContact O-N 2.87Å; K854-S856 WeakPolarHBondContact CE-OG 3.3Å; K854-S856 PolarHBondContact NZ-OG 2.79Å; S856-Q860 WeakPolarHBondContact CA-O 3.48Å
857	H	86.3	Confident	82.4	Confident	84 Å²	84	62.4 Å²	62.4	39%	0.389	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	115.2	172.9	175.7	-149.1	0	0	0	109.5	G833 F834 Q859 Q860	G833-H857 PolarHBondContact O-CD2 2.94Å; F834-H857 HydrophobicContact CB-CB 4.29Å; F834-H857 HydrophobicContact CD1-CB 3.39Å; F834-H857 HydrophobicContact CD2-CB 3.65Å; F834-H857 HydrophobicContact CE1-CB 3.5Å; F834-H857 HydrophobicContact CE2-CB 3.73Å; F834-H857 AromaticContact CE2-ND1 3.8Å; F834-H857 HydrophobicContact CG-CB 3.5Å; F834-H857 VanDerWaalsContact CG-CB 3.5Å; F834-H857 HydrophobicContact CZ-CB 3.68Å; H857-Q859 PolarHBondContact O-N 3.33Å; H857-Q860 PolarHBondContact N-O 2.86Å; H857-Q860 PolarHBondContact O-N 3.44Å
858	S	82.2	Confident	84.1	Confident	115 Å²	115	60 Å²	60	80%	0.804	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	-103.7	-178.7	-176.1	0	0	0	0	112.5
859	Q	76.8	Confident	85.4	Confident	171 Å²	171	55 Å²	55	80%	0.799	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-11.4	-179	-60.8	-174.6	1.7	0	0	114.5	H857	H857-Q859 PolarHBondContact O-N 3.33Å
860	Q	82.3	Confident	86.3	Confident	90 Å²	90	60.4 Å²	60.4	42%	0.421	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.1	-179.7	-60.7	-168.2	33.6	0	0	111.5	F834 S856 H857 F862	F834-Q860 HydrophobicContact CE1-CB 4.29Å; F834-Q860 HydrophobicContact CZ-CB 4.3Å; S856-Q860 WeakPolarHBondContact CA-O 3.48Å; H857-Q860 PolarHBondContact N-O 2.86Å; H857-Q860 PolarHBondContact O-N 3.44Å; Q860-F862 HydrophobicContact CB-CE2 4.38Å
861	T	85.3	Confident	86.6	Confident	30 Å²	30	56.1 Å²	56.1	18%	0.184	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	126.9	175.6	-52.9	0	0	0	0	109.4	K795 K854 L855 L863	K795-T861 PolarHBondContact N-O 3.48Å; K854-T861 HydrophobicContact CD-CG2 4.29Å; K854-T861 HydrophobicContact CG-CG2 4.06Å; L855-T861 WeakPolarHBondContact O-CA 3.44Å; T861-L863 HydrophobicContact CG2-CD1 4.26Å
862	F	89.3	Confident	86.9	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.1	172.3	-52.3	-95	0	0	0	107.8	V792 Q793 E794 L816 V829 F834 K854 L855 Q860 L864	V792-F862 HydrophobicContact CG1-CD1 4.33Å; Q793-F862 WeakPolarHBondContact O-CA 3.47Å; E794-F862 HydrophobicContact CG-CD1 3.83Å; E794-F862 HydrophobicContact CG-CE1 3.92Å; L816-F862 HydrophobicContact CD1-CD1 4.2Å; L816-F862 HydrophobicContact CD1-CE1 3.84Å; V829-F862 HydrophobicContact CG1-CE2 4.09Å; V829-F862 HydrophobicContact CG1-CZ 4.25Å; V829-F862 HydrophobicContact CG2-CZ 4.03Å; F834-F862 HydrophobicContact CE1-CD2 4.09Å; F834-F862 AromaticContact CE1-CE2 3.86Å; F834-F862 HydrophobicContact CE1-CE2 3.86Å; F834-F862 HydrophobicContact CZ-CE2 4.05Å; K854-F862 WeakPolarHBondContact CA-O 3.4Å; L855-F862 HydrophobicContact CB-CB 4.39Å; L855-F862 HydrophobicContact CD2-CD2 4.26Å; L855-F862 PolarHBondContact N-O 2.96Å; L855-F862 PolarHBondContact O-N 3.4Å; Q860-F862 HydrophobicContact CB-CE2 4.38Å; F862-L864 HydrophobicContact CB-CD1 3.83Å
863	L	90.3	Very high	86.9	Confident	47 Å²	47	57.5 Å²	57.5	25%	0.246	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	137.4	158.8	-73	73.8	0	0	0	107	V792 Q793 W799 V852 F853 T861	V792-L863 CarbonylContact C-O 3.59Å; V792-L863 WeakPolarHBondContact CA-O 3.17Å; Q793-L863 HydrophobicContact CB-CB 4.37Å; Q793-L863 PolarHBondContact N-O 3.42Å; Q793-L863 PolarHBondContact O-N 3.22Å; W799-L863 HydrophobicContact CH2-CB 3.68Å; W799-L863 HydrophobicContact CZ2-CB 4.2Å; W799-L863 HydrophobicContact CZ2-CD2 4.4Å; W799-L863 HydrophobicContact CZ3-CB 4.33Å; V852-L863 HydrophobicContact CG1-CB 4.38Å; V852-L863 HydrophobicContact CG1-CD2 4.24Å; F853-L863 WeakPolarHBondContact O-CA 3.31Å; T861-L863 HydrophobicContact CG2-CD1 4.26Å
864	L	91.9	Very high	86.8	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.2	178.1	-61.3	94.8	0	0	0	108.8	L790 Q791 V792 V852 F853 L855 F862	L790-L864 HydrophobicContact CD1-CB 4.48Å; L790-L864 HydrophobicContact CD1-CD2 3.78Å; Q791-L864 CarbonylContact O-C 3.46Å; Q791-L864 WeakPolarHBondContact O-CA 3.48Å; V792-L864 HydrophobicContact CG1-CG 4.38Å; V792-L864 HydrophobicContact CG2-CD2 4Å; V792-L864 HydrophobicContact CG2-CG 4.12Å; V852-L864 CarbonylContact C-O 3.46Å; V852-L864 WeakPolarHBondContact CA-O 3.48Å; F853-L864 HydrophobicContact CD1-CB 4.19Å; F853-L864 WeakPolarHBondContact CD1-O 3.42Å; F853-L864 HydrophobicContact CD2-CB 4.1Å; F853-L864 HydrophobicContact CD2-CD1 4.31Å; F853-L864 HydrophobicContact CE1-CB 3.74Å; F853-L864 HydrophobicContact CE2-CB 3.6Å; F853-L864 HydrophobicContact CE2-CD1 4Å; F853-L864 HydrophobicContact CE2-CD2 4.11Å; F853-L864 HydrophobicContact CE2-CG 4.11Å; F853-L864 HydrophobicContact CG-CB 4.38Å; F853-L864 HydrophobicContact CZ-CB 3.43Å; F853-L864 VanDerWaalsContact CZ-CB 3.43Å; F853-L864 HydrophobicContact CZ-CD2 4.14Å; F853-L864 HydrophobicContact CZ-CG 4.26Å; F853-L864 PolarHBondContact N-O 2.95Å; F853-L864 PolarHBondContact O-N 3.25Å; L855-L864 HydrophobicContact CB-CD1 3.96Å; F862-L864 HydrophobicContact CB-CD1 3.83Å
865	S	90.5	Very high	86.8	Confident	9 Å²	9	59 Å²	59	6%	0.063	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.5	175.5	163.9	0	0	0	0	109.9	L790 Q791 V849 K850	L790-S865 WeakPolarHBondContact CD2-O 3.48Å; Q791-S865 PolarHBondContact N-O 3.38Å; Q791-S865 PolarHBondContact O-N 3.03Å; V849-S865 VanDerWaalsContact CG1-CB 3.43Å; V849-S865 WeakPolarHBondContact CG1-OG 3.38Å; K850-S865 PolarHBondContact O-OG 3.25Å
866	A	89.6	Confident	86.8	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.033	32%	0.324	C	S	.	.			trans	-97.8	155.4	174.5	0	0	0	0	0	111.2	L790 N851 D868 L871 Q872	L790-A866 HydrophobicContact CD2-CB 3.98Å; N851-A866 WeakPolarHBondContact CB-O 3.35Å; N851-A866 PolarHBondContact ND2-O 3.38Å; N851-A866 PolarHBondContact O-N 3.42Å; A866-D868 VanDerWaalsContact C-N 3.28Å; A866-D868 PolarHBondContact O-N 2.86Å; A866-L871 HydrophobicContact CB-CB 4.18Å; A866-L871 HydrophobicContact CB-CD2 4.38Å; A866-L871 HydrophobicContact CB-CG 4.09Å; A866-Q872 HydrophobicContact CB-CB 4.03Å
867	Q	85.6	Confident	87	Confident	182 Å²	182	64.5 Å²	64.5	85%	0.85	34%	0.343	S	S	*	.	S	Bend	trans	-64.8	-33	-177.5	-175.4	167.4	-17	0	0	112.9	N851	N851-Q867 PolarHBondContact ND2-O 2.95Å
868	D	84.4	Confident	87.1	Confident	68 Å²	68	61.8 Å²	61.8	36%	0.364	33%	0.332	S	S	.	.	S	Bend	trans	-139.8	168.1	-178.7	61.4	77.9	0	0	0	111	N851 A866 E870 L871 Q872	N851-D868 VanDerWaalsContact ND2-C 3.31Å; N851-D868 VanDerWaalsContact ND2-CA 3.29Å; N851-D868 WeakPolarHBondContact ND2-CA 3.45Å; N851-D868 PolarHBondContact ND2-N 3.23Å; A866-D868 VanDerWaalsContact C-N 3.28Å; A866-D868 PolarHBondContact O-N 2.86Å; D868-E870 WeakPolarHBondContact OD1-CB 3.39Å; D868-E870 PolarHBondContact OD1-N 3.48Å; D868-E870 VanDerWaalsContact OD1-N 3.11Å; D868-L871 VanDerWaalsContact OD1-CB 3.27Å; D868-L871 WeakPolarHBondContact OD1-CB 3.42Å; D868-L871 PolarHBondContact OD1-N 2.7Å; D868-Q872 PolarHBondContact O-N 3.48Å; D868-Q872 VanDerWaalsContact O-N 3.09Å
869	A	84.4	Confident	87.4	Confident	62 Å²	62	56.3 Å²	56.3	51%	0.512	29%	0.294	S	S	.	.	H	α-helix	trans	-74.5	-26.8	-175.8	0	0	0	0	0	113.3	Q872 A873	A869-Q872 WeakPolarHBondContact O-CB 3.5Å; A869-Q872 PolarHBondContact O-N 3.01Å; A869-A873 PolarHBondContact O-N 3.09Å
870	E	84.5	Confident	88	Confident	130 Å²	130	49.3 Å²	49.3	61%	0.607	26%	0.264	S	S	*	.	H	α-helix	trans	-70.4	-44.3	175.9	-66.6	-172.7	-152.3	0	0	111.3	D868 Q872 A873 K874	D868-E870 WeakPolarHBondContact OD1-CB 3.39Å; D868-E870 PolarHBondContact OD1-N 3.48Å; D868-E870 VanDerWaalsContact OD1-N 3.11Å; E870-Q872 VanDerWaalsContact C-N 3.29Å; E870-A873 PolarHBondContact O-N 3.04Å; E870-K874 WeakPolarHBondContact O-CB 3.4Å; E870-K874 WeakPolarHBondContact O-CD 3.27Å; E870-K874 WeakPolarHBondContact O-CG 3.45Å; E870-K874 PolarHBondContact O-N 3.35Å; E870-K874 IonicContact OE2-NZ 2.71Å; E870-K874 PolarHBondContact OE2-NZ 3.21Å
871	L	84.9	Confident	88.1	Confident	46 Å²	46	48.1 Å²	48.1	24%	0.241	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-36.4	175.9	-174.3	59.1	0	0	0	110.2	A866 D868 W875	A866-L871 HydrophobicContact CB-CB 4.18Å; A866-L871 HydrophobicContact CB-CD2 4.38Å; A866-L871 HydrophobicContact CB-CG 4.09Å; D868-L871 VanDerWaalsContact OD1-CB 3.27Å; D868-L871 WeakPolarHBondContact OD1-CB 3.42Å; D868-L871 PolarHBondContact OD1-N 2.7Å; L871-W875 PolarHBondContact O-N 3.3Å
872	Q	90	Very high	88.1	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.126	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-51.6	169.3	-169.6	-171.7	2.8	0	0	111.3	N851 V852 F853 A866 D868 A869 E870 K874 W875 V876	N851-Q872 HydrophobicContact CB-CB 4.13Å; N851-Q872 HydrophobicContact CB-CG 4.33Å; V852-Q872 PolarHBondContact O-NE2 3.5Å; F853-Q872 HydrophobicContact CD1-CG 3.83Å; F853-Q872 HydrophobicContact CE1-CG 4.39Å; A866-Q872 HydrophobicContact CB-CB 4.03Å; D868-Q872 PolarHBondContact O-N 3.48Å; D868-Q872 VanDerWaalsContact O-N 3.09Å; A869-Q872 WeakPolarHBondContact O-CB 3.5Å; A869-Q872 PolarHBondContact O-N 3.01Å; E870-Q872 VanDerWaalsContact C-N 3.29Å; Q872-K874 PolarHBondContact O-N 3.37Å; Q872-W875 PolarHBondContact O-N 3.45Å; Q872-V876 HydrophobicContact CG-CG2 4.42Å; Q872-V876 WeakPolarHBondContact O-CB 3.16Å; Q872-V876 VanDerWaalsContact O-CG2 3.31Å; Q872-V876 WeakPolarHBondContact O-CG2 3.3Å; Q872-V876 PolarHBondContact O-N 3.13Å
873	A	87.3	Confident	87.9	Confident	60 Å²	60	47 Å²	47	50%	0.496	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-46.4	179.1	0	0	0	0	0	111.8	A869 E870 W875 V876 E877	A869-A873 PolarHBondContact O-N 3.09Å; E870-A873 PolarHBondContact O-N 3.04Å; A873-W875 PolarHBondContact O-N 2.97Å; A873-V876 PolarHBondContact O-N 2.75Å; A873-E877 WeakPolarHBondContact O-CB 3Å; A873-E877 PolarHBondContact O-N 3.48Å
874	K	88.6	Confident	87.6	Confident	96 Å²	96	52 Å²	52	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-43.7	177.1	-69.5	159.2	-167.8	164.1	0	111.9	E870 Q872 V878	E870-K874 WeakPolarHBondContact O-CB 3.4Å; E870-K874 WeakPolarHBondContact O-CD 3.27Å; E870-K874 WeakPolarHBondContact O-CG 3.45Å; E870-K874 PolarHBondContact O-N 3.35Å; E870-K874 IonicContact OE2-NZ 2.71Å; E870-K874 PolarHBondContact OE2-NZ 3.21Å; Q872-K874 PolarHBondContact O-N 3.37Å; K874-V878 WeakPolarHBondContact O-CB 3.39Å; K874-V878 VanDerWaalsContact O-CG2 3.27Å; K874-V878 WeakPolarHBondContact O-CG2 3.38Å; K874-V878 PolarHBondContact O-N 3.38Å
875	W	91.3	Very high	86.8	Confident	1 Å²	1	53.7 Å²	53.7	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-67.8	-44.5	174.4	-83.1	108.2	0	0	0	112.7	L786 L790 V804 L806 L814 F853 L871 Q872 A873 E877 L879	L786-W875 HydrophobicContact CB-CH2 4.33Å; L786-W875 HydrophobicContact CB-CZ3 4.43Å; L786-W875 HydrophobicContact CD2-CB 4.45Å; L786-W875 HydrophobicContact CD2-CD2 3.45Å; L786-W875 VanDerWaalsContact CD2-CD2 3.45Å; L786-W875 HydrophobicContact CD2-CE3 3.65Å; L786-W875 HydrophobicContact CD2-CG 3.83Å; L786-W875 HydrophobicContact CD2-CH2 4.34Å; L786-W875 HydrophobicContact CD2-CZ2 4.19Å; L786-W875 HydrophobicContact CD2-CZ3 4.09Å; L786-W875 HydrophobicContact CG-CD2 4.01Å; L786-W875 HydrophobicContact CG-CE3 4.18Å; L786-W875 HydrophobicContact CG-CH2 3.95Å; L786-W875 HydrophobicContact CG-CZ2 3.77Å; L786-W875 HydrophobicContact CG-CZ3 4.15Å; L786-W875 WeakPolarHBondContact O-CH2 3.22Å; L790-W875 HydrophobicContact CD1-CD2 3.99Å; L790-W875 HydrophobicContact CD1-CG 4.21Å; L790-W875 HydrophobicContact CD1-CZ2 4.26Å; V804-W875 HydrophobicContact CB-CH2 4.11Å; V804-W875 HydrophobicContact CB-CZ2 4.35Å; V804-W875 HydrophobicContact CG1-CH2 3.67Å; V804-W875 HydrophobicContact CG1-CZ2 4.3Å; V804-W875 HydrophobicContact CG1-CZ3 3.9Å; L806-W875 HydrophobicContact CD1-CE3 4.44Å; L806-W875 HydrophobicContact CD1-CZ3 3.91Å; L806-W875 HydrophobicContact CG-CZ3 4.12Å; L814-W875 HydrophobicContact CD1-CZ3 4.03Å; F853-W875 HydrophobicContact CE1-CB 4.26Å; F853-W875 HydrophobicContact CE2-CB 4.21Å; F853-W875 HydrophobicContact CZ-CB 3.65Å; F853-W875 HydrophobicContact CZ-CG 4.21Å; L871-W875 PolarHBondContact O-N 3.3Å; Q872-W875 PolarHBondContact O-N 3.45Å; A873-W875 PolarHBondContact O-N 2.97Å; W875-E877 PolarHBondContact O-N 2.72Å; W875-L879 HydrophobicContact CB-CD1 4.46Å; W875-L879 HydrophobicContact CE3-CD1 4.15Å; W875-L879 HydrophobicContact CE3-CG 4.25Å; W875-L879 WeakPolarHBondContact O-CB 3.29Å; W875-L879 WeakPolarHBondContact O-CD1 3.27Å; W875-L879 WeakPolarHBondContact O-CG 3.48Å; W875-L879 PolarHBondContact O-N 3.16Å
876	V	90.9	Very high	86.1	Confident	23 Å²	23	57.3 Å²	57.3	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-44.8	179	166.2	0	0	0	0	111	V836 M838 F853 Q872 A873 S880	V836-V876 HydrophobicContact CG1-CB 4.43Å; V836-V876 HydrophobicContact CG1-CG1 4Å; V836-V876 HydrophobicContact CG1-CG2 4.34Å; M838-V876 HydrophobicContact CG-CG1 4.42Å; M838-V876 HydrophobicContact CG-CG2 4.49Å; F853-V876 HydrophobicContact CB-CG2 3.68Å; F853-V876 HydrophobicContact CD1-CG2 4.28Å; F853-V876 HydrophobicContact CD2-CG2 3.96Å; F853-V876 HydrophobicContact CG-CG2 3.73Å; Q872-V876 HydrophobicContact CG-CG2 4.42Å; Q872-V876 WeakPolarHBondContact O-CB 3.16Å; Q872-V876 VanDerWaalsContact O-CG2 3.31Å; Q872-V876 WeakPolarHBondContact O-CG2 3.3Å; Q872-V876 PolarHBondContact O-N 3.13Å; A873-V876 PolarHBondContact O-N 2.75Å; V876-S880 VanDerWaalsContact O-CB 3.23Å; V876-S880 WeakPolarHBondContact O-CB 3.43Å; V876-S880 PolarHBondContact O-N 3.4Å; V876-S880 PolarHBondContact O-OG 3.2Å
877	E	89.8	Confident	84.7	Confident	102 Å²	102	60.1 Å²	60.1	48%	0.477	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-53.2	179	-168.4	-155.9	144.3	0	0	111.8	A873 W875 L879 S880 K881	A873-E877 WeakPolarHBondContact O-CB 3Å; A873-E877 PolarHBondContact O-N 3.48Å; W875-E877 PolarHBondContact O-N 2.72Å; E877-L879 PolarHBondContact O-N 3.02Å; E877-S880 PolarHBondContact O-N 3.5Å; E877-K881 PolarHBondContact O-N 2.76Å; E877-K881 VanDerWaalsContact O-N 3.09Å; E877-K881 WeakPolarHBondContact OE1-CE 3.36Å; E877-K881 IonicContact OE1-NZ 3.72Å; E877-K881 PolarHBondContact OE1-NZ 2.69Å
878	V	88.2	Confident	83.4	Confident	27 Å²	27	52.7 Å²	52.7	16%	0.164	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-41.1	-176.6	176.5	0	0	0	0	111.2	L786 L806 K874 K881 A882 P888	L786-V878 HydrophobicContact CD2-CB 4.35Å; L786-V878 HydrophobicContact CD2-CG2 4.28Å; L806-V878 HydrophobicContact CD1-CG1 3.5Å; L806-V878 VanDerWaalsContact CD1-CG1 3.5Å; K874-V878 WeakPolarHBondContact O-CB 3.39Å; K874-V878 VanDerWaalsContact O-CG2 3.27Å; K874-V878 WeakPolarHBondContact O-CG2 3.38Å; K874-V878 PolarHBondContact O-N 3.38Å; V878-K881 PolarHBondContact O-N 3.11Å; V878-A882 WeakPolarHBondContact O-CB 3.31Å; V878-A882 PolarHBondContact O-N 2.87Å; V878-P888 HydrophobicContact CG1-CG 3.96Å
879	L	89.9	Confident	81.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-36.1	175.9	-69.3	169.8	0	0	0	112.3	L806 L814 L831 V836 F853 W875 E877 A882 S883	L806-L879 HydrophobicContact CD1-CD2 4.05Å; L814-L879 HydrophobicContact CD1-CD2 4Å; L814-L879 HydrophobicContact CD2-CD2 4.27Å; L831-L879 HydrophobicContact CD1-CD2 3.53Å; L831-L879 HydrophobicContact CD2-CD2 4.09Å; L831-L879 HydrophobicContact CG-CD2 4.49Å; V836-L879 HydrophobicContact CG2-CB 3.95Å; F853-L879 HydrophobicContact CD2-CD1 4.4Å; F853-L879 HydrophobicContact CE2-CD1 3.57Å; F853-L879 HydrophobicContact CZ-CD1 4.38Å; W875-L879 HydrophobicContact CB-CD1 4.46Å; W875-L879 HydrophobicContact CE3-CD1 4.15Å; W875-L879 HydrophobicContact CE3-CG 4.25Å; W875-L879 WeakPolarHBondContact O-CB 3.29Å; W875-L879 WeakPolarHBondContact O-CD1 3.27Å; W875-L879 WeakPolarHBondContact O-CG 3.48Å; W875-L879 PolarHBondContact O-N 3.16Å; E877-L879 PolarHBondContact O-N 3.02Å; L879-A882 PolarHBondContact O-N 2.64Å; L879-S883 VanDerWaalsContact O-CB 3.3Å; L879-S883 WeakPolarHBondContact O-CB 3.47Å; L879-S883 PolarHBondContact O-N 2.81Å; L879-S883 PolarHBondContact O-OG 3.17Å
880	S	88.4	Confident	79.3	Confident	25 Å²	25	59 Å²	59	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-69	-35	179.3	-60.4	0	0	0	0	112.4	V836 V876 E877 R884	V836-S880 WeakPolarHBondContact CB-OG 3.38Å; V876-S880 VanDerWaalsContact O-CB 3.23Å; V876-S880 WeakPolarHBondContact O-CB 3.43Å; V876-S880 PolarHBondContact O-N 3.4Å; V876-S880 PolarHBondContact O-OG 3.2Å; E877-S880 PolarHBondContact O-N 3.5Å; S880-R884 PolarHBondContact O-N 3.49Å; S880-R884 PolarHBondContact O-NH1 3.41Å
881	K	85.8	Confident	76.7	Confident	65 Å²	65	57.4 Å²	57.4	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-65	-55.7	170.3	-71.4	170.6	172.6	175.2	0	109.8	E877 V878 S883 R884 G885 E886	E877-K881 PolarHBondContact O-N 2.76Å; E877-K881 VanDerWaalsContact O-N 3.09Å; E877-K881 WeakPolarHBondContact OE1-CE 3.36Å; E877-K881 IonicContact OE1-NZ 3.72Å; E877-K881 PolarHBondContact OE1-NZ 2.69Å; V878-K881 PolarHBondContact O-N 3.11Å; K881-S883 PolarHBondContact O-N 3.48Å; K881-S883 VanDerWaalsContact O-N 3.16Å; K881-R884 PolarHBondContact O-N 3.09Å; K881-R884 VanDerWaalsContact O-N 3.13Å; K881-G885 PolarHBondContact O-N 3.02Å; K881-E886 CarbonylContact C-O 3.19Å; K881-E886 HydrophobicContact CB-CB 4.16Å; K881-E886 WeakPolarHBondContact O-CB 3.46Å; K881-E886 PolarHBondContact O-N 3.21Å
882	A	85.3	Confident	73.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-29.7	-178.2	0	0	0	0	0	114.1	P811 L812 L831 V878 L879 G885 E886	P811-A882 WeakPolarHBondContact O-CB 3.42Å; L812-A882 HydrophobicContact CD2-CB 4.24Å; L812-A882 WeakPolarHBondContact CD2-O 3.42Å; L831-A882 HydrophobicContact CB-CB 4.37Å; L831-A882 HydrophobicContact CD1-CB 3.6Å; V878-A882 WeakPolarHBondContact O-CB 3.31Å; V878-A882 PolarHBondContact O-N 2.87Å; L879-A882 PolarHBondContact O-N 2.64Å; A882-G885 PolarHBondContact O-N 2.97Å; A882-E886 WeakPolarHBondContact CA-O 3.2Å; A882-E886 PolarHBondContact N-O 3.23Å
883	S	84.9	Confident	71	Confident	13 Å²	13	66.4 Å²	66.4	9%	0.091	39%	0.388	C	S	.	.	H	α-helix	trans	-82.3	-20.8	179.6	81.4	0	0	0	0	114.7	L831 P832 G833 F834 L879 K881	L831-S883 VanDerWaalsContact O-CA 3.3Å; L831-S883 WeakPolarHBondContact O-CA 3.4Å; L831-S883 VanDerWaalsContact O-CB 3.3Å; L831-S883 WeakPolarHBondContact O-CB 3.23Å; P832-S883 WeakPolarHBondContact CA-O 3.45Å; G833-S883 PolarHBondContact N-O 2.88Å; F834-S883 WeakPolarHBondContact O-CB 3.43Å; F834-S883 PolarHBondContact O-OG 3.32Å; L879-S883 VanDerWaalsContact O-CB 3.3Å; L879-S883 WeakPolarHBondContact O-CB 3.47Å; L879-S883 PolarHBondContact O-N 2.81Å; L879-S883 PolarHBondContact O-OG 3.17Å; K881-S883 PolarHBondContact O-N 3.48Å; K881-S883 VanDerWaalsContact O-N 3.16Å
884	R	83.1	Confident	68.1	Low	150 Å²	150	68 Å²	68	57%	0.566	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.7	163.7	-66.4	-170.7	-57.6	-91.5	-3.2	113.1	S880 K881 E886	S880-R884 PolarHBondContact O-N 3.49Å; S880-R884 PolarHBondContact O-NH1 3.41Å; K881-R884 PolarHBondContact O-N 3.09Å; K881-R884 VanDerWaalsContact O-N 3.13Å; R884-E886 VanDerWaalsContact C-N 3.32Å; R884-E886 HydrophobicContact CB-CG 4.38Å; R884-E886 IonicContact CZ-OE1 3.23Å; R884-E886 IonicContact CZ-OE2 3.01Å; R884-E886 IonicContact NE-OE1 3.53Å; R884-E886 PolarHBondContact NE-OE1 2.62Å; R884-E886 IonicContact NE-OE2 3.49Å; R884-E886 IonicContact NH2-OE1 2.68Å; R884-E886 PolarHBondContact NH2-OE1 2.87Å; R884-E886 IonicContact NH2-OE2 2.64Å; R884-E886 PolarHBondContact NH2-OE2 2.63Å
885	G	75.9	Confident	65.3	Low	37 Å²	37	70.4 Å²	70.4	38%	0.381	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	3.8	-174.2	0	0	0	0	0	113.9	K881 A882 A887	K881-G885 PolarHBondContact O-N 3.02Å; A882-G885 PolarHBondContact O-N 2.97Å; G885-A887 PolarHBondContact O-N 2.72Å
886	E	74.9	Confident	62.3	Low	86 Å²	86	76.1 Å²	76.1	40%	0.402	45%	0.447	S	S	.	.			trans	-75.1	115.7	173.3	-63.6	157.4	-153.2	0	0	108.9	K881 A882 R884	K881-E886 CarbonylContact C-O 3.19Å; K881-E886 HydrophobicContact CB-CB 4.16Å; K881-E886 WeakPolarHBondContact O-CB 3.46Å; K881-E886 PolarHBondContact O-N 3.21Å; A882-E886 WeakPolarHBondContact CA-O 3.2Å; A882-E886 PolarHBondContact N-O 3.23Å; R884-E886 VanDerWaalsContact C-N 3.32Å; R884-E886 HydrophobicContact CB-CG 4.38Å; R884-E886 IonicContact CZ-OE1 3.23Å; R884-E886 IonicContact CZ-OE2 3.01Å; R884-E886 IonicContact NE-OE1 3.53Å; R884-E886 PolarHBondContact NE-OE1 2.62Å; R884-E886 IonicContact NE-OE2 3.49Å; R884-E886 IonicContact NH2-OE1 2.68Å; R884-E886 PolarHBondContact NH2-OE1 2.87Å; R884-E886 IonicContact NH2-OE2 2.64Å; R884-E886 PolarHBondContact NH2-OE2 2.63Å
887	A	61.6	Low	59.4	Low	62 Å²	62	83.9 Å²	83.9	51%	0.512	48%	0.482	S	S	.	.			trans	-62.4	131.6	161.8	0	0	0	0	0	108.2	P811 G885 A889	P811-A887 HydrophobicContact CB-CB 4.34Å; P811-A887 HydrophobicContact CG-CB 3.88Å; G885-A887 PolarHBondContact O-N 2.72Å; A887-A889 PolarHBondContact O-N 3.39Å
888	P	56.8	Low	56.5	Low	27 Å²	27	88.4 Å²	88.4	18%	0.175	50%	0.502	C	S	.	.			trans	-58.7	111.3	172.7	-21.5	32.3	0	0	0	109.1	L785 V878 E890	L785-P888 HydrophobicContact CD1-CG 4.46Å; V878-P888 HydrophobicContact CG1-CG 3.96Å; P888-E890 PolarHBondContact O-N 2.87Å
889	A	44.7	Very low	54	Low	90 Å²	90	98.6 Å²	98.6	74%	0.744	54%	0.538	S	S	*	.			trans	-57.5	136.6	171.4	0	0	0	0	0	109.1	A887 A891	A887-A889 PolarHBondContact O-N 3.39Å; A889-A891 PolarHBondContact O-N 3.41Å
890	E	39.1	Very low	51.3	Low	172 Å²	172	108.3 Å²	108.3	80%	0.804	58%	0.58	S	S	*	*			trans	-55.8	131.1	164.4	-66.8	-169.5	143.6	0	0	107.9	P888 S892	P888-E890 PolarHBondContact O-N 2.87Å; E890-S892 PolarHBondContact O-N 2.83Å
891	A	28.9	Very low	48.6	Very low	97 Å²	97	112.6 Å²	112.6	80%	0.802	61%	0.61	S	S	*	*			trans	-72.7	77.8	-175.3	0	0	0	0	0	110.6	A889 M893	A889-A891 PolarHBondContact O-N 3.41Å; A891-M893 VanDerWaalsContact C-N 3.27Å; A891-M893 PolarHBondContact O-N 2.85Å
892	S	27.7	Very low	45.8	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	66%	0.656	S	S	*	*			trans	-64.3	89.9	165.9	58.9	0	0	0	0	108.5	E890 S894	E890-S892 PolarHBondContact O-N 2.83Å; S892-S894 VanDerWaalsContact C-N 3.25Å; S892-S894 PolarHBondContact O-N 3.47Å
893	M	27.3	Very low	43.9	Very low	157 Å²	157	128.3 Å²	128.3	77%	0.773	69%	0.688	S	S	*	*			trans	-67.9	86.9	172.4	-69.6	-157.1	73.5	0	0	109.6	A891 L895	A891-M893 VanDerWaalsContact C-N 3.27Å; A891-M893 PolarHBondContact O-N 2.85Å; M893-L895 PolarHBondContact O-N 2.85Å; M893-L895 VanDerWaalsContact O-N 3.1Å
894	S	26.9	Very low	41.7	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	72%	0.72	S	S	*	*			trans	-74.5	92.1	173.6	53.6	0	0	0	0	109.9	S892 T896	S892-S894 VanDerWaalsContact C-N 3.25Å; S892-S894 PolarHBondContact O-N 3.47Å; S894-T896 PolarHBondContact O-N 3.1Å
895	L	30.9	Very low	39.4	Very low	146 Å²	146	133.4 Å²	133.4	76%	0.764	73%	0.728	S	S	*	*			trans	-73.6	63.2	174.8	-106.4	170.2	0	0	0	111.7	M893	M893-L895 PolarHBondContact O-N 2.85Å; M893-L895 VanDerWaalsContact O-N 3.1Å
896	T	28.1	Very low	37.3	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	75%	0.749	S	S	*	*			trans	-141.9	43.3	-179.1	55.5	0	0	0	0	114.1	S894	S894-T896 PolarHBondContact O-N 3.1Å
897	E	28.6	Very low	34.9	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	77%	0.77	S	S	*	*			trans	-146.3	45.3	159.4	-141.2	165.7	-145.7	0	0	115.2
898	H	30.1	Very low	33.1	Very low	196 Å²	196	147.8 Å²	147.8	91%	0.907	79%	0.788	S	S	*	*			trans	-126.3	73.4	161	-105.5	35.7	0	0	0	110.9
899	R	35.7	Very low	31.4	Very low	242 Å²	242	156.4 Å²	156.4	91%	0.913	83%	0.831	S	S	*	*			trans	-153.8	53.9	163.4	-136.5	174.1	-166.8	175.1	6.1	113.1
900	K	33.5	Very low	30.4	Very low	203 Å²	203	161.5 Å²	161.5	88%	0.883	84%	0.838	S	S	*	*	S	Bend	trans	-147.6	27.1	170.4	-129.9	174.2	-173.2	179.2	0	115.6
901	S	30.9	Very low	29.7	Very low	115 Å²	115	160.7 Å²	160.7	80%	0.804	84%	0.841	S	S	*	*			trans	-165.3	129.2	156.8	-84	0	0	0	0	109
902	Q	27.9	Very low	29.8	Very low	266 Å²	266	166.5 Å²	166.5	100%	1.243	84%	0.844	S	S	*	*			trans	66.6	0	-168.2	-55.1	-175.6	3.6	0	0	114.3

Retrieved 902 of 902 residues in 237.8 ms (Link to these results)

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