A0A087Y326_POEFO Loading...

Poly [ADP-ribose] polymerase

AlphaFold DB , UniProt , Accession A0A087Y326, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,263 aa.

						>A0A087Y326_POEFO|A0A087Y326
MAVSRRSSQQQQQQTTLQSPPRNGSLSGASPASPPMALLSPAVGSSESERECSGGVDMALASPDLPVQVLASSASSTSTTSGGGSSSVSSPGSGATSPIDGSSGVVGAFRELFEACRNGDVSRVKRLVDSVNVNAKDMAGRKSTPLHFAAGFGRKDVVEHLLQTGANVHARDDGGLIPLHNACSFGHAEVVSLLLCQGADPNARDNWNYTPLHEAAIKGKIDVCIVLLQHGADPNIRNTDGKSALDLADPSAKAVLTGEYKKDELLEAARSGNEEKLMALLTPLNVNCHASDGRKSTSQKMLSTPLHLAAGYNRVRIVQLLLQHGADVHAKDKGGLVPLHNACSYGHYEVTELLLKHGACVNAMDLWQFTPLHEAASKNRVEVCSLLLSHGADPTLLNCHSKSAVDMAPTPELKERLTYEFKGHSLLQAAREADMAKVKKTLALEIIGFKHPQSNETALHCAVASPHPKRKQVTELLLRKGANINEKNKDFMTPLHVAAERAHNDILEVLQKHGAKVNAADTLGQTALHRAALAGHIQTCKLLLSYGADPSIVSLQGFTAAQMGNEAVQQILNENVPTRNSDVDYRFLEAAKAGDLDTVQQLCSPQNVNCRDLEGRHSTPLHFAAGYNRVAVVEYLLHHGADVHAKDKGGLVPLHNACSYGHYEVAELLVRHGASVNVADLWKFTPLHEAAAKGKYEICKLLLKHGADPTKKNRDGNIPLDMVKDGDTDIQDLLRGDAALLDAAKKGCLARVQKLCSPENINCRDAQGRNSTPLHLAAGYNNLEVAEYLLEHGADVNAQDKGGLIPLHNAASYGHVDIAALLIKYNTCVNATDKWAFTPLHEAAQKGRTQLCALLLAHGADPTMKNQEGQTALDLATADDIRALLMDAMPPDALPSCFKPQATVVSASVISPASTPSCLSAASSIDNLAGPLTELAASAAAGASGVADGASGTDRKEGEMTMLDMNISQFLKSLGLEHLRDIFEREQITLDVLADMGHEELKEIGINAYGHRHKLIKGVERLLGGQQGGNPYLTFHCANQGTILIDLSPDDKEYQSVEEEMQSTIREHRDGGNAGGVFSRYNIIKIQKVVNKKLRERYTHRQKEIADENHNHHNERMLFHGSPFINAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQYVYGIGGGTGCPTHKDRSCYLCHRQMLFCRVTLGKSFLQFSAMKMAHAPPGHHSVIGRPSVNGLAYAEYVIYRGEQAYPEYLITYQILKPESAAQSAAAAEQKS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.1	Very low	28.1	Very low	246 Å²	246	149.5 Å²	149.5	100%	1.212	78%	0.78	S	S	*	*				0	147.3	0	-78.7	178.3	162	0	0	109.2
2	A	29.4	Very low	28	Very low	91 Å²	91	149.8 Å²	149.8	75%	0.752	77%	0.774	S	S	*	*			trans	43.6	99.7	163.9	0	0	0	0	0	118.3
3	V	29	Very low	27.8	Very low	132 Å²	132	153.8 Å²	153.8	80%	0.8	79%	0.787	S	S	*	*				45.2	113.1	70.9	-161.9	0	0	0	0	112.7
4	S	28.8	Very low	27.9	Very low	93 Å²	93	154.5 Å²	154.5	65%	0.65	79%	0.786	S	S	*	*				-176.8	145.1	87.6	-119.2	0	0	0	0	111.1
5	R	31.1	Very low	27.7	Very low	200 Å²	200	152.7 Å²	152.7	76%	0.755	79%	0.785	S	S	*	*				56.4	141.8	96.5	-61.3	-176.6	174	-178.7	-0.1	115
6	R	28.5	Very low	27.7	Very low	204 Å²	204	149.9 Å²	149.9	77%	0.77	78%	0.778	S	S	*	*			cis	-170.9	161	7.4	-128.4	-179.4	-176.3	-179.4	-1.1	110.6
7	S	26.1	Very low	27.7	Very low	93 Å²	93	149 Å²	149	65%	0.65	77%	0.773	S	S	*	*			trans	51.9	118.4	141.6	69.1	0	0	0	0	121.3
8	S	26	Very low	27.6	Very low	109 Å²	109	149.6 Å²	149.6	76%	0.762	77%	0.772	S	S	*	*				70.7	148.8	99.8	81.1	0	0	0	0	116.1
9	Q	26.4	Very low	27.5	Very low	160 Å²	160	146.9 Å²	146.9	75%	0.748	77%	0.768	S	S	*	*			cis	-169.1	157.8	5.2	-137.6	-177.4	16.6	0	0	108.2
10	Q	26.7	Very low	28.5	Very low	157 Å²	157	145.4 Å²	145.4	73%	0.734	77%	0.767	S	S	*	*			trans	64.7	162.5	164.9	-56.2	-180	3.8	0	0	115.4
11	Q	26	Very low	29.4	Very low	160 Å²	160	143 Å²	143	75%	0.748	76%	0.76	S	S	*	*			cis	-149.6	169.9	16.4	-152.9	167.2	19.3	0	0	112.9
12	Q	26.7	Very low	29.4	Very low	152 Å²	152	142.4 Å²	142.4	71%	0.71	74%	0.744	S	S	*	*			trans	-52.4	159.9	-175.4	-58.3	144.9	-37.7	0	0	117.4
13	Q	25.8	Very low	29.3	Very low	202 Å²	202	145.4 Å²	145.4	94%	0.944	75%	0.748	S	S	*	*				-149.8	148.1	122.5	-113.5	170.7	36.1	0	0	112.9
14	Q	28.3	Very low	29.2	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	75%	0.749	S	S	*	*			trans	-103.5	165.8	-175.6	-62.2	168.3	-43.6	0	0	111.5
15	T	25.7	Very low	29.2	Very low	127 Å²	127	143.7 Å²	143.7	78%	0.779	75%	0.754	S	S	*	*			trans	-179.9	108.5	130.9	23.4	0	0	0	0	108.4
16	T	27.9	Very low	29.1	Very low	108 Å²	108	141.7 Å²	141.7	66%	0.663	76%	0.758	S	S	*	*				69.7	138.4	85.9	62.4	0	0	0	0	114.1
17	L	27.5	Very low	29.2	Very low	135 Å²	135	137.8 Å²	137.8	71%	0.707	76%	0.762	S	S	*	*			cis	-156.1	166.2	34.3	-91.8	105.1	0	0	0	115.1
18	Q	25.3	Very low	29.3	Very low	159 Å²	159	136.8 Å²	136.8	74%	0.743	77%	0.766	S	S	*	*			trans	77.8	93	140.5	-78.2	163.9	-3.9	0	0	124.7
19	S	26.9	Very low	29.4	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	77%	0.773	S	S	*	*				42.9	164.8	98.7	73.4	0	0	0	0	122.9
20	P	46.1	Very low	29.5	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	78%	0.777	S	S	*	*			cis	-132.2	-122.4	-39	36.6	-14.9	0	0	0	110.1
21	P	48	Very low	30.3	Very low	97 Å²	97	133.4 Å²	133.4	63%	0.63	78%	0.781	S	S	*	*			cis	-130.9	153.7	-46.8	35.5	-18.4	0	0	0	116.9
22	R	30.3	Very low	30.3	Very low	232 Å²	232	130.5 Å²	130.5	88%	0.875	78%	0.784	S	S	*	*			trans	65.9	154.3	145.5	-70.9	174.9	-178.7	174.8	-0.8	118.9
23	N	28.4	Very low	30.3	Very low	155 Å²	155	129 Å²	129	83%	0.829	79%	0.791	S	S	*	*			cis	-160.3	167.6	14.6	-127.1	9.6	0	0	0	110.5
24	G	27	Very low	30.5	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	78%	0.784	S	S	*	*			trans	125	134.4	157.8	0	0	0	0	0	116
25	S	27.8	Very low	30.7	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	79%	0.786	S	S	*	*			trans	-135.9	161.1	-169.4	56.4	0	0	0	0	114.1
26	L	29.6	Very low	30.7	Very low	157 Å²	157	126.2 Å²	126.2	82%	0.822	79%	0.793	S	S	*	*			trans	92.8	122.2	157.5	-66.4	164.4	0	0	0	122.1
27	S	30	Very low	30.7	Very low	122 Å²	122	125.5 Å²	125.5	85%	0.853	80%	0.798	S	S	*	*			trans	67.5	134.4	141.5	64.4	0	0	0	0	123
28	G	28.8	Very low	30.8	Very low	73 Å²	73	127 Å²	127	75%	0.753	81%	0.806	S	S	*	*			trans	140.7	90.1	146.1	0	0	0	0	0	118.9
29	A	27.1	Very low	30.8	Very low	109 Å²	109	127.6 Å²	127.6	90%	0.901	81%	0.813	S	S	*	*			trans	64.7	160.9	146.2	0	0	0	0	0	122.4
30	S	29.6	Very low	30.7	Very low	120 Å²	120	128.4 Å²	128.4	84%	0.839	82%	0.819	S	S	*	*			trans	-92.6	172.8	-168.8	-85.6	0	0	0	0	114.3
31	P	42.8	Very low	29.9	Very low	126 Å²	126	129 Å²	129	82%	0.818	82%	0.823	S	S	*	*			trans	-105	174.5	-140.1	40.9	-39.1	0	0	0	116.4
32	A	25.9	Very low	29	Very low	98 Å²	98	129.2 Å²	129.2	81%	0.81	83%	0.832	S	S	*	*			trans	-122.4	148.7	164.9	0	0	0	0	0	111.5
33	S	28.2	Very low	28.8	Very low	121 Å²	121	124.9 Å²	124.9	85%	0.846	83%	0.832	S	S	*	*			trans	-81.8	155	-174.8	-40.9	0	0	0	0	113.9
34	P	29.2	Very low	28.7	Very low	122 Å²	122	121.1 Å²	121.1	79%	0.792	83%	0.83	S	S	*	*			trans	-109.8	166.8	156.5	28.5	-13.4	0	0	0	113.1
35	P	33.4	Very low	28.6	Very low	125 Å²	125	122.8 Å²	122.8	81%	0.812	83%	0.829	S	S	*	*			trans	-103.3	169.1	-154.7	39.6	-36.6	0	0	0	115.5
36	M	25.9	Very low	28.5	Very low	187 Å²	187	122.9 Å²	122.9	92%	0.921	83%	0.829	S	S	*	*			trans	-110.7	125.4	167.4	-87.7	-84.6	-80.5	0	0	110.6
37	A	27.7	Very low	28.3	Very low	94 Å²	94	124.7 Å²	124.7	78%	0.777	83%	0.834	S	S	*	*			trans	-105	152	165.8	0	0	0	0	0	109.9
38	L	29	Very low	27.9	Very low	166 Å²	166	124.5 Å²	124.5	87%	0.869	83%	0.832	S	S	*	*			trans	-65.1	151.9	-177.5	-70.2	151.7	0	0	0	112.9
39	L	24.9	Very low	27.9	Very low	171 Å²	171	130.2 Å²	130.2	90%	0.895	84%	0.839	S	S	*	*				-173.3	116.9	128.4	-101.3	164.6	0	0	0	110.7
40	S	25.8	Very low	27.8	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	84%	0.835	S	S	*	*			trans	-136.6	123.2	167	-69.4	0	0	0	0	108.5
41	P	28.9	Very low	27.6	Very low	127 Å²	127	137.2 Å²	137.2	83%	0.825	83%	0.83	S	S	*	*			trans	-89.2	124.6	173.8	32.9	-29.5	0	0	0	110.4
42	A	28.5	Very low	26.6	Very low	101 Å²	101	136.1 Å²	136.1	84%	0.835	83%	0.825	S	S	*	*			trans	-125.5	104.6	164.9	0	0	0	0	0	108.5	G44	A42-G44 PolarHBondContact O-N 2.63Å
43	V	25.1	Very low	26.6	Very low	142 Å²	142	137.1 Å²	137.1	86%	0.861	83%	0.826	S	S	*	*			trans	-86.9	98.4	169	179.3	0	0	0	0	107.5
44	G	26.6	Very low	26.5	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	83%	0.827	S	S	*	*			trans	-116.6	92.6	159.3	0	0	0	0	0	107.3	A42	A42-G44 PolarHBondContact O-N 2.63Å
45	S	25.2	Very low	26.2	Very low	114 Å²	114	132.9 Å²	132.9	80%	0.797	82%	0.823	S	S	*	*			trans	-79.1	130.1	-175.3	47.1	0	0	0	0	111.8
46	S	27.3	Very low	25.9	Very low	111 Å²	111	133 Å²	133	78%	0.776	82%	0.822	S	S	*	*			trans	-93.6	152.8	173.9	48.2	0	0	0	0	112.4
47	E	24.2	Very low	25.8	Very low	196 Å²	196	130.3 Å²	130.3	92%	0.916	81%	0.811	S	S	*	*			trans	-139.7	136.3	154.1	-67.8	-170.4	155.6	0	0	106.7
48	S	22.5	Very low	25.7	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	81%	0.813	S	S	*	*			cis	-151.7	147.2	0.5	50.6	0	0	0	0	111.3
49	E	28.4	Very low	25.6	Very low	193 Å²	193	129.9 Å²	129.9	90%	0.902	81%	0.805	S	S	*	*			trans	-111.9	161.6	157.2	-75.4	-170.1	149.2	0	0	108.8
50	R	24.2	Very low	25.6	Very low	217 Å²	217	130.1 Å²	130.1	82%	0.819	81%	0.806	S	S	*	*			trans	-140.6	116.3	153.6	-88.9	-162.4	-178.6	177.9	1.3	112.4
51	E	26.3	Very low	25.5	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.743	81%	0.807	S	S	*	*			trans	68.8	143.5	133.3	-64.4	172.5	-177.7	0	0	118.2
52	C	22	Very low	25.3	Very low	104 Å²	104	129 Å²	129	70%	0.703	81%	0.807	S	S	*	*			cis	-159.4	156.1	6.8	-141.8	0	0	0	0	113.8
53	S	25.7	Very low	26.5	Very low	119 Å²	119	129.1 Å²	129.1	83%	0.832	80%	0.8	S	S	*	*			trans	60	141.5	154.3	63.3	0	0	0	0	120.5
54	G	25.3	Very low	26.4	Very low	83 Å²	83	129.8 Å²	129.8	86%	0.856	80%	0.798	S	S	*	*			cis	148.8	150.3	-6.2	0	0	0	0	0	112.3
55	G	24.3	Very low	26.2	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	80%	0.801	S	S	*	*			trans	134.6	60.4	157	0	0	0	0	0	123.1
56	V	25.6	Very low	26.9	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	80%	0.796	S	S	*	*			trans	44	142.4	136.4	-94.2	0	0	0	0	126.9
57	D	25.3	Very low	26.8	Very low	130 Å²	130	133.8 Å²	133.8	70%	0.695	79%	0.793	S	S	*	*			trans	75.3	146.4	138.7	-67.7	-14.6	0	0	0	122.6
58	M	25.2	Very low	26.8	Very low	166 Å²	166	132.6 Å²	132.6	82%	0.818	79%	0.788	S	S	*	*			cis	-162.9	165.1	-11.8	-125.1	-157.1	-139.8	0	0	113.5
59	A	25.5	Very low	26.9	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	78%	0.78	S	S	*	*			trans	67.2	108.1	143.5	0	0	0	0	0	125.2
60	L	25.1	Very low	26.7	Very low	176 Å²	176	130.2 Å²	130.2	92%	0.921	78%	0.775	S	S	*	*				23.8	127.4	127.1	-64.3	166.1	0	0	0	123
61	A	23.5	Very low	26.8	Very low	102 Å²	102	124.2 Å²	124.2	84%	0.843	77%	0.772	S	S	*	*				162	151.1	111.4	0	0	0	0	0	114.5
62	S	25.7	Very low	26.8	Very low	118 Å²	118	122.4 Å²	122.4	83%	0.825	78%	0.777	S	S	*	*			trans	-109.3	-170.8	175.6	-34.7	0	0	0	0	110.8
63	P	53.8	Low	27	Very low	105 Å²	105	123 Å²	123	68%	0.682	78%	0.782	S	S	*	*			cis	-134	-176.4	-14.6	39	-20	0	0	0	114.1
64	D	23.3	Very low	27.1	Very low	155 Å²	155	122.4 Å²	122.4	83%	0.829	78%	0.784	S	S	*	*				164.6	163.2	121.2	-94.6	-28.5	0	0	0	116.3
65	L	21.6	Very low	27.2	Very low	160 Å²	160	124 Å²	124	84%	0.838	78%	0.782	S	S	*	*			trans	-88	-167.4	-174.3	-67.9	155.9	0	0	0	112.7
66	P	39.4	Very low	27.3	Very low	107 Å²	107	126.5 Å²	126.5	70%	0.695	79%	0.789	S	S	*	*			cis	-143.1	173.9	-2.9	32.7	-8.2	0	0	0	118.8
67	V	25.1	Very low	27.4	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.715	79%	0.791	S	S	*	*				92.1	125.6	129.9	139.5	0	0	0	0	125.6
68	Q	24.5	Very low	27.4	Very low	172 Å²	172	126.4 Å²	126.4	80%	0.804	80%	0.799	S	S	*	*			trans	75.8	148.1	147.5	-76.1	177.1	10.7	0	0	121.9
69	V	24.4	Very low	27.6	Very low	109 Å²	109	124.2 Å²	124.2	66%	0.661	79%	0.794	S	S	*	*			cis	-164.6	144.5	17.7	105.9	0	0	0	0	113.4
70	L	25.2	Very low	27.8	Very low	150 Å²	150	126.1 Å²	126.1	79%	0.785	80%	0.797	S	S	*	*			trans	43.4	123.9	149	-59.5	165.4	0	0	0	125.8
71	A	25.5	Very low	28	Very low	91 Å²	91	124 Å²	124	75%	0.752	80%	0.797	S	S	*	*				50.9	149	117.2	0	0	0	0	0	121.5
72	S	26.2	Very low	28.1	Very low	122 Å²	122	123.1 Å²	123.1	85%	0.853	80%	0.799	S	S	*	*			cis	-162.5	169.4	35.4	48.5	0	0	0	0	114.5
73	S	26.6	Very low	28.1	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	80%	0.803	S	S	*	*			trans	-91	156.5	-178.5	54.2	0	0	0	0	114.8
74	A	27.7	Very low	26.7	Very low	107 Å²	107	120.9 Å²	120.9	88%	0.884	81%	0.813	S	S	*	*			trans	-157.7	145.5	138	0	0	0	0	0	112.6
75	S	27.4	Very low	26.9	Very low	116 Å²	116	119 Å²	119	81%	0.811	81%	0.812	S	S	*	*			trans	-118.3	164.5	179.2	54.2	0	0	0	0	111.1
76	S	26.6	Very low	27.1	Very low	123 Å²	123	116.2 Å²	116.2	86%	0.86	81%	0.806	S	S	*	*			trans	-169.2	157	142.6	38.6	0	0	0	0	112.8
77	T	27.6	Very low	26.5	Very low	136 Å²	136	116.1 Å²	116.1	83%	0.834	81%	0.808	S	S	*	*			trans	-118.3	161.5	-170.2	45.3	0	0	0	0	111.6
78	S	26.4	Very low	26.6	Very low	121 Å²	121	116.8 Å²	116.8	85%	0.846	81%	0.812	S	S	*	*			trans	-179.5	178.9	140.6	42.1	0	0	0	0	111.7
79	T	28.6	Very low	26.7	Very low	119 Å²	119	113.7 Å²	113.7	73%	0.73	81%	0.809	S	S	*	*			trans	-137	158.9	-139.6	44.2	0	0	0	0	115.9
80	T	29.6	Very low	27.1	Very low	125 Å²	125	114 Å²	114	77%	0.767	82%	0.816	S	S	*	*			trans	58.6	122.2	147	51.5	0	0	0	0	121.4
81	S	29.7	Very low	27.6	Very low	131 Å²	131	112.9 Å²	112.9	92%	0.916	82%	0.818	S	S	*	*				177.7	166	100.6	43.8	0	0	0	0	110.5
82	G	26.2	Very low	27.7	Very low	85 Å²	85	111.7 Å²	111.7	88%	0.876	82%	0.815	S	S	*	*			trans	-122.5	-177.7	-165.9	0	0	0	0	0	115.9
83	G	24.4	Very low	27.9	Very low	89 Å²	89	112.3 Å²	112.3	92%	0.918	82%	0.819	S	S	*	*			trans	139.6	133.5	164.6	0	0	0	0	0	115.1
84	G	24.3	Very low	27.9	Very low	86 Å²	86	110.9 Å²	110.9	89%	0.887	82%	0.823	S	S	*	*			trans	129.8	125.9	165.8	0	0	0	0	0	115
85	S	27.4	Very low	28	Very low	116 Å²	116	110.2 Å²	110.2	81%	0.811	82%	0.817	S	S	*	*			trans	-121.7	-179.9	-178.1	55.7	0	0	0	0	112.1
86	S	27.4	Very low	28	Very low	102 Å²	102	111.6 Å²	111.6	71%	0.713	82%	0.821	S	S	*	*			trans	94.9	98	160.9	77.3	0	0	0	0	120.2
87	S	26.8	Very low	28.3	Very low	105 Å²	105	111 Å²	111	73%	0.734	82%	0.816	S	S	*	*				68.1	136.7	108.9	80.9	0	0	0	0	124.2
88	V	26.8	Very low	28.8	Very low	132 Å²	132	110.7 Å²	110.7	80%	0.8	82%	0.817	S	S	*	*			trans	96.7	143.6	145.3	-177.7	0	0	0	0	120.5
89	S	25.8	Very low	29.5	Very low	106 Å²	106	112.7 Å²	112.7	74%	0.741	82%	0.817	S	S	*	*			trans	83.3	107.7	157	44.4	0	0	0	0	121.4
90	S	34	Very low	29.5	Very low	115 Å²	115	113.9 Å²	113.9	80%	0.804	82%	0.818	S	S	*	*			trans	-67.1	162.2	142.6	-42.9	0	0	0	0	110.9
91	P	35.1	Very low	29.8	Very low	127 Å²	127	111.2 Å²	111.2	83%	0.825	82%	0.816	S	S	*	*				-143.3	141	120.5	35.6	-22	0	0	0	116.2
92	G	26.5	Very low	30	Very low	67 Å²	67	110.8 Å²	110.8	69%	0.691	81%	0.813	S	S	*	*				57	104.4	121.5	0	0	0	0	0	122.3
93	S	31.1	Very low	30.5	Very low	134 Å²	134	110.6 Å²	110.6	94%	0.937	80%	0.798	S	S	*	*				54.1	126.4	118.1	-48.8	0	0	0	0	122.2
94	G	26.1	Very low	31.3	Very low	86 Å²	86	109.1 Å²	109.1	89%	0.887	78%	0.783	S	S	*	*			trans	170.5	113.1	157.9	0	0	0	0	0	113.6
95	A	29.8	Very low	32.5	Very low	93 Å²	93	110 Å²	110	77%	0.769	77%	0.771	S	S	*	*			trans	-98.2	149.5	178.9	0	0	0	0	0	112.4
96	T	27.9	Very low	33.6	Very low	145 Å²	145	109.4 Å²	109.4	89%	0.89	76%	0.762	S	S	*	*				172.9	147.3	122.1	30.5	0	0	0	0	112.2
97	S	33.9	Very low	35.1	Very low	110 Å²	110	105.9 Å²	105.9	77%	0.769	74%	0.742	S	S	*	*			trans	-80	169.7	-178.3	-33.2	0	0	0	0	112.3
98	P	37.1	Very low	36.8	Very low	130 Å²	130	103.2 Å²	103.2	84%	0.844	73%	0.727	S	S	*	*				-138.7	174.3	73.6	34.4	-15.9	0	0	0	115.8
99	I	40.5	Very low	39.2	Very low	164 Å²	164	100.3 Å²	100.3	84%	0.841	70%	0.703	S	S	*	*			trans	-76.9	139.8	-173.7	-62.9	152.9	0	0	0	110.8
100	D	29.6	Very low	41.8	Very low	143 Å²	143	104.9 Å²	104.9	77%	0.765	70%	0.704	S	S	*	*			trans	-131.2	134.7	152.7	-159.4	0.3	0	0	0	111	S102	D100-S102 PolarHBondContact O-N 3.43Å
101	G	36.1	Very low	44.2	Very low	70 Å²	70	104 Å²	104	72%	0.722	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	61.2	-152.4	0	0	0	0	0	115.5
102	S	34.1	Very low	46.8	Very low	121 Å²	121	98 Å²	98	85%	0.846	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.5	4.8	167.2	72.4	0	0	0	0	116.1	D100	D100-S102 PolarHBondContact O-N 3.43Å
103	S	36.3	Very low	49.8	Very low	81 Å²	81	95.8 Å²	95.8	57%	0.566	62%	0.62	S	S	*	*			trans	-103.7	-10.4	-167.2	56.6	0	0	0	0	116	V105 V106	S103-V105 PolarHBondContact O-N 2.95Å; S103-V106 PolarHBondContact O-N 3.34Å
104	G	40.8	Very low	52.5	Low	59 Å²	59	93.7 Å²	93.7	61%	0.608	60%	0.595	S	S	*	*	H	α-helix	trans	-61	-33.4	-164.8	0	0	0	0	0	116.3	G107 A108	G104-G107 PolarHBondContact O-N 3.03Å; G104-A108 PolarHBondContact O-N 3.45Å
105	V	49	Very low	55.7	Low	105 Å²	105	89.6 Å²	89.6	64%	0.636	55%	0.553	S	S	*	*	H	α-helix	trans	-67.8	-39.5	-178.2	-178.7	0	0	0	0	111.5	S103 G107 A108 F109	S103-V105 PolarHBondContact O-N 2.95Å; V105-G107 VanDerWaalsContact C-N 3.32Å; V105-G107 PolarHBondContact O-N 3.39Å; V105-A108 PolarHBondContact O-N 3Å; V105-F109 HydrophobicContact CG1-CD2 4.01Å; V105-F109 HydrophobicContact CG1-CE2 3.7Å; V105-F109 VanDerWaalsContact O-CD2 3.24Å; V105-F109 WeakPolarHBondContact O-CD2 3.17Å; V105-F109 PolarHBondContact O-N 3.04Å
106	V	51.2	Low	58.7	Low	102 Å²	102	85.2 Å²	85.2	62%	0.618	52%	0.517	S	S	*	.	H	α-helix	trans	-70.5	-31.4	-178.6	-174.3	0	0	0	0	111.4	S103 R110	S103-V106 PolarHBondContact O-N 3.34Å; V106-R110 WeakPolarHBondContact O-CB 3.41Å; V106-R110 PolarHBondContact O-N 3.04Å
107	G	59	Low	61.7	Low	28 Å²	28	83.7 Å²	83.7	29%	0.289	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-51.3	173.7	0	0	0	0	0	112.6	G104 V105 F109 R110 E111	G104-G107 PolarHBondContact O-N 3.03Å; V105-G107 VanDerWaalsContact C-N 3.32Å; V105-G107 PolarHBondContact O-N 3.39Å; G107-F109 PolarHBondContact O-N 3.06Å; G107-R110 WeakPolarHBondContact O-CB 3.32Å; G107-R110 PolarHBondContact O-N 3.35Å; G107-R110 VanDerWaalsContact O-N 3.08Å; G107-E111 PolarHBondContact O-N 3.25Å
108	A	63.2	Low	64.5	Low	50 Å²	50	82.7 Å²	82.7	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-58.8	-42.8	-177.8	0	0	0	0	0	113.1	G104 V105 E111 L112	G104-A108 PolarHBondContact O-N 3.45Å; V105-A108 PolarHBondContact O-N 3Å; A108-E111 PolarHBondContact O-N 3.45Å; A108-L112 PolarHBondContact O-N 3.04Å; A108-L112 VanDerWaalsContact O-N 3.07Å
109	F	75.3	Confident	67.1	Low	71 Å²	71	77.8 Å²	77.8	31%	0.311	45%	0.453	S	S	.	.	H	α-helix	trans	-61.8	-45.9	173.7	-78.2	-66.2	0	0	0	112.1	V105 G107 E111 L112 F113 N132 A135	V105-F109 HydrophobicContact CG1-CD2 4.01Å; V105-F109 HydrophobicContact CG1-CE2 3.7Å; V105-F109 VanDerWaalsContact O-CD2 3.24Å; V105-F109 WeakPolarHBondContact O-CD2 3.17Å; V105-F109 PolarHBondContact O-N 3.04Å; G107-F109 PolarHBondContact O-N 3.06Å; F109-E111 VanDerWaalsContact C-N 3.3Å; F109-E111 PolarHBondContact O-N 2.84Å; F109-L112 WeakPolarHBondContact O-CB 3.45Å; F109-L112 PolarHBondContact O-N 3.33Å; F109-F113 HydrophobicContact CB-CE2 4.44Å; F109-F113 WeakPolarHBondContact O-CD2 3.24Å; F109-F113 PolarHBondContact O-N 3.36Å; F109-N132 HydrophobicContact CE1-CB 3.81Å; F109-N132 HydrophobicContact CZ-CB 4.33Å; F109-A135 HydrophobicContact CD1-CB 3.86Å; F109-A135 HydrophobicContact CE1-CB 3.33Å; F109-A135 HydrophobicContact CZ-CB 4.21Å
110	R	80.4	Confident	69.6	Low	202 Å²	202	73 Å²	73	76%	0.762	43%	0.429	S	S	*	.	H	α-helix	trans	-59.4	-41.2	178.9	-178	178.1	176.5	170.8	-0.9	112	V106 G107 E114	V106-R110 WeakPolarHBondContact O-CB 3.41Å; V106-R110 PolarHBondContact O-N 3.04Å; G107-R110 WeakPolarHBondContact O-CB 3.32Å; G107-R110 PolarHBondContact O-N 3.35Å; G107-R110 VanDerWaalsContact O-N 3.08Å; R110-E114 WeakPolarHBondContact O-CB 3.49Å; R110-E114 PolarHBondContact O-N 3.39Å
111	E	85.3	Confident	72.7	Confident	95 Å²	95	67.6 Å²	67.6	44%	0.444	40%	0.402	S	S	.	.	H	α-helix	trans	-65.3	-39.3	176.1	-71.4	178.3	-153.7	0	0	112.5	G107 A108 F109 E114 A115 R123 L127	G107-E111 PolarHBondContact O-N 3.25Å; A108-E111 PolarHBondContact O-N 3.45Å; F109-E111 VanDerWaalsContact C-N 3.3Å; F109-E111 PolarHBondContact O-N 2.84Å; E111-E114 PolarHBondContact O-N 3.31Å; E111-A115 WeakPolarHBondContact O-CB 3.24Å; E111-A115 PolarHBondContact O-N 2.83Å; E111-R123 PolarHBondContact O-NH2 3.48Å; E111-L127 HydrophobicContact CB-CD1 3.8Å
112	L	89.4	Confident	75.3	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-62.4	-50.6	174.6	177.2	61.9	0	0	0	111.5	A108 F109 E114 A115 C116 V124 L127 V128 N132 P145	A108-L112 PolarHBondContact O-N 3.04Å; A108-L112 VanDerWaalsContact O-N 3.07Å; F109-L112 WeakPolarHBondContact O-CB 3.45Å; F109-L112 PolarHBondContact O-N 3.33Å; L112-E114 VanDerWaalsContact C-N 3.3Å; L112-E114 PolarHBondContact O-N 2.93Å; L112-A115 WeakPolarHBondContact O-CB 3.39Å; L112-A115 PolarHBondContact O-N 3.02Å; L112-A115 VanDerWaalsContact O-N 3.16Å; L112-C116 PolarHBondContact O-N 3.49Å; L112-C116 PolarHBondContact O-SG 3.32Å; L112-C116 VanDerWaalsContact O-SG 3.33Å; L112-V124 HydrophobicContact CD1-CG1 4.21Å; L112-L127 HydrophobicContact CB-CB 4.3Å; L112-L127 HydrophobicContact CB-CD1 4.4Å; L112-L127 HydrophobicContact CD1-CB 3.99Å; L112-V128 HydrophobicContact CD1-CB 4.19Å; L112-N132 WeakPolarHBondContact CD2-OD1 3.06Å; L112-P145 HydrophobicContact CD2-CG 4.08Å; L112-P145 HydrophobicContact CG-CG 4.41Å
113	F	89.3	Confident	78	Confident	21 Å²	21	64.7 Å²	64.7	9%	0.092	36%	0.363	C	S	.	.	H	α-helix	trans	-61.3	-37.8	177.9	-75.5	-72.1	0	0	0	112.6	F109 C116 R117 D137 S143 P145 F148	F109-F113 HydrophobicContact CB-CE2 4.44Å; F109-F113 WeakPolarHBondContact O-CD2 3.24Å; F109-F113 PolarHBondContact O-N 3.36Å; F113-C116 PolarHBondContact O-N 3.39Å; F113-R117 WeakPolarHBondContact O-CB 3.47Å; F113-R117 PolarHBondContact O-N 3.46Å; F113-D137 HydrophobicContact CD1-CB 4.49Å; F113-D137 HydrophobicContact CD2-CB 4.4Å; F113-D137 HydrophobicContact CE1-CB 4.05Å; F113-D137 HydrophobicContact CE2-CB 4.02Å; F113-D137 HydrophobicContact CZ-CB 3.83Å; F113-S143 WeakPolarHBondContact CE1-O 3.4Å; F113-P145 HydrophobicContact CD1-CG 4.44Å; F113-P145 HydrophobicContact CE1-CG 3.95Å; F113-P145 HydrophobicContact CZ-CG 4.22Å; F113-F148 AromaticContact CD1-CD2 3.53Å; F113-F148 HydrophobicContact CD1-CD2 3.53Å; F113-F148 AromaticContact CD1-CE2 3.59Å; F113-F148 HydrophobicContact CD1-CE2 3.59Å; F113-F148 HydrophobicContact CD1-CG 4.13Å; F113-F148 HydrophobicContact CD1-CZ 4.24Å; F113-F148 AromaticContact CE1-CD2 3.9Å; F113-F148 HydrophobicContact CE1-CD2 3.9Å; F113-F148 AromaticContact CE1-CE2 3.85Å; F113-F148 HydrophobicContact CE1-CE2 3.85Å
114	E	89.2	Confident	80.7	Confident	90 Å²	90	60.9 Å²	60.9	42%	0.421	34%	0.336	S	S	.	.	H	α-helix	trans	-67.3	-41.3	174.1	-173	-169.1	-121.7	0	0	111.9	R110 E111 L112 C116 R117 N118 R123	R110-E114 WeakPolarHBondContact O-CB 3.49Å; R110-E114 PolarHBondContact O-N 3.39Å; E111-E114 PolarHBondContact O-N 3.31Å; L112-E114 VanDerWaalsContact C-N 3.3Å; L112-E114 PolarHBondContact O-N 2.93Å; E114-C116 VanDerWaalsContact C-N 3.33Å; E114-C116 PolarHBondContact O-N 2.77Å; E114-R117 PolarHBondContact O-N 3.39Å; E114-N118 WeakPolarHBondContact O-CB 3.28Å; E114-N118 VanDerWaalsContact O-CG 3.3Å; E114-N118 PolarHBondContact O-N 2.93Å; E114-R123 IonicContact OE2-CZ 3.81Å; E114-R123 IonicContact OE2-NH1 2.81Å; E114-R123 PolarHBondContact OE2-NH1 3.21Å; E114-R123 IonicContact OE2-NH2 2.72Å; E114-R123 PolarHBondContact OE2-NH2 2.94Å
115	A	92.4	Very high	83.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-43.8	174.2	0	0	0	0	0	111.3	E111 L112 N118 G119 D120 R123 V124	E111-A115 WeakPolarHBondContact O-CB 3.24Å; E111-A115 PolarHBondContact O-N 2.83Å; L112-A115 WeakPolarHBondContact O-CB 3.39Å; L112-A115 PolarHBondContact O-N 3.02Å; L112-A115 VanDerWaalsContact O-N 3.16Å; A115-N118 PolarHBondContact O-N 3.36Å; A115-G119 PolarHBondContact O-N 3.2Å; A115-D120 HydrophobicContact CB-CB 4.47Å; A115-D120 PolarHBondContact O-N 3.11Å; A115-D120 VanDerWaalsContact O-N 3.09Å; A115-R123 HydrophobicContact CB-CB 4.1Å; A115-R123 HydrophobicContact CB-CG 4.06Å; A115-R123 VanDerWaalsContact N-NH2 3.13Å; A115-V124 HydrophobicContact CB-CG2 3.6Å
116	C	92.7	Very high	85.1	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-36.8	175.9	-66.9	0	0	0	0	113.5	L112 F113 E114 F148 A149 R154 V157	L112-C116 PolarHBondContact O-N 3.49Å; L112-C116 PolarHBondContact O-SG 3.32Å; L112-C116 VanDerWaalsContact O-SG 3.33Å; F113-C116 PolarHBondContact O-N 3.39Å; E114-C116 VanDerWaalsContact C-N 3.33Å; E114-C116 PolarHBondContact O-N 2.77Å; C116-F148 HydrophobicContact CB-CB 4.4Å; C116-A149 HydrophobicContact CB-CB 4.28Å; C116-R154 WeakPolarHBondContact O-CG 3.39Å; C116-V157 HydrophobicContact CB-CG1 4.32Å
117	R	91	Very high	86.9	Confident	114 Å²	114	65.3 Å²	65.3	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-43.4	172.5	169.8	179.7	-72.7	168.7	-2.4	112.2	F113 E114 F152 R154	F113-R117 WeakPolarHBondContact O-CB 3.47Å; F113-R117 PolarHBondContact O-N 3.46Å; E114-R117 PolarHBondContact O-N 3.39Å; R117-F152 HydrophobicContact CB-CD2 4.01Å; R117-F152 HydrophobicContact CB-CE2 4.15Å; R117-F152 HydrophobicContact CG-CD1 4.22Å; R117-F152 HydrophobicContact CG-CD2 3.79Å; R117-F152 HydrophobicContact CG-CE1 4.13Å; R117-F152 HydrophobicContact CG-CE2 3.72Å; R117-F152 HydrophobicContact CG-CG 4.07Å; R117-F152 HydrophobicContact CG-CZ 3.9Å; R117-R154 PolarHBondContact O-NE 3.32Å; R117-R154 PolarHBondContact O-NH2 2.94Å; R117-R154 VanDerWaalsContact O-NH2 3.1Å
118	N	92.4	Very high	88.4	Confident	89 Å²	89	64.9 Å²	64.9	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-81	-20.9	-173.6	-68	-7.4	0	0	0	112.9	E114 A115	E114-N118 WeakPolarHBondContact O-CB 3.28Å; E114-N118 VanDerWaalsContact O-CG 3.3Å; E114-N118 PolarHBondContact O-N 2.93Å; A115-N118 PolarHBondContact O-N 3.36Å
119	G	91.8	Very high	89.4	Confident	26 Å²	26	66 Å²	66	27%	0.268	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	19.1	-177.1	0	0	0	0	0	113.8	A115 V121	A115-G119 PolarHBondContact O-N 3.2Å; G119-V121 VanDerWaalsContact C-N 3.33Å; G119-V121 PolarHBondContact O-N 3.4Å
120	D	93.5	Very high	89.7	Confident	63 Å²	63	67.8 Å²	67.8	34%	0.337	33%	0.33	S	S	.	.			trans	-78.8	81.4	-179.5	-175.3	-11.6	0	0	0	110.5	A115 S122 R123 V124	A115-D120 HydrophobicContact CB-CB 4.47Å; A115-D120 PolarHBondContact O-N 3.11Å; A115-D120 VanDerWaalsContact O-N 3.09Å; D120-S122 PolarHBondContact O-N 3.45Å; D120-S122 PolarHBondContact OD1-N 3.33Å; D120-R123 HydrophobicContact CB-CB 4.05Å; D120-R123 PolarHBondContact O-N 3.44Å; D120-R123 VanDerWaalsContact O-N 3.14Å; D120-R123 WeakPolarHBondContact OD1-CB 3.28Å; D120-R123 PolarHBondContact OD1-N 2.88Å; D120-R123 WeakPolarHBondContact OD2-CB 3.47Å; D120-R123 IonicContact OD2-NE 2.93Å; D120-V124 WeakPolarHBondContact O-CG2 3.41Å; D120-V124 PolarHBondContact O-N 3.36Å
121	V	93.2	Very high	89.7	Confident	30 Å²	30	64.3 Å²	64.3	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-54	-37.3	-179.8	-176.6	0	0	0	0	111.7	G119 K125 D156 V157	G119-V121 VanDerWaalsContact C-N 3.33Å; G119-V121 PolarHBondContact O-N 3.4Å; V121-K125 HydrophobicContact CG1-CD 3.99Å; V121-K125 HydrophobicContact CG1-CG 4.41Å; V121-K125 VanDerWaalsContact O-CB 3.29Å; V121-K125 WeakPolarHBondContact O-CB 3.5Å; V121-K125 VanDerWaalsContact O-CG 3.29Å; V121-K125 WeakPolarHBondContact O-CG 3.12Å; V121-K125 PolarHBondContact O-N 3.22Å; V121-D156 HydrophobicContact CG2-CB 3.61Å; V121-V157 HydrophobicContact CG2-CG2 3.75Å
122	S	92.1	Very high	89.8	Confident	82 Å²	82	60.7 Å²	60.7	57%	0.573	32%	0.315	S	S	*	.	H	α-helix	trans	-72.5	-33	-178.9	-64	0	0	0	0	112.9	D120 R126	D120-S122 PolarHBondContact O-N 3.45Å; D120-S122 PolarHBondContact OD1-N 3.33Å; S122-R126 WeakPolarHBondContact O-CG 3.47Å; S122-R126 PolarHBondContact O-NE 3.41Å
123	R	91.3	Very high	89.9	Confident	49 Å²	49	60.7 Å²	60.7	19%	0.185	32%	0.315	C	S	.	.	H	α-helix	trans	-77.2	-40.2	171.3	-169.7	166.5	73.6	147.6	5.8	111.3	E111 E114 A115 D120 K125 R126 L127	E111-R123 PolarHBondContact O-NH2 3.48Å; E114-R123 IonicContact OE2-CZ 3.81Å; E114-R123 IonicContact OE2-NH1 2.81Å; E114-R123 PolarHBondContact OE2-NH1 3.21Å; E114-R123 IonicContact OE2-NH2 2.72Å; E114-R123 PolarHBondContact OE2-NH2 2.94Å; A115-R123 HydrophobicContact CB-CB 4.1Å; A115-R123 HydrophobicContact CB-CG 4.06Å; A115-R123 VanDerWaalsContact N-NH2 3.13Å; D120-R123 HydrophobicContact CB-CB 4.05Å; D120-R123 PolarHBondContact O-N 3.44Å; D120-R123 VanDerWaalsContact O-N 3.14Å; D120-R123 WeakPolarHBondContact OD1-CB 3.28Å; D120-R123 PolarHBondContact OD1-N 2.88Å; D120-R123 WeakPolarHBondContact OD2-CB 3.47Å; D120-R123 IonicContact OD2-NE 2.93Å; R123-K125 PolarHBondContact O-N 2.85Å; R123-R126 PolarHBondContact O-N 2.88Å; R123-L127 HydrophobicContact CG-CD1 3.72Å; R123-L127 HydrophobicContact CG-CG 4.29Å; R123-L127 WeakPolarHBondContact O-CB 3.48Å; R123-L127 WeakPolarHBondContact O-CG 3.46Å; R123-L127 PolarHBondContact O-N 3.01Å; R123-L127 VanDerWaalsContact O-N 3.08Å
124	V	91.6	Very high	90.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.7	-50.5	172.7	177.1	0	0	0	0	110.6	L112 A115 D120 R126 L127 V128 V157 L161	L112-V124 HydrophobicContact CD1-CG1 4.21Å; A115-V124 HydrophobicContact CB-CG2 3.6Å; D120-V124 WeakPolarHBondContact O-CG2 3.41Å; D120-V124 PolarHBondContact O-N 3.36Å; V124-R126 PolarHBondContact O-N 3.44Å; V124-L127 PolarHBondContact O-N 2.8Å; V124-V128 HydrophobicContact CG1-CB 4.21Å; V124-V128 HydrophobicContact CG1-CG1 4.14Å; V124-V128 WeakPolarHBondContact O-CB 3.33Å; V124-V128 VanDerWaalsContact O-CG1 3.29Å; V124-V128 WeakPolarHBondContact O-CG1 3.28Å; V124-V128 PolarHBondContact O-N 3.24Å; V124-V157 HydrophobicContact CG1-CG1 4.26Å; V124-V157 HydrophobicContact CG2-CG1 3.96Å; V124-V157 HydrophobicContact CG2-CG2 4.31Å; V124-L161 HydrophobicContact CG1-CD2 4.1Å
125	K	92.1	Very high	90.1	Very high	122 Å²	122	59.2 Å²	59.2	53%	0.53	31%	0.314	S	S	.	.	H	α-helix	trans	-55.4	-23.2	177.9	-83.4	174.9	178.5	-179.2	0	115.3	V121 R123 H160	V121-K125 HydrophobicContact CG1-CD 3.99Å; V121-K125 HydrophobicContact CG1-CG 4.41Å; V121-K125 VanDerWaalsContact O-CB 3.29Å; V121-K125 WeakPolarHBondContact O-CB 3.5Å; V121-K125 VanDerWaalsContact O-CG 3.29Å; V121-K125 WeakPolarHBondContact O-CG 3.12Å; V121-K125 PolarHBondContact O-N 3.22Å; R123-K125 PolarHBondContact O-N 2.85Å; K125-H160 VanDerWaalsContact CG-CD2 3.48Å; K125-H160 WeakPolarHBondContact CG-CD2 3.45Å; K125-H160 WeakPolarHBondContact CG-NE2 3.48Å
126	R	90.8	Very high	90	Very high	194 Å²	194	64.1 Å²	64.1	73%	0.732	34%	0.335	S	S	*	.	H	α-helix	trans	-95.3	-23.3	177.4	-71	-176.4	-65.2	165.1	3.7	113.6	S122 R123 V124	S122-R126 WeakPolarHBondContact O-CG 3.47Å; S122-R126 PolarHBondContact O-NE 3.41Å; R123-R126 PolarHBondContact O-N 2.88Å; V124-R126 PolarHBondContact O-N 3.44Å
127	L	88.2	Confident	89.6	Confident	44 Å²	44	65.1 Å²	65.1	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-101.3	-22.4	-176.2	-67.3	-179.4	0	0	0	112.9	E111 L112 R123 V124 N132	E111-L127 HydrophobicContact CB-CD1 3.8Å; L112-L127 HydrophobicContact CB-CB 4.3Å; L112-L127 HydrophobicContact CB-CD1 4.4Å; L112-L127 HydrophobicContact CD1-CB 3.99Å; R123-L127 HydrophobicContact CG-CD1 3.72Å; R123-L127 HydrophobicContact CG-CG 4.29Å; R123-L127 WeakPolarHBondContact O-CB 3.48Å; R123-L127 WeakPolarHBondContact O-CG 3.46Å; R123-L127 PolarHBondContact O-N 3.01Å; R123-L127 VanDerWaalsContact O-N 3.08Å; V124-L127 PolarHBondContact O-N 2.8Å; L127-N132 PolarHBondContact O-ND2 3.14Å
128	V	90.9	Very high	89.2	Confident	19 Å²	19	68.3 Å²	68.3	12%	0.115	36%	0.362	C	S	.	.			trans	-87.2	136	-177.9	77.9	0	0	0	0	112.1	L112 V124 N132 V133 L161 T164	L112-V128 HydrophobicContact CD1-CB 4.19Å; V124-V128 HydrophobicContact CG1-CB 4.21Å; V124-V128 HydrophobicContact CG1-CG1 4.14Å; V124-V128 WeakPolarHBondContact O-CB 3.33Å; V124-V128 VanDerWaalsContact O-CG1 3.29Å; V124-V128 WeakPolarHBondContact O-CG1 3.28Å; V124-V128 PolarHBondContact O-N 3.24Å; V128-N132 VanDerWaalsContact CA-OD1 3.3Å; V128-N132 WeakPolarHBondContact CA-OD1 3.37Å; V128-V133 HydrophobicContact CG2-CB 3.74Å; V128-V133 HydrophobicContact CG2-CG2 3.93Å; V128-L161 HydrophobicContact CG2-CD2 3.92Å; V128-T164 HydrophobicContact CG1-CG2 4.27Å; V128-T164 HydrophobicContact CG2-CG2 4.34Å
129	D	85.4	Confident	88.1	Confident	74 Å²	74	69.1 Å²	69.1	40%	0.396	38%	0.382	S	S	.	.			trans	-139.9	174.3	173.2	65.8	44.8	0	0	0	110.9	V131 N132 V133	D129-V131 PolarHBondContact O-N 3.04Å; D129-V131 VanDerWaalsContact O-N 3.16Å; D129-V131 VanDerWaalsContact OD1-CA 3.31Å; D129-V131 WeakPolarHBondContact OD1-CA 3.25Å; D129-V131 VanDerWaalsContact OD1-CB 3.27Å; D129-V131 WeakPolarHBondContact OD1-CB 3.4Å; D129-V131 PolarHBondContact OD1-N 2.91Å; D129-N132 PolarHBondContact N-ND2 3.45Å; D129-N132 PolarHBondContact N-OD1 3.19Å; D129-N132 PolarHBondContact O-N 3.4Å; D129-N132 WeakPolarHBondContact OD1-CB 3.34Å; D129-N132 VanDerWaalsContact OD1-CG 3.31Å; D129-N132 PolarHBondContact OD1-N 2.79Å; D129-N132 PolarHBondContact OD1-ND2 3.19Å; D129-N132 PolarHBondContact OD2-ND2 3.5Å; D129-V133 WeakPolarHBondContact O-CB 3.22Å; D129-V133 PolarHBondContact O-N 3.06Å
130	S	81	Confident	87.5	Confident	108 Å²	108	69.9 Å²	69.9	76%	0.755	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-13	-178.5	56	0	0	0	0	114.8
131	V	79.8	Confident	87.1	Confident	129 Å²	129	72 Å²	72	78%	0.782	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-38.7	177.3	-172.9	0	0	0	0	110.4	D129	D129-V131 PolarHBondContact O-N 3.04Å; D129-V131 VanDerWaalsContact O-N 3.16Å; D129-V131 VanDerWaalsContact OD1-CA 3.31Å; D129-V131 WeakPolarHBondContact OD1-CA 3.25Å; D129-V131 VanDerWaalsContact OD1-CB 3.27Å; D129-V131 WeakPolarHBondContact OD1-CB 3.4Å; D129-V131 PolarHBondContact OD1-N 2.91Å
132	N	88.5	Confident	86.9	Confident	18 Å²	18	75.1 Å²	75.1	10%	0.096	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-16	-168.6	80.8	34.4	0	0	0	114.7	F109 L112 L127 V128 D129 N134 A135	F109-N132 HydrophobicContact CE1-CB 3.81Å; F109-N132 HydrophobicContact CZ-CB 4.33Å; L112-N132 WeakPolarHBondContact CD2-OD1 3.06Å; L127-N132 PolarHBondContact O-ND2 3.14Å; V128-N132 VanDerWaalsContact CA-OD1 3.3Å; V128-N132 WeakPolarHBondContact CA-OD1 3.37Å; D129-N132 PolarHBondContact N-ND2 3.45Å; D129-N132 PolarHBondContact N-OD1 3.19Å; D129-N132 PolarHBondContact O-N 3.4Å; D129-N132 WeakPolarHBondContact OD1-CB 3.34Å; D129-N132 VanDerWaalsContact OD1-CG 3.31Å; D129-N132 PolarHBondContact OD1-N 2.79Å; D129-N132 PolarHBondContact OD1-ND2 3.19Å; D129-N132 PolarHBondContact OD2-ND2 3.5Å; N132-N134 PolarHBondContact O-N 3.25Å; N132-A135 WeakPolarHBondContact O-CB 3.49Å; N132-A135 PolarHBondContact O-N 2.98Å
133	V	91.4	Very high	86.9	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.018	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.4	-179.4	64.8	0	0	0	0	114	V128 D129 L161 T164 A166	V128-V133 HydrophobicContact CG2-CB 3.74Å; V128-V133 HydrophobicContact CG2-CG2 3.93Å; D129-V133 WeakPolarHBondContact O-CB 3.22Å; D129-V133 PolarHBondContact O-N 3.06Å; V133-L161 HydrophobicContact CG2-CD2 4.14Å; V133-T164 HydrophobicContact CG2-CG2 4.4Å; V133-A166 HydrophobicContact CG2-CB 3.78Å
134	N	92.6	Very high	87.1	Confident	59 Å²	59	69.3 Å²	69.3	32%	0.316	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	12	178.8	-73.5	-54.2	0	0	0	114.1	N132 G165 A166 N167	N132-N134 PolarHBondContact O-N 3.25Å; N134-G165 PolarHBondContact ND2-O 3.31Å; N134-A166 WeakPolarHBondContact OD1-CA 3.4Å; N134-N167 PolarHBondContact OD1-N 3.49Å
135	A	89.8	Confident	87.2	Confident	20 Å²	20	69.3 Å²	69.3	17%	0.165	37%	0.371	C	S	.	.			trans	-59.5	151.3	176.7	0	0	0	0	0	111.4	F109 N132 T144 P145	F109-A135 HydrophobicContact CD1-CB 3.86Å; F109-A135 HydrophobicContact CE1-CB 3.33Å; F109-A135 HydrophobicContact CZ-CB 4.21Å; N132-A135 WeakPolarHBondContact O-CB 3.49Å; N132-A135 PolarHBondContact O-N 2.98Å; A135-T144 VanDerWaalsContact O-CA 3.3Å; A135-T144 WeakPolarHBondContact O-CA 3.38Å; A135-P145 WeakPolarHBondContact O-CD 3.5Å
136	K	89.2	Confident	87.4	Confident	103 Å²	103	63.5 Å²	63.5	45%	0.448	35%	0.345	S	S	.	.			trans	-107.4	140.7	179.9	-63.3	-168.4	177.1	-152.2	0	110.3	K142 T144 R171	K136-K142 HydrophobicContact CB-CB 3.96Å; K136-K142 HydrophobicContact CD-CB 3.91Å; K136-K142 WeakPolarHBondContact CD-O 3.45Å; K136-K142 HydrophobicContact CG-CB 4.48Å; K136-K142 WeakPolarHBondContact CG-O 3.22Å; K136-T144 HydrophobicContact CG-CG2 4.19Å; K136-R171 PolarHBondContact NZ-O 2.89Å
137	D	86	Confident	87.6	Confident	22 Å²	22	54.3 Å²	54.3	12%	0.118	31%	0.311	C	S	.	.			trans	-66.5	138.2	177.6	81.9	-39.2	0	0	0	111.8	F113 G140 K142 S143 F148	F113-D137 HydrophobicContact CD1-CB 4.49Å; F113-D137 HydrophobicContact CD2-CB 4.4Å; F113-D137 HydrophobicContact CE1-CB 4.05Å; F113-D137 HydrophobicContact CE2-CB 4.02Å; F113-D137 HydrophobicContact CZ-CB 3.83Å; D137-G140 WeakPolarHBondContact OD2-CA 3.39Å; D137-G140 PolarHBondContact OD2-N 3.08Å; D137-G140 VanDerWaalsContact OD2-N 3.17Å; D137-K142 WeakPolarHBondContact O-CA 3.43Å; D137-K142 WeakPolarHBondContact OD1-CA 3.48Å; D137-K142 PolarHBondContact OD1-N 3.07Å; D137-S143 PolarHBondContact N-O 2.83Å; D137-S143 PolarHBondContact OD1-N 2.62Å; D137-F148 HydrophobicContact CB-CE2 4.22Å; D137-F148 HydrophobicContact CB-CZ 4.42Å
138	M	80.8	Confident	87.9	Confident	180 Å²	180	53.8 Å²	53.8	89%	0.887	31%	0.307	S	S	*	.	S	Bend	trans	-90.6	-10.9	-175.8	-63.1	-179.4	71.3	0	0	113.5
139	A	70.8	Confident	88.1	Confident	107 Å²	107	52.9 Å²	52.9	88%	0.884	30%	0.301	S	S	*	.	S	Bend	trans	-112.4	-5.2	-173.4	0	0	0	0	0	113.9
140	G	77.6	Confident	88.6	Confident	42 Å²	42	49.3 Å²	49.3	43%	0.433	28%	0.282	S	S	.	.	S	Bend	trans	-125.2	-140.4	-178.8	0	0	0	0	0	111.8	D137 K142	D137-G140 WeakPolarHBondContact OD2-CA 3.39Å; D137-G140 PolarHBondContact OD2-N 3.08Å; D137-G140 VanDerWaalsContact OD2-N 3.17Å; G140-K142 PolarHBondContact O-N 3.32Å
141	R	85.1	Confident	89.2	Confident	106 Å²	106	44.5 Å²	44.5	40%	0.4	25%	0.249	S	C	.	.	S	Bend	trans	-87.7	20	-174.1	-58.8	-175	-60.7	94.7	6.1	112.8	S143 D172 D173	R141-S143 VanDerWaalsContact C-N 3.29Å; R141-S143 PolarHBondContact O-N 2.96Å; R141-D172 IonicContact CZ-OD1 3.95Å; R141-D172 IonicContact CZ-OD2 3.98Å; R141-D172 VanDerWaalsContact CZ-OD2 3.25Å; R141-D172 IonicContact NH1-OD1 2.99Å; R141-D172 PolarHBondContact NH1-OD1 2.99Å; R141-D172 IonicContact NH1-OD2 3.86Å; R141-D172 PolarHBondContact NH1-OD2 3.44Å; R141-D172 IonicContact NH2-OD2 2.82Å; R141-D172 PolarHBondContact NH2-OD2 3.48Å; R141-D172 WeakPolarHBondContact O-CB 3.5Å; R141-D173 WeakPolarHBondContact O-CB 3.32Å; R141-D173 PolarHBondContact O-N 3.39Å
142	K	89.7	Confident	89.9	Confident	97 Å²	97	42.4 Å²	42.4	42%	0.422	23%	0.23	S	C	.	.			trans	57.5	40.1	-170.7	-52.4	-163.1	-157.8	91.6	0	113	K136 D137 G140 D173	K136-K142 HydrophobicContact CB-CB 3.96Å; K136-K142 HydrophobicContact CD-CB 3.91Å; K136-K142 WeakPolarHBondContact CD-O 3.45Å; K136-K142 HydrophobicContact CG-CB 4.48Å; K136-K142 WeakPolarHBondContact CG-O 3.22Å; D137-K142 WeakPolarHBondContact O-CA 3.43Å; D137-K142 WeakPolarHBondContact OD1-CA 3.48Å; D137-K142 PolarHBondContact OD1-N 3.07Å; G140-K142 PolarHBondContact O-N 3.32Å; K142-D173 WeakPolarHBondContact CD-OD1 3.33Å; K142-D173 WeakPolarHBondContact CG-OD2 3.2Å; K142-D173 IonicContact NZ-OD1 3.41Å; K142-D173 PolarHBondContact NZ-OD1 2.83Å; K142-D173 IonicContact NZ-OD2 3.72Å; K142-D173 PolarHBondContact NZ-OD2 2.99Å
143	S	92.3	Very high	90.2	Very high	7 Å²	7	42.7 Å²	42.7	5%	0.049	24%	0.237	C	C	.	.			trans	-77.6	146.3	175.5	-63.1	0	0	0	0	110.7	F113 D137 R141 D172	F113-S143 WeakPolarHBondContact CE1-O 3.4Å; D137-S143 PolarHBondContact N-O 2.83Å; D137-S143 PolarHBondContact OD1-N 2.62Å; R141-S143 VanDerWaalsContact C-N 3.29Å; R141-S143 PolarHBondContact O-N 2.96Å; S143-D172 PolarHBondContact OG-OD2 2.92Å
144	T	94.6	Very high	90.5	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.006	25%	0.254	C	S	.	.			trans	-89.5	165	179.7	69.6	0	0	0	0	112.7	A135 K136 L146 H147 F148 A170	A135-T144 VanDerWaalsContact O-CA 3.3Å; A135-T144 WeakPolarHBondContact O-CA 3.38Å; K136-T144 HydrophobicContact CG-CG2 4.19Å; T144-L146 PolarHBondContact O-N 3.35Å; T144-L146 VanDerWaalsContact O-N 3.07Å; T144-H147 PolarHBondContact N-ND1 2.7Å; T144-H147 VanDerWaalsContact N-ND1 3.16Å; T144-H147 VanDerWaalsContact O-CB 3.32Å; T144-H147 WeakPolarHBondContact O-CB 3.43Å; T144-H147 PolarHBondContact O-N 3.02Å; T144-H147 PolarHBondContact OG1-ND1 3.1Å; T144-F148 PolarHBondContact O-N 3.15Å; T144-A170 HydrophobicContact CG2-CB 3.94Å
145	P	94.8	Very high	90.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-48.1	-37.7	174.2	-32.4	36.4	0	0	0	113.5	L112 F113 A135 F148 A149 L161	L112-P145 HydrophobicContact CD2-CG 4.08Å; L112-P145 HydrophobicContact CG-CG 4.41Å; F113-P145 HydrophobicContact CD1-CG 4.44Å; F113-P145 HydrophobicContact CE1-CG 3.95Å; F113-P145 HydrophobicContact CZ-CG 4.22Å; A135-P145 WeakPolarHBondContact O-CD 3.5Å; P145-F148 PolarHBondContact O-N 3.27Å; P145-A149 WeakPolarHBondContact O-CB 3.16Å; P145-A149 PolarHBondContact O-N 3.2Å; P145-L161 HydrophobicContact CB-CD1 4.01Å; P145-L161 HydrophobicContact CB-CD2 4.13Å
146	L	96.3	Very high	90.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-38.4	176.3	-171.4	62.5	0	0	0	112.8	T144 F148 A150 V158 L161 L162 A166 P178 L194	T144-L146 PolarHBondContact O-N 3.35Å; T144-L146 VanDerWaalsContact O-N 3.07Å; L146-F148 VanDerWaalsContact C-N 3.32Å; L146-F148 PolarHBondContact O-N 3.45Å; L146-A150 WeakPolarHBondContact O-CB 3.23Å; L146-A150 PolarHBondContact O-N 3.41Å; L146-V158 HydrophobicContact CD1-CB 4.38Å; L146-V158 HydrophobicContact CD1-CG1 3.9Å; L146-V158 HydrophobicContact CD1-CG2 4.38Å; L146-L161 HydrophobicContact CB-CD1 4.43Å; L146-L161 HydrophobicContact CD1-CB 4.25Å; L146-L161 HydrophobicContact CD1-CD1 4.4Å; L146-L162 HydrophobicContact CD1-CD1 4.5Å; L146-L162 HydrophobicContact CD1-CD2 4.26Å; L146-L162 HydrophobicContact CD1-CG 4.09Å; L146-L162 HydrophobicContact CD2-CD2 3.79Å; L146-L162 HydrophobicContact CD2-CG 4.49Å; L146-A166 HydrophobicContact CB-CB 4.18Å; L146-A166 HydrophobicContact CD1-CB 4.48Å; L146-A166 HydrophobicContact CD2-CB 3.87Å; L146-A166 HydrophobicContact CG-CB 4.41Å; L146-P178 HydrophobicContact CB-CG 4.2Å; L146-P178 HydrophobicContact CD2-CB 4.28Å; L146-P178 HydrophobicContact CD2-CG 3.85Å; L146-P178 HydrophobicContact CG-CB 3.93Å; L146-P178 HydrophobicContact CG-CG 3.82Å; L146-L194 HydrophobicContact CD1-CD2 4.28Å; L146-L194 HydrophobicContact CD2-CD2 4.37Å; L146-L194 HydrophobicContact CG-CD2 4.49Å
147	H	95.4	Very high	91.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-38	174.8	-72.9	79.3	0	0	0	112.4	T144 G151 A170 D172 L176 N181	T144-H147 PolarHBondContact N-ND1 2.7Å; T144-H147 VanDerWaalsContact N-ND1 3.16Å; T144-H147 VanDerWaalsContact O-CB 3.32Å; T144-H147 WeakPolarHBondContact O-CB 3.43Å; T144-H147 PolarHBondContact O-N 3.02Å; T144-H147 PolarHBondContact OG1-ND1 3.1Å; H147-G151 PolarHBondContact O-N 2.99Å; H147-A170 PolarHBondContact CE1-O 2.82Å; H147-A170 PolarHBondContact NE2-O 3.21Å; H147-D172 IonicContact CD2-OD2 3.92Å; H147-L176 PolarHBondContact NE2-O 3.33Å; H147-L176 VanDerWaalsContact NE2-O 3.17Å; H147-N181 PolarHBondContact O-ND2 3.23Å
148	F	92.9	Very high	91.8	Very high	33 Å²	33	46.3 Å²	46.3	15%	0.145	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-54.1	176.9	-79.2	-102.9	0	0	0	110.4	F113 C116 D137 T144 P145 L146 A150 G151 F152	F113-F148 AromaticContact CD1-CD2 3.53Å; F113-F148 HydrophobicContact CD1-CD2 3.53Å; F113-F148 AromaticContact CD1-CE2 3.59Å; F113-F148 HydrophobicContact CD1-CE2 3.59Å; F113-F148 HydrophobicContact CD1-CG 4.13Å; F113-F148 HydrophobicContact CD1-CZ 4.24Å; F113-F148 AromaticContact CE1-CD2 3.9Å; F113-F148 HydrophobicContact CE1-CD2 3.9Å; F113-F148 AromaticContact CE1-CE2 3.85Å; F113-F148 HydrophobicContact CE1-CE2 3.85Å; C116-F148 HydrophobicContact CB-CB 4.4Å; D137-F148 HydrophobicContact CB-CE2 4.22Å; D137-F148 HydrophobicContact CB-CZ 4.42Å; T144-F148 PolarHBondContact O-N 3.15Å; P145-F148 PolarHBondContact O-N 3.27Å; L146-F148 VanDerWaalsContact C-N 3.32Å; L146-F148 PolarHBondContact O-N 3.45Å; F148-A150 PolarHBondContact O-N 2.99Å; F148-G151 PolarHBondContact O-N 3.43Å; F148-F152 HydrophobicContact CD1-CE2 4.21Å; F148-F152 VanDerWaalsContact O-CD2 3.28Å; F148-F152 WeakPolarHBondContact O-CD2 3.44Å; F148-F152 PolarHBondContact O-N 2.88Å
149	A	96.1	Very high	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.9	-39.7	179.2	0	0	0	0	0	111.8	C116 P145 G153 R154 V157 V158 L161	C116-A149 HydrophobicContact CB-CB 4.28Å; P145-A149 WeakPolarHBondContact O-CB 3.16Å; P145-A149 PolarHBondContact O-N 3.2Å; A149-G153 PolarHBondContact O-N 3.27Å; A149-R154 HydrophobicContact CB-CB 4.41Å; A149-R154 PolarHBondContact O-N 2.83Å; A149-V157 HydrophobicContact CB-CB 4.17Å; A149-V157 HydrophobicContact CB-CG1 3.66Å; A149-V158 HydrophobicContact CB-CG2 3.65Å; A149-L161 HydrophobicContact CB-CD1 3.88Å
150	A	96.4	Very high	93.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68.4	-47.2	177.1	0	0	0	0	0	113.1	L146 F148 F152 G153 V158 P178 A182 H187 V190 L194	L146-A150 WeakPolarHBondContact O-CB 3.23Å; L146-A150 PolarHBondContact O-N 3.41Å; F148-A150 PolarHBondContact O-N 2.99Å; A150-F152 VanDerWaalsContact C-N 3.27Å; A150-F152 PolarHBondContact O-N 3.22Å; A150-G153 PolarHBondContact O-N 2.92Å; A150-V158 HydrophobicContact CB-CG2 4.36Å; A150-P178 HydrophobicContact CB-CB 4.03Å; A150-P178 WeakPolarHBondContact CB-O 3.28Å; A150-A182 HydrophobicContact CB-CB 4.23Å; A150-H187 PolarHBondContact O-CD2 3.09Å; A150-V190 HydrophobicContact CB-CG1 3.94Å; A150-L194 HydrophobicContact CB-CD1 4.06Å
151	G	93.8	Very high	94.6	Very high	6 Å²	6	36.3 Å²	36.3	6%	0.062	17%	0.169	C	C	.	.	H	α-helix	trans	-68.5	-18.5	179.3	0	0	0	0	0	115.3	H147 F148 F185 H187	H147-G151 PolarHBondContact O-N 2.99Å; F148-G151 PolarHBondContact O-N 3.43Å; G151-F185 WeakPolarHBondContact O-CD2 3.2Å; G151-H187 PolarHBondContact O-NE2 2.69Å
152	F	94.8	Very high	95.1	Very high	85 Å²	85	32.4 Å²	32.4	37%	0.373	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	8.7	173.3	-70.8	-76.7	0	0	0	113.4	R117 F148 A150 R154	R117-F152 HydrophobicContact CB-CD2 4.01Å; R117-F152 HydrophobicContact CB-CE2 4.15Å; R117-F152 HydrophobicContact CG-CD1 4.22Å; R117-F152 HydrophobicContact CG-CD2 3.79Å; R117-F152 HydrophobicContact CG-CE1 4.13Å; R117-F152 HydrophobicContact CG-CE2 3.72Å; R117-F152 HydrophobicContact CG-CG 4.07Å; R117-F152 HydrophobicContact CG-CZ 3.9Å; F148-F152 HydrophobicContact CD1-CE2 4.21Å; F148-F152 VanDerWaalsContact O-CD2 3.28Å; F148-F152 WeakPolarHBondContact O-CD2 3.44Å; F148-F152 PolarHBondContact O-N 2.88Å; A150-F152 VanDerWaalsContact C-N 3.27Å; A150-F152 PolarHBondContact O-N 3.22Å; F152-R154 VanDerWaalsContact C-N 3.35Å; F152-R154 HydrophobicContact CB-CG 4.12Å; F152-R154 WeakPolarHBondContact O-CD 3.46Å; F152-R154 PolarHBondContact O-N 2.97Å; F152-R154 PolarHBondContact O-NE 3.42Å
153	G	94.8	Very high	95.3	Very high	25 Å²	25	34.3 Å²	34.3	26%	0.258	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	24.1	172.9	0	0	0	0	0	115.2	A149 A150 K155 H187	A149-G153 PolarHBondContact O-N 3.27Å; A150-G153 PolarHBondContact O-N 2.92Å; G153-K155 VanDerWaalsContact C-N 3.33Å; G153-K155 PolarHBondContact O-N 3.12Å; G153-H187 VanDerWaalsContact CA-CD2 3.47Å; G153-H187 WeakPolarHBondContact CA-CD2 3.43Å; G153-H187 PolarHBondContact N-CD2 3Å; G153-H187 VanDerWaalsContact N-CD2 3.27Å; G153-H187 PolarHBondContact N-NE2 3.43Å
154	R	96.4	Very high	95.3	Very high	95 Å²	95	36 Å²	36	36%	0.358	18%	0.176	S	C	.	.			trans	-85.3	69.6	-173.3	-52.5	-49.3	-173.2	-170.6	0	111.6	C116 R117 A149 F152 D156 V157 V158	C116-R154 WeakPolarHBondContact O-CG 3.39Å; R117-R154 PolarHBondContact O-NE 3.32Å; R117-R154 PolarHBondContact O-NH2 2.94Å; R117-R154 VanDerWaalsContact O-NH2 3.1Å; A149-R154 HydrophobicContact CB-CB 4.41Å; A149-R154 PolarHBondContact O-N 2.83Å; F152-R154 VanDerWaalsContact C-N 3.35Å; F152-R154 HydrophobicContact CB-CG 4.12Å; F152-R154 WeakPolarHBondContact O-CD 3.46Å; F152-R154 PolarHBondContact O-N 2.97Å; F152-R154 PolarHBondContact O-NE 3.42Å; R154-D156 PolarHBondContact O-N 3.46Å; R154-V157 HydrophobicContact CB-CB 3.95Å; R154-V157 HydrophobicContact CB-CG2 4.14Å; R154-V157 WeakPolarHBondContact O-CA 3.31Å; R154-V157 WeakPolarHBondContact O-CB 3.49Å; R154-V157 PolarHBondContact O-N 3.13Å; R154-V158 WeakPolarHBondContact O-CG2 3.46Å; R154-V158 PolarHBondContact O-N 3.2Å
155	K	96.1	Very high	95.2	Very high	84 Å²	84	38.1 Å²	38.1	37%	0.365	20%	0.199	S	C	.	.	H	α-helix	trans	-42.7	-55.3	-176.5	-174.6	-173.3	-176.8	179	0	113.8	G153 V157 V158 E159 E189 V190 L193	G153-K155 VanDerWaalsContact C-N 3.33Å; G153-K155 PolarHBondContact O-N 3.12Å; K155-V157 VanDerWaalsContact C-N 3.26Å; K155-V157 PolarHBondContact O-N 3.26Å; K155-V158 WeakPolarHBondContact O-CA 3.23Å; K155-V158 WeakPolarHBondContact O-CB 3.18Å; K155-V158 PolarHBondContact O-N 3.47Å; K155-E159 PolarHBondContact O-N 2.93Å; K155-E189 HydrophobicContact CD-CB 4.3Å; K155-E189 WeakPolarHBondContact CD-OE2 3.5Å; K155-E189 WeakPolarHBondContact CE-OE2 3.1Å; K155-E189 IonicContact NZ-OE2 3.04Å; K155-E189 PolarHBondContact NZ-OE2 2.84Å; K155-V190 HydrophobicContact CB-CG2 4.22Å; K155-L193 HydrophobicContact CG-CD2 4.32Å
156	D	95.9	Very high	95.3	Very high	102 Å²	102	38.6 Å²	38.6	55%	0.545	20%	0.203	S	C	.	.	H	α-helix	trans	-64.5	-30.6	-176.3	-48.2	-15.3	0	0	0	112.7	V121 R154 H160	V121-D156 HydrophobicContact CG2-CB 3.61Å; R154-D156 PolarHBondContact O-N 3.46Å; D156-H160 WeakPolarHBondContact O-CB 3.36Å; D156-H160 PolarHBondContact O-N 2.9Å
157	V	96.8	Very high	95.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-74.3	-43.6	172.3	176	0	0	0	0	110.5	C116 V121 V124 A149 R154 K155 E159 H160 L161	C116-V157 HydrophobicContact CB-CG1 4.32Å; V121-V157 HydrophobicContact CG2-CG2 3.75Å; V124-V157 HydrophobicContact CG1-CG1 4.26Å; V124-V157 HydrophobicContact CG2-CG1 3.96Å; V124-V157 HydrophobicContact CG2-CG2 4.31Å; A149-V157 HydrophobicContact CB-CB 4.17Å; A149-V157 HydrophobicContact CB-CG1 3.66Å; R154-V157 HydrophobicContact CB-CB 3.95Å; R154-V157 HydrophobicContact CB-CG2 4.14Å; R154-V157 WeakPolarHBondContact O-CA 3.31Å; R154-V157 WeakPolarHBondContact O-CB 3.49Å; R154-V157 PolarHBondContact O-N 3.13Å; K155-V157 VanDerWaalsContact C-N 3.26Å; K155-V157 PolarHBondContact O-N 3.26Å; V157-E159 VanDerWaalsContact C-N 3.35Å; V157-E159 PolarHBondContact O-N 3.42Å; V157-H160 PolarHBondContact O-N 3.46Å; V157-L161 HydrophobicContact CG1-CD1 3.81Å; V157-L161 HydrophobicContact CG1-CG 4.09Å; V157-L161 WeakPolarHBondContact O-CB 3.09Å; V157-L161 WeakPolarHBondContact O-CG 3.33Å; V157-L161 PolarHBondContact O-N 2.87Å
158	V	96.7	Very high	95.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-47.4	176.4	169.9	0	0	0	0	110.5	L146 A149 A150 R154 K155 L161 L162 V190 L193 L194	L146-V158 HydrophobicContact CD1-CB 4.38Å; L146-V158 HydrophobicContact CD1-CG1 3.9Å; L146-V158 HydrophobicContact CD1-CG2 4.38Å; A149-V158 HydrophobicContact CB-CG2 3.65Å; A150-V158 HydrophobicContact CB-CG2 4.36Å; R154-V158 WeakPolarHBondContact O-CG2 3.46Å; R154-V158 PolarHBondContact O-N 3.2Å; K155-V158 WeakPolarHBondContact O-CA 3.23Å; K155-V158 WeakPolarHBondContact O-CB 3.18Å; K155-V158 PolarHBondContact O-N 3.47Å; V158-L161 PolarHBondContact O-N 3.13Å; V158-L162 HydrophobicContact CG1-CD1 3.68Å; V158-L162 WeakPolarHBondContact O-CB 3.38Å; V158-L162 WeakPolarHBondContact O-CD1 3.38Å; V158-L162 VanDerWaalsContact O-CG 3.24Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 3.39Å; V158-V190 HydrophobicContact CG1-CG1 4.42Å; V158-V190 HydrophobicContact CG2-CG1 4.15Å; V158-V190 HydrophobicContact CG2-CG2 4.42Å; V158-L193 HydrophobicContact CB-CD2 4.26Å; V158-L193 HydrophobicContact CG1-CD2 3.76Å; V158-L193 HydrophobicContact CG1-CG 4.38Å; V158-L194 HydrophobicContact CG1-CD2 4.08Å; V158-L194 HydrophobicContact CG1-CG 4.36Å
159	E	96.4	Very high	95.4	Very high	91 Å²	91	45.8 Å²	45.8	43%	0.425	24%	0.24	S	C	.	.	H	α-helix	trans	-58.5	-49.5	176.4	-176.9	174.2	-131	0	0	111.5	K155 V157 L161 L162 Q163 L193	K155-E159 PolarHBondContact O-N 2.93Å; V157-E159 VanDerWaalsContact C-N 3.35Å; V157-E159 PolarHBondContact O-N 3.42Å; E159-L161 PolarHBondContact O-N 2.93Å; E159-L162 PolarHBondContact O-N 2.92Å; E159-Q163 VanDerWaalsContact O-CG 3.3Å; E159-Q163 WeakPolarHBondContact O-CG 3.23Å; E159-Q163 PolarHBondContact O-N 3.46Å; E159-L193 HydrophobicContact CB-CD2 3.94Å
160	H	95.7	Very high	95.3	Very high	28 Å²	28	46.3 Å²	46.3	13%	0.13	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-38	179.3	-179.2	48.7	0	0	0	113.1	K125 D156 V157 Q163 T164	K125-H160 VanDerWaalsContact CG-CD2 3.48Å; K125-H160 WeakPolarHBondContact CG-CD2 3.45Å; K125-H160 WeakPolarHBondContact CG-NE2 3.48Å; D156-H160 WeakPolarHBondContact O-CB 3.36Å; D156-H160 PolarHBondContact O-N 2.9Å; V157-H160 PolarHBondContact O-N 3.46Å; H160-Q163 PolarHBondContact O-N 3.44Å; H160-T164 PolarHBondContact CE1-OG1 2.85Å; H160-T164 WeakPolarHBondContact O-CB 3.45Å; H160-T164 PolarHBondContact O-N 3.28Å; H160-T164 PolarHBondContact O-OG1 3.31Å
161	L	95.6	Very high	95.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-43.5	175	-73.7	174.8	0	0	0	111.3	V124 V128 V133 P145 L146 A149 V157 V158 E159 T164 G165 A166	V124-L161 HydrophobicContact CG1-CD2 4.1Å; V128-L161 HydrophobicContact CG2-CD2 3.92Å; V133-L161 HydrophobicContact CG2-CD2 4.14Å; P145-L161 HydrophobicContact CB-CD1 4.01Å; P145-L161 HydrophobicContact CB-CD2 4.13Å; L146-L161 HydrophobicContact CB-CD1 4.43Å; L146-L161 HydrophobicContact CD1-CB 4.25Å; L146-L161 HydrophobicContact CD1-CD1 4.4Å; A149-L161 HydrophobicContact CB-CD1 3.88Å; V157-L161 HydrophobicContact CG1-CD1 3.81Å; V157-L161 HydrophobicContact CG1-CG 4.09Å; V157-L161 WeakPolarHBondContact O-CB 3.09Å; V157-L161 WeakPolarHBondContact O-CG 3.33Å; V157-L161 PolarHBondContact O-N 2.87Å; V158-L161 PolarHBondContact O-N 3.13Å; E159-L161 PolarHBondContact O-N 2.93Å; L161-T164 CarbonylContact O-C 3.38Å; L161-T164 PolarHBondContact O-N 3.44Å; L161-T164 VanDerWaalsContact O-N 3.11Å; L161-G165 PolarHBondContact O-N 3.37Å; L161-A166 HydrophobicContact CB-CB 3.94Å; L161-A166 WeakPolarHBondContact O-CB 3.22Å; L161-A166 PolarHBondContact O-N 3.31Å
162	L	94.8	Very high	95.2	Very high	24 Å²	24	52.1 Å²	52.1	13%	0.126	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-43.4	177.3	-68.9	163.6	0	0	0	111.4	L146 V158 E159 T164 G165 V168 L193 L194 Q197	L146-L162 HydrophobicContact CD1-CD1 4.5Å; L146-L162 HydrophobicContact CD1-CD2 4.26Å; L146-L162 HydrophobicContact CD1-CG 4.09Å; L146-L162 HydrophobicContact CD2-CD2 3.79Å; L146-L162 HydrophobicContact CD2-CG 4.49Å; V158-L162 HydrophobicContact CG1-CD1 3.68Å; V158-L162 WeakPolarHBondContact O-CB 3.38Å; V158-L162 WeakPolarHBondContact O-CD1 3.38Å; V158-L162 VanDerWaalsContact O-CG 3.24Å; V158-L162 WeakPolarHBondContact O-CG 3.46Å; V158-L162 PolarHBondContact O-N 3.39Å; E159-L162 PolarHBondContact O-N 2.92Å; L162-T164 PolarHBondContact O-N 2.95Å; L162-G165 PolarHBondContact O-N 3.27Å; L162-V168 HydrophobicContact CD2-CB 4.2Å; L162-V168 HydrophobicContact CD2-CG2 4.39Å; L162-L193 HydrophobicContact CD1-CG 4.32Å; L162-L194 HydrophobicContact CD1-CD2 4.07Å; L162-Q197 HydrophobicContact CD1-CB 4.27Å; L162-Q197 HydrophobicContact CD1-CG 4.03Å
163	Q	94.1	Very high	95.1	Very high	138 Å²	138	52 Å²	52	65%	0.645	27%	0.267	S	S	*	.	H	α-helix	trans	-57.8	-28.8	171.1	-71.8	170	1.7	0	0	113.1	E159 H160 G165	E159-Q163 VanDerWaalsContact O-CG 3.3Å; E159-Q163 WeakPolarHBondContact O-CG 3.23Å; E159-Q163 PolarHBondContact O-N 3.46Å; H160-Q163 PolarHBondContact O-N 3.44Å; Q163-G165 VanDerWaalsContact C-N 3.33Å
164	T	92.8	Very high	94.9	Very high	41 Å²	41	51.1 Å²	51.1	25%	0.252	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	7.2	179.5	-46.7	0	0	0	0	112.6	V128 V133 H160 L161 L162	V128-T164 HydrophobicContact CG1-CG2 4.27Å; V128-T164 HydrophobicContact CG2-CG2 4.34Å; V133-T164 HydrophobicContact CG2-CG2 4.4Å; H160-T164 PolarHBondContact CE1-OG1 2.85Å; H160-T164 WeakPolarHBondContact O-CB 3.45Å; H160-T164 PolarHBondContact O-N 3.28Å; H160-T164 PolarHBondContact O-OG1 3.31Å; L161-T164 CarbonylContact O-C 3.38Å; L161-T164 PolarHBondContact O-N 3.44Å; L161-T164 VanDerWaalsContact O-N 3.11Å; L162-T164 PolarHBondContact O-N 2.95Å
165	G	93.1	Very high	94.8	Very high	47 Å²	47	46.7 Å²	46.7	49%	0.485	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	24.4	176.2	0	0	0	0	0	115.2	N134 L161 L162 Q163 N167	N134-G165 PolarHBondContact ND2-O 3.31Å; L161-G165 PolarHBondContact O-N 3.37Å; L162-G165 PolarHBondContact O-N 3.27Å; Q163-G165 VanDerWaalsContact C-N 3.33Å; G165-N167 PolarHBondContact O-N 2.7Å
166	A	95.5	Very high	94.8	Very high	9 Å²	9	43.8 Å²	43.8	7%	0.074	23%	0.231	C	C	.	.			trans	-61.6	129	169.7	0	0	0	0	0	111.2	V133 N134 L146 L161 V168	V133-A166 HydrophobicContact CG2-CB 3.78Å; N134-A166 WeakPolarHBondContact OD1-CA 3.4Å; L146-A166 HydrophobicContact CB-CB 4.18Å; L146-A166 HydrophobicContact CD1-CB 4.48Å; L146-A166 HydrophobicContact CD2-CB 3.87Å; L146-A166 HydrophobicContact CG-CB 4.41Å; L161-A166 HydrophobicContact CB-CB 3.94Å; L161-A166 WeakPolarHBondContact O-CB 3.22Å; L161-A166 PolarHBondContact O-N 3.31Å; A166-V168 PolarHBondContact O-N 2.9Å
167	N	94.7	Very high	94.9	Very high	75 Å²	75	39 Å²	39	40%	0.401	21%	0.206	S	C	.	.			trans	-76.7	108.7	-179.8	178.4	-0.1	0	0	0	110.3	N134 G165 H169 A170	N134-N167 PolarHBondContact OD1-N 3.49Å; G165-N167 PolarHBondContact O-N 2.7Å; N167-H169 PolarHBondContact O-N 3.35Å; N167-H169 WeakPolarHBondContact OD1-CA 3.46Å; N167-H169 PolarHBondContact OD1-N 2.95Å; N167-A170 HydrophobicContact CB-CB 4.18Å; N167-A170 VanDerWaalsContact O-CB 3.28Å; N167-A170 WeakPolarHBondContact O-CB 3.37Å; N167-A170 PolarHBondContact O-N 3.02Å; N167-A170 VanDerWaalsContact O-N 3.1Å; N167-A170 PolarHBondContact OD1-N 3.34Å
168	V	96.1	Very high	94.9	Very high	12 Å²	12	39 Å²	39	7%	0.073	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.2	178.6	76.6	0	0	0	0	113.8	L162 A166 L194 A199	L162-V168 HydrophobicContact CD2-CB 4.2Å; L162-V168 HydrophobicContact CD2-CG2 4.39Å; A166-V168 PolarHBondContact O-N 2.9Å; V168-L194 HydrophobicContact CG2-CB 4.45Å; V168-L194 HydrophobicContact CG2-CD2 3.84Å; V168-A199 HydrophobicContact CG2-CB 3.64Å
169	H	95.9	Very high	94.9	Very high	99 Å²	99	39 Å²	39	46%	0.458	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	7.2	177.7	-51.7	-77.3	0	0	0	113.6	N167 R171 G198	N167-H169 PolarHBondContact O-N 3.35Å; N167-H169 WeakPolarHBondContact OD1-CA 3.46Å; N167-H169 PolarHBondContact OD1-N 2.95Å; H169-R171 PolarHBondContact O-N 2.94Å; H169-G198 PolarHBondContact CE1-O 2.84Å
170	A	95	Very high	95	Very high	10 Å²	10	34.8 Å²	34.8	8%	0.083	19%	0.186	C	C	.	.			trans	-56.9	131.9	177.1	0	0	0	0	0	110.1	T144 H147 N167 I177 P178	T144-A170 HydrophobicContact CG2-CB 3.94Å; H147-A170 PolarHBondContact CE1-O 2.82Å; H147-A170 PolarHBondContact NE2-O 3.21Å; N167-A170 HydrophobicContact CB-CB 4.18Å; N167-A170 VanDerWaalsContact O-CB 3.28Å; N167-A170 WeakPolarHBondContact O-CB 3.37Å; N167-A170 PolarHBondContact O-N 3.02Å; N167-A170 VanDerWaalsContact O-N 3.1Å; N167-A170 PolarHBondContact OD1-N 3.34Å; A170-I177 WeakPolarHBondContact O-CA 3.49Å; A170-P178 WeakPolarHBondContact O-CD 3.3Å
171	R	95.1	Very high	95	Very high	121 Å²	121	34.4 Å²	34.4	46%	0.457	19%	0.185	S	C	.	.			trans	-102.5	138.2	176.4	-64.9	-175.9	-175.8	-141.7	-3.8	112.1	K136 H169 L176 I177 R204	K136-R171 PolarHBondContact NZ-O 2.89Å; H169-R171 PolarHBondContact O-N 2.94Å; R171-L176 WeakPolarHBondContact CA-O 3.35Å; R171-I177 HydrophobicContact CG-CG2 3.84Å; R171-R204 PolarHBondContact NH1-O 3.18Å; R171-R204 PolarHBondContact NH2-O 3.24Å
172	D	93.8	Very high	95.1	Very high	7 Å²	7	34.4 Å²	34.4	4%	0.037	19%	0.185	C	C	.	.			trans	-84.8	178.5	165.4	76.7	31.8	0	0	0	111.5	R141 S143 H147 G174 G175 L176	R141-D172 IonicContact CZ-OD1 3.95Å; R141-D172 IonicContact CZ-OD2 3.98Å; R141-D172 VanDerWaalsContact CZ-OD2 3.25Å; R141-D172 IonicContact NH1-OD1 2.99Å; R141-D172 PolarHBondContact NH1-OD1 2.99Å; R141-D172 IonicContact NH1-OD2 3.86Å; R141-D172 PolarHBondContact NH1-OD2 3.44Å; R141-D172 IonicContact NH2-OD2 2.82Å; R141-D172 PolarHBondContact NH2-OD2 3.48Å; R141-D172 WeakPolarHBondContact O-CB 3.5Å; S143-D172 PolarHBondContact OG-OD2 2.92Å; H147-D172 IonicContact CD2-OD2 3.92Å; D172-G174 PolarHBondContact O-N 3.14Å; D172-G174 WeakPolarHBondContact OD1-CA 3.5Å; D172-G174 PolarHBondContact OD1-N 3.22Å; D172-G175 WeakPolarHBondContact O-CA 3.12Å; D172-G175 PolarHBondContact O-N 3.44Å; D172-L176 PolarHBondContact N-O 2.81Å
173	D	92.3	Very high	95.2	Very high	82 Å²	82	33.3 Å²	33.3	44%	0.439	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.5	-175.9	-78.7	-9.6	0	0	0	113.5	R141 K142 G175 N206	R141-D173 WeakPolarHBondContact O-CB 3.32Å; R141-D173 PolarHBondContact O-N 3.39Å; K142-D173 WeakPolarHBondContact CD-OD1 3.33Å; K142-D173 WeakPolarHBondContact CG-OD2 3.2Å; K142-D173 IonicContact NZ-OD1 3.41Å; K142-D173 PolarHBondContact NZ-OD1 2.83Å; K142-D173 IonicContact NZ-OD2 3.72Å; K142-D173 PolarHBondContact NZ-OD2 2.99Å; D173-G175 VanDerWaalsContact C-N 3.28Å; D173-N206 PolarHBondContact O-ND2 3.23Å
174	G	90.9	Very high	95.2	Very high	8 Å²	8	27.7 Å²	27.7	8%	0.082	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-4.1	170.8	0	0	0	0	0	113.6	D172 L176 N206	D172-G174 PolarHBondContact O-N 3.14Å; D172-G174 WeakPolarHBondContact OD1-CA 3.5Å; D172-G174 PolarHBondContact OD1-N 3.22Å; G174-L176 PolarHBondContact O-N 3.44Å; G174-N206 VanDerWaalsContact C-CG 3.46Å; G174-N206 VanDerWaalsContact C-ND2 3.26Å; G174-N206 WeakPolarHBondContact O-CB 3.47Å; G174-N206 PolarHBondContact O-N 3.11Å; G174-N206 PolarHBondContact O-ND2 2.82Å
175	G	94.3	Very high	95.1	Very high	2 Å²	2	31.8 Å²	31.8	2%	0.021	17%	0.169	C	C	.	.	S	Bend	trans	80.3	-0.8	-172.2	0	0	0	0	0	114	D172 D173 N206	D172-G175 WeakPolarHBondContact O-CA 3.12Å; D172-G175 PolarHBondContact O-N 3.44Å; D173-G175 VanDerWaalsContact C-N 3.28Å; G175-N206 WeakPolarHBondContact CA-OD1 3.19Å
176	L	95.9	Very high	95.1	Very high	22 Å²	22	30.8 Å²	30.8	12%	0.115	16%	0.16	C	C	.	.			trans	-70.5	143	-178.6	-63.4	156.8	0	0	0	110.1	H147 R171 D172 G174 H180 D205	H147-L176 PolarHBondContact NE2-O 3.33Å; H147-L176 VanDerWaalsContact NE2-O 3.17Å; R171-L176 WeakPolarHBondContact CA-O 3.35Å; D172-L176 PolarHBondContact N-O 2.81Å; G174-L176 PolarHBondContact O-N 3.44Å; L176-H180 HydrophobicContact CB-CB 4.23Å; L176-H180 HydrophobicContact CD2-CB 3.55Å; L176-H180 HydrophobicContact CG-CB 4.49Å; L176-D205 HydrophobicContact CD2-CB 3.84Å; L176-D205 HydrophobicContact CG-CB 4.11Å
177	I	97	Very high	95.1	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.015	17%	0.17	C	C	.	.			trans	-101	165	169.4	62.1	158.4	0	0	0	110.1	A170 R171 L179 H180 A203	A170-I177 WeakPolarHBondContact O-CA 3.49Å; R171-I177 HydrophobicContact CG-CG2 3.84Å; I177-L179 HydrophobicContact CD1-CB 3.77Å; I177-L179 HydrophobicContact CD1-CD2 4.44Å; I177-L179 HydrophobicContact CG1-CB 4.03Å; I177-L179 PolarHBondContact O-N 3.38Å; I177-H180 VanDerWaalsContact CG1-ND1 3.28Å; I177-H180 WeakPolarHBondContact CG1-ND1 3.36Å; I177-H180 PolarHBondContact N-ND1 2.94Å; I177-H180 PolarHBondContact O-N 3.17Å; I177-A203 HydrophobicContact CD1-CB 3.63Å; I177-A203 HydrophobicContact CG1-CB 4.05Å
178	P	97.2	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-53	-29.9	-179.6	-28.3	34.9	0	0	0	114.7	L146 A150 A170 N181 A182 L194	L146-P178 HydrophobicContact CB-CG 4.2Å; L146-P178 HydrophobicContact CD2-CB 4.28Å; L146-P178 HydrophobicContact CD2-CG 3.85Å; L146-P178 HydrophobicContact CG-CB 3.93Å; L146-P178 HydrophobicContact CG-CG 3.82Å; A150-P178 HydrophobicContact CB-CB 4.03Å; A150-P178 WeakPolarHBondContact CB-O 3.28Å; A170-P178 WeakPolarHBondContact O-CD 3.3Å; P178-N181 PolarHBondContact O-N 3.43Å; P178-A182 PolarHBondContact O-N 3.29Å; P178-A182 VanDerWaalsContact O-N 3.15Å; P178-L194 HydrophobicContact CB-CD1 4.41Å
179	L	97.9	Very high	94.9	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61	-43.2	175.9	-174.2	62.2	0	0	0	112.3	I177 N181 A182 C183 V191 L194 L195 A199 P211 L227	I177-L179 HydrophobicContact CD1-CB 3.77Å; I177-L179 HydrophobicContact CD1-CD2 4.44Å; I177-L179 HydrophobicContact CG1-CB 4.03Å; I177-L179 PolarHBondContact O-N 3.38Å; L179-N181 VanDerWaalsContact C-N 3.3Å; L179-N181 PolarHBondContact O-N 2.91Å; L179-A182 PolarHBondContact O-N 2.95Å; L179-C183 WeakPolarHBondContact O-CB 3.08Å; L179-C183 PolarHBondContact O-N 3.16Å; L179-C183 PolarHBondContact O-SG 3.37Å; L179-V191 HydrophobicContact CD1-CB 4.3Å; L179-V191 HydrophobicContact CD1-CG1 3.96Å; L179-V191 HydrophobicContact CD1-CG2 4.32Å; L179-L194 HydrophobicContact CB-CD1 4.46Å; L179-L194 HydrophobicContact CD1-CB 4.14Å; L179-L194 HydrophobicContact CD1-CD1 4.3Å; L179-L195 HydrophobicContact CD1-CD2 4.43Å; L179-L195 HydrophobicContact CD1-CG 4.16Å; L179-L195 HydrophobicContact CD2-CD2 3.75Å; L179-L195 HydrophobicContact CD2-CG 4.37Å; L179-A199 HydrophobicContact CB-CB 4.37Å; L179-A199 HydrophobicContact CD2-CB 3.91Å; L179-P211 HydrophobicContact CB-CG 4.39Å; L179-P211 HydrophobicContact CD2-CB 4.15Å; L179-P211 HydrophobicContact CD2-CG 3.78Å; L179-P211 HydrophobicContact CG-CB 3.99Å; L179-P211 HydrophobicContact CG-CG 3.9Å; L179-L227 HydrophobicContact CD2-CD2 4.35Å
180	H	97.8	Very high	95	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-58.2	-42.8	176.7	-68.7	87.2	0	0	0	111.8	L176 I177 C183 S184 A203 D205 Y209 T210	L176-H180 HydrophobicContact CB-CB 4.23Å; L176-H180 HydrophobicContact CD2-CB 3.55Å; L176-H180 HydrophobicContact CG-CB 4.49Å; I177-H180 VanDerWaalsContact CG1-ND1 3.28Å; I177-H180 WeakPolarHBondContact CG1-ND1 3.36Å; I177-H180 PolarHBondContact N-ND1 2.94Å; I177-H180 PolarHBondContact O-N 3.17Å; H180-C183 PolarHBondContact O-N 2.83Å; H180-S184 WeakPolarHBondContact O-CB 3.25Å; H180-S184 PolarHBondContact O-N 2.98Å; H180-A203 WeakPolarHBondContact CE1-CB 3.2Å; H180-A203 PolarHBondContact CE1-O 2.98Å; H180-A203 PolarHBondContact NE2-O 3.45Å; H180-D205 PolarHBondContact NE2-N 3.16Å; H180-Y209 PolarHBondContact NE2-O 3.04Å; H180-T210 WeakPolarHBondContact NE2-CA 3.26Å; H180-T210 PolarHBondContact NE2-N 3.02Å
181	N	95	Very high	95.1	Very high	21 Å²	21	31.3 Å²	31.3	11%	0.112	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-48.7	177.7	-72.7	1.4	0	0	0	111.3	H147 P178 L179 C183 S184 F185	H147-N181 PolarHBondContact O-ND2 3.23Å; P178-N181 PolarHBondContact O-N 3.43Å; L179-N181 VanDerWaalsContact C-N 3.3Å; L179-N181 PolarHBondContact O-N 2.91Å; N181-C183 VanDerWaalsContact C-N 3.26Å; N181-C183 PolarHBondContact O-N 3.29Å; N181-S184 PolarHBondContact O-N 3.29Å; N181-F185 VanDerWaalsContact O-CD2 3.27Å; N181-F185 WeakPolarHBondContact O-CD2 3.28Å; N181-F185 PolarHBondContact O-N 3.33Å
182	A	97.1	Very high	95.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-38.6	177.3	0	0	0	0	0	112	A150 P178 L179 G186 H187 V190 V191 L194	A150-A182 HydrophobicContact CB-CB 4.23Å; P178-A182 PolarHBondContact O-N 3.29Å; P178-A182 VanDerWaalsContact O-N 3.15Å; L179-A182 PolarHBondContact O-N 2.95Å; A182-G186 PolarHBondContact O-N 2.99Å; A182-H187 PolarHBondContact O-N 2.86Å; A182-V190 HydrophobicContact CB-CB 4.37Å; A182-V190 HydrophobicContact CB-CG1 3.67Å; A182-V191 HydrophobicContact CB-CG2 3.68Å; A182-L194 HydrophobicContact CB-CD1 4.22Å
183	C	97.1	Very high	95.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.7	-44.6	178.9	-69.4	0	0	0	0	113.3	L179 H180 N181 F185 G186 V191 P211 A215 V223	L179-C183 WeakPolarHBondContact O-CB 3.08Å; L179-C183 PolarHBondContact O-N 3.16Å; L179-C183 PolarHBondContact O-SG 3.37Å; H180-C183 PolarHBondContact O-N 2.83Å; N181-C183 VanDerWaalsContact C-N 3.26Å; N181-C183 PolarHBondContact O-N 3.29Å; C183-F185 VanDerWaalsContact C-N 3.32Å; C183-F185 PolarHBondContact O-N 2.93Å; C183-G186 PolarHBondContact O-N 3.27Å; C183-V191 VanDerWaalsContact SG-CG2 3.58Å; C183-P211 HydrophobicContact CB-CB 4.23Å; C183-P211 WeakPolarHBondContact CB-O 3.45Å; C183-A215 HydrophobicContact CB-CB 4.32Å; C183-V223 HydrophobicContact CB-CG1 3.81Å; C183-V223 VanDerWaalsContact SG-CG1 3.55Å
184	S	94	Very high	95.5	Very high	20 Å²	20	24.8 Å²	24.8	14%	0.14	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-37.6	-179.1	-158.9	0	0	0	0	112.2	H180 N181 E214 K218 K220	H180-S184 WeakPolarHBondContact O-CB 3.25Å; H180-S184 PolarHBondContact O-N 2.98Å; N181-S184 PolarHBondContact O-N 3.29Å; S184-E214 VanDerWaalsContact CB-OE2 3.22Å; S184-E214 WeakPolarHBondContact CB-OE2 3.25Å; S184-E214 PolarHBondContact OG-OE2 2.99Å; S184-K218 WeakPolarHBondContact O-CB 3.36Å; S184-K218 WeakPolarHBondContact O-CG 3.29Å; S184-K218 WeakPolarHBondContact OG-CE 3.38Å; S184-K220 WeakPolarHBondContact O-CE 3.39Å
185	F	92	Very high	95.8	Very high	127 Å²	127	25 Å²	25	56%	0.557	14%	0.137	S	C	*	.	H	α-helix	trans	-86.1	-22.8	178.3	-66.5	-67.7	0	0	0	114.2	G151 N181 C183 K220	G151-F185 WeakPolarHBondContact O-CD2 3.2Å; N181-F185 VanDerWaalsContact O-CD2 3.27Å; N181-F185 WeakPolarHBondContact O-CD2 3.28Å; N181-F185 PolarHBondContact O-N 3.33Å; C183-F185 VanDerWaalsContact C-N 3.32Å; C183-F185 PolarHBondContact O-N 2.93Å; F185-K220 WeakPolarHBondContact O-CE 3.18Å; F185-K220 PolarHBondContact O-NZ 3.31Å
186	G	93.1	Very high	95.9	Very high	27 Å²	27	29 Å²	29	28%	0.278	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.2	26.1	172.6	0	0	0	0	0	115.4	A182 C183 A188	A182-G186 PolarHBondContact O-N 2.99Å; C183-G186 PolarHBondContact O-N 3.27Å; G186-A188 PolarHBondContact O-N 2.79Å; G186-A188 VanDerWaalsContact O-N 3.09Å
187	H	95.4	Very high	95.9	Very high	61 Å²	61	33.3 Å²	33.3	28%	0.282	18%	0.183	S	C	.	.			trans	-86.7	72.3	-172.7	-61.7	-54.7	0	0	0	112.3	A150 G151 G153 A182 E189 V190 V191	A150-H187 PolarHBondContact O-CD2 3.09Å; G151-H187 PolarHBondContact O-NE2 2.69Å; G153-H187 VanDerWaalsContact CA-CD2 3.47Å; G153-H187 WeakPolarHBondContact CA-CD2 3.43Å; G153-H187 PolarHBondContact N-CD2 3Å; G153-H187 VanDerWaalsContact N-CD2 3.27Å; G153-H187 PolarHBondContact N-NE2 3.43Å; A182-H187 PolarHBondContact O-N 2.86Å; H187-E189 VanDerWaalsContact C-N 3.33Å; H187-E189 PolarHBondContact O-N 2.96Å; H187-V190 HydrophobicContact CB-CB 4.04Å; H187-V190 HydrophobicContact CB-CG2 4.35Å; H187-V190 WeakPolarHBondContact O-CB 3.46Å; H187-V190 PolarHBondContact O-N 3.47Å; H187-V191 WeakPolarHBondContact O-CG2 3.37Å; H187-V191 PolarHBondContact O-N 2.66Å
188	A	93.1	Very high	95.8	Very high	27 Å²	27	35.3 Å²	35.3	22%	0.223	21%	0.205	C	C	.	.	H	α-helix	trans	-52.4	-40.7	-171.8	0	0	0	0	0	115	G186 V190 V191 S192 D222 V223	G186-A188 PolarHBondContact O-N 2.79Å; G186-A188 VanDerWaalsContact O-N 3.09Å; A188-V190 PolarHBondContact O-N 2.81Å; A188-V191 WeakPolarHBondContact O-CB 3.19Å; A188-V191 PolarHBondContact O-N 2.78Å; A188-S192 PolarHBondContact O-N 3.16Å; A188-D222 HydrophobicContact CB-CB 4.23Å; A188-V223 HydrophobicContact CB-CG2 4.2Å
189	E	93.4	Very high	95.8	Very high	124 Å²	124	35.6 Å²	35.6	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-65	-37.6	176.7	-68	-170.9	-131.2	0	0	113.2	K155 H187 L193	K155-E189 HydrophobicContact CD-CB 4.3Å; K155-E189 WeakPolarHBondContact CD-OE2 3.5Å; K155-E189 WeakPolarHBondContact CE-OE2 3.1Å; K155-E189 IonicContact NZ-OE2 3.04Å; K155-E189 PolarHBondContact NZ-OE2 2.84Å; H187-E189 VanDerWaalsContact C-N 3.33Å; H187-E189 PolarHBondContact O-N 2.96Å; E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 3.45Å
190	V	97.1	Very high	95.7	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-70.7	-40	175.1	167.1	0	0	0	0	110.6	A150 K155 V158 A182 H187 A188 L193 L194	A150-V190 HydrophobicContact CB-CG1 3.94Å; K155-V190 HydrophobicContact CB-CG2 4.22Å; V158-V190 HydrophobicContact CG1-CG1 4.42Å; V158-V190 HydrophobicContact CG2-CG1 4.15Å; V158-V190 HydrophobicContact CG2-CG2 4.42Å; A182-V190 HydrophobicContact CB-CB 4.37Å; A182-V190 HydrophobicContact CB-CG1 3.67Å; H187-V190 HydrophobicContact CB-CB 4.04Å; H187-V190 HydrophobicContact CB-CG2 4.35Å; H187-V190 WeakPolarHBondContact O-CB 3.46Å; H187-V190 PolarHBondContact O-N 3.47Å; A188-V190 PolarHBondContact O-N 2.81Å; V190-L193 PolarHBondContact O-N 2.88Å; V190-L194 HydrophobicContact CG1-CD1 3.8Å; V190-L194 HydrophobicContact CG1-CG 4.32Å; V190-L194 WeakPolarHBondContact O-CB 3.42Å; V190-L194 VanDerWaalsContact O-CG 3.26Å; V190-L194 WeakPolarHBondContact O-CG 3.24Å; V190-L194 PolarHBondContact O-N 3.04Å
191	V	97.6	Very high	95.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.5	-50.7	175	168.6	0	0	0	0	110.2	L179 A182 C183 H187 A188 L193 L194 L195 V223 V226 L227	L179-V191 HydrophobicContact CD1-CB 4.3Å; L179-V191 HydrophobicContact CD1-CG1 3.96Å; L179-V191 HydrophobicContact CD1-CG2 4.32Å; A182-V191 HydrophobicContact CB-CG2 3.68Å; C183-V191 VanDerWaalsContact SG-CG2 3.58Å; H187-V191 WeakPolarHBondContact O-CG2 3.37Å; H187-V191 PolarHBondContact O-N 2.66Å; A188-V191 WeakPolarHBondContact O-CB 3.19Å; A188-V191 PolarHBondContact O-N 2.78Å; V191-L193 PolarHBondContact O-N 3.32Å; V191-L194 PolarHBondContact O-N 2.73Å; V191-L195 HydrophobicContact CG1-CD1 3.66Å; V191-L195 WeakPolarHBondContact O-CD1 3.42Å; V191-L195 VanDerWaalsContact O-CG 3.22Å; V191-L195 WeakPolarHBondContact O-CG 3.4Å; V191-L195 PolarHBondContact O-N 3.27Å; V191-V223 HydrophobicContact CG1-CG1 4.32Å; V191-V223 HydrophobicContact CG2-CG1 4.13Å; V191-V223 HydrophobicContact CG2-CG2 4.18Å; V191-V226 HydrophobicContact CG1-CB 4.45Å; V191-V226 HydrophobicContact CG1-CG1 3.9Å; V191-L227 HydrophobicContact CG1-CD2 4.28Å; V191-L227 HydrophobicContact CG1-CG 4.32Å
192	S	96	Very high	95.8	Very high	43 Å²	43	40.3 Å²	40.3	30%	0.301	23%	0.233	S	C	.	.	H	α-helix	trans	-59.6	-45.6	176.4	-178.9	0	0	0	0	112.1	A188 L194 L195 C196	A188-S192 PolarHBondContact O-N 3.16Å; S192-L194 PolarHBondContact O-N 3.24Å; S192-L195 PolarHBondContact O-N 3.02Å; S192-C196 WeakPolarHBondContact O-CB 3.41Å; S192-C196 PolarHBondContact O-N 2.93Å; S192-C196 PolarHBondContact O-SG 3.08Å; S192-C196 VanDerWaalsContact O-SG 3.32Å
193	L	96.9	Very high	95.8	Very high	30 Å²	30	40.5 Å²	40.5	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-44.8	177	177.1	60.3	0	0	0	112.6	K155 V158 E159 L162 E189 V190 V191 C196 Q197	K155-L193 HydrophobicContact CG-CD2 4.32Å; V158-L193 HydrophobicContact CB-CD2 4.26Å; V158-L193 HydrophobicContact CG1-CD2 3.76Å; V158-L193 HydrophobicContact CG1-CG 4.38Å; E159-L193 HydrophobicContact CB-CD2 3.94Å; L162-L193 HydrophobicContact CD1-CG 4.32Å; E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 3.45Å; V190-L193 PolarHBondContact O-N 2.88Å; V191-L193 PolarHBondContact O-N 3.32Å; L193-C196 PolarHBondContact O-N 2.67Å; L193-Q197 HydrophobicContact CD1-CG 4.39Å; L193-Q197 VanDerWaalsContact O-CG 3.31Å; L193-Q197 WeakPolarHBondContact O-CG 3.46Å; L193-Q197 PolarHBondContact O-N 2.86Å; L193-Q197 VanDerWaalsContact O-N 3.09Å
194	L	97.4	Very high	95.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-42.3	178.3	-71.1	168	0	0	0	111.7	L146 A150 V158 L162 V168 P178 L179 A182 V190 V191 S192 Q197 G198 A199	L146-L194 HydrophobicContact CD1-CD2 4.28Å; L146-L194 HydrophobicContact CD2-CD2 4.37Å; L146-L194 HydrophobicContact CG-CD2 4.49Å; A150-L194 HydrophobicContact CB-CD1 4.06Å; V158-L194 HydrophobicContact CG1-CD2 4.08Å; V158-L194 HydrophobicContact CG1-CG 4.36Å; L162-L194 HydrophobicContact CD1-CD2 4.07Å; V168-L194 HydrophobicContact CG2-CB 4.45Å; V168-L194 HydrophobicContact CG2-CD2 3.84Å; P178-L194 HydrophobicContact CB-CD1 4.41Å; L179-L194 HydrophobicContact CB-CD1 4.46Å; L179-L194 HydrophobicContact CD1-CB 4.14Å; L179-L194 HydrophobicContact CD1-CD1 4.3Å; A182-L194 HydrophobicContact CB-CD1 4.22Å; V190-L194 HydrophobicContact CG1-CD1 3.8Å; V190-L194 HydrophobicContact CG1-CG 4.32Å; V190-L194 WeakPolarHBondContact O-CB 3.42Å; V190-L194 VanDerWaalsContact O-CG 3.26Å; V190-L194 WeakPolarHBondContact O-CG 3.24Å; V190-L194 PolarHBondContact O-N 3.04Å; V191-L194 PolarHBondContact O-N 2.73Å; S192-L194 PolarHBondContact O-N 3.24Å; L194-Q197 CarbonylContact O-C 3.6Å; L194-Q197 PolarHBondContact O-N 2.98Å; L194-Q197 VanDerWaalsContact O-N 3.15Å; L194-G198 PolarHBondContact O-N 3.13Å; L194-A199 HydrophobicContact CB-CB 4.06Å; L194-A199 WeakPolarHBondContact O-CB 3.19Å; L194-A199 PolarHBondContact O-N 3.48Å
195	L	96.9	Very high	95.8	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.073	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-41.8	177.3	-67.9	160.9	0	0	0	111.9	L179 V191 S192 Q197 G198 P201 V226 L227 H230	L179-L195 HydrophobicContact CD1-CD2 4.43Å; L179-L195 HydrophobicContact CD1-CG 4.16Å; L179-L195 HydrophobicContact CD2-CD2 3.75Å; L179-L195 HydrophobicContact CD2-CG 4.37Å; V191-L195 HydrophobicContact CG1-CD1 3.66Å; V191-L195 WeakPolarHBondContact O-CD1 3.42Å; V191-L195 VanDerWaalsContact O-CG 3.22Å; V191-L195 WeakPolarHBondContact O-CG 3.4Å; V191-L195 PolarHBondContact O-N 3.27Å; S192-L195 PolarHBondContact O-N 3.02Å; L195-Q197 PolarHBondContact O-N 3.19Å; L195-G198 PolarHBondContact O-N 3.3Å; L195-P201 HydrophobicContact CD2-CB 3.79Å; L195-P201 HydrophobicContact CD2-CG 4.39Å; L195-V226 HydrophobicContact CD1-CG1 3.85Å; L195-L227 HydrophobicContact CD1-CD2 4.24Å; L195-L227 HydrophobicContact CD2-CD2 4.46Å; L195-H230 HydrophobicContact CB-CB 4.26Å; L195-H230 HydrophobicContact CD1-CB 3.87Å; L195-H230 HydrophobicContact CD2-CB 4.11Å; L195-H230 HydrophobicContact CG-CB 4.31Å
196	C	95.6	Very high	96	Very high	85 Å²	85	44 Å²	44	57%	0.574	25%	0.249	S	C	*	.	H	α-helix	trans	-63.3	-25.2	172.6	-72.4	0	0	0	0	113.2	S192 L193 G198	S192-C196 WeakPolarHBondContact O-CB 3.41Å; S192-C196 PolarHBondContact O-N 2.93Å; S192-C196 PolarHBondContact O-SG 3.08Å; S192-C196 VanDerWaalsContact O-SG 3.32Å; L193-C196 PolarHBondContact O-N 2.67Å; C196-G198 VanDerWaalsContact C-N 3.3Å
197	Q	96	Very high	96.1	Very high	113 Å²	113	49.5 Å²	49.5	53%	0.528	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	18.9	173.5	-65.2	-67.4	-28.9	0	0	112.7	L162 L193 L194 L195	L162-Q197 HydrophobicContact CD1-CB 4.27Å; L162-Q197 HydrophobicContact CD1-CG 4.03Å; L193-Q197 HydrophobicContact CD1-CG 4.39Å; L193-Q197 VanDerWaalsContact O-CG 3.31Å; L193-Q197 WeakPolarHBondContact O-CG 3.46Å; L193-Q197 PolarHBondContact O-N 2.86Å; L193-Q197 VanDerWaalsContact O-N 3.09Å; L194-Q197 CarbonylContact O-C 3.6Å; L194-Q197 PolarHBondContact O-N 2.98Å; L194-Q197 VanDerWaalsContact O-N 3.15Å; L195-Q197 PolarHBondContact O-N 3.19Å
198	G	95.1	Very high	96.1	Very high	45 Å²	45	49.8 Å²	49.8	46%	0.464	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	9.3	170.3	0	0	0	0	0	116	H169 L194 L195 C196 D200	H169-G198 PolarHBondContact CE1-O 2.84Å; L194-G198 PolarHBondContact O-N 3.13Å; L195-G198 PolarHBondContact O-N 3.3Å; C196-G198 VanDerWaalsContact C-N 3.3Å; G198-D200 PolarHBondContact O-N 2.57Å
199	A	96.7	Very high	96.3	Very high	5 Å²	5	50.5 Å²	50.5	4%	0.041	26%	0.262	C	S	.	.			trans	-56.1	132.1	173.6	0	0	0	0	0	111.2	V168 L179 L194 P201	V168-A199 HydrophobicContact CG2-CB 3.64Å; L179-A199 HydrophobicContact CB-CB 4.37Å; L179-A199 HydrophobicContact CD2-CB 3.91Å; L194-A199 HydrophobicContact CB-CB 4.06Å; L194-A199 WeakPolarHBondContact O-CB 3.19Å; L194-A199 PolarHBondContact O-N 3.48Å; A199-P201 VanDerWaalsContact O-CD 3.28Å; A199-P201 WeakPolarHBondContact O-CD 3.47Å
200	D	96.5	Very high	96.5	Very high	68 Å²	68	44.6 Å²	44.6	36%	0.364	24%	0.235	S	C	.	.			trans	-74.1	113.9	177.6	172.1	16.5	0	0	0	110.5	G198 N202 A203	G198-D200 PolarHBondContact O-N 2.57Å; D200-N202 PolarHBondContact O-N 3.14Å; D200-N202 WeakPolarHBondContact OD1-CA 3.41Å; D200-N202 WeakPolarHBondContact OD1-CB 3.19Å; D200-N202 PolarHBondContact OD1-N 3.19Å; D200-A203 HydrophobicContact CB-CB 4.13Å; D200-A203 VanDerWaalsContact CG-N 3.34Å; D200-A203 WeakPolarHBondContact O-CB 3.36Å; D200-A203 PolarHBondContact O-N 3.12Å; D200-A203 PolarHBondContact OD1-N 3.2Å; D200-A203 WeakPolarHBondContact OD2-CA 3.23Å; D200-A203 PolarHBondContact OD2-N 3.5Å
201	P	96.9	Very high	96.6	Very high	16 Å²	16	44.4 Å²	44.4	10%	0.104	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	178.6	29.5	-36.5	0	0	0	113.3	L195 A199 P211 L227 A232	L195-P201 HydrophobicContact CD2-CB 3.79Å; L195-P201 HydrophobicContact CD2-CG 4.39Å; A199-P201 VanDerWaalsContact O-CD 3.28Å; A199-P201 WeakPolarHBondContact O-CD 3.47Å; P201-P211 WeakPolarHBondContact O-CD 3.2Å; P201-L227 HydrophobicContact CB-CD2 4.36Å; P201-A232 HydrophobicContact CB-CB 4.02Å
202	N	97.6	Very high	96.6	Very high	38 Å²	38	44.5 Å²	44.5	20%	0.203	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	9.6	-178.8	-64.8	-54.4	0	0	0	112.8	D200 R204 G231 A232 D233 I236	D200-N202 PolarHBondContact O-N 3.14Å; D200-N202 WeakPolarHBondContact OD1-CA 3.41Å; D200-N202 WeakPolarHBondContact OD1-CB 3.19Å; D200-N202 PolarHBondContact OD1-N 3.19Å; N202-R204 PolarHBondContact O-N 3.4Å; N202-G231 PolarHBondContact ND2-O 3.12Å; N202-A232 WeakPolarHBondContact OD1-CA 3.44Å; N202-D233 PolarHBondContact OD1-N 3.2Å; N202-I236 HydrophobicContact CB-CD1 3.78Å; N202-I236 WeakPolarHBondContact OD1-CD1 3.44Å
203	A	96.9	Very high	96.6	Very high	5 Å²	5	42.5 Å²	42.5	4%	0.041	22%	0.22	C	C	.	.			trans	-54.6	130.1	178.8	0	0	0	0	0	111.2	I177 H180 D200 T210 P211	I177-A203 HydrophobicContact CD1-CB 3.63Å; I177-A203 HydrophobicContact CG1-CB 4.05Å; H180-A203 WeakPolarHBondContact CE1-CB 3.2Å; H180-A203 PolarHBondContact CE1-O 2.98Å; H180-A203 PolarHBondContact NE2-O 3.45Å; D200-A203 HydrophobicContact CB-CB 4.13Å; D200-A203 VanDerWaalsContact CG-N 3.34Å; D200-A203 WeakPolarHBondContact O-CB 3.36Å; D200-A203 PolarHBondContact O-N 3.12Å; D200-A203 PolarHBondContact OD1-N 3.2Å; D200-A203 WeakPolarHBondContact OD2-CA 3.23Å; D200-A203 PolarHBondContact OD2-N 3.5Å; A203-T210 WeakPolarHBondContact O-CA 3.39Å; A203-P211 WeakPolarHBondContact O-CD 3.07Å
204	R	96.4	Very high	96.6	Very high	113 Å²	113	42.7 Å²	42.7	43%	0.426	22%	0.22	S	C	.	.			trans	-101.3	128.4	-179.7	-67.2	-173.3	-171.3	99.6	6.8	111.6	R171 N202 N208 T210	R171-R204 PolarHBondContact NH1-O 3.18Å; R171-R204 PolarHBondContact NH2-O 3.24Å; N202-R204 PolarHBondContact O-N 3.4Å; R204-N208 WeakPolarHBondContact CD-OD1 3.31Å; R204-T210 HydrophobicContact CG-CG2 4.26Å
205	D	95.2	Very high	96.6	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.053	22%	0.22	C	C	.	.			trans	-76.2	-172.6	168.2	82.1	-10.5	0	0	0	111.7	L176 H180 W207 N208 Y209	L176-D205 HydrophobicContact CD2-CB 3.84Å; L176-D205 HydrophobicContact CG-CB 4.11Å; H180-D205 PolarHBondContact NE2-N 3.16Å; D205-W207 PolarHBondContact O-N 3.17Å; D205-W207 WeakPolarHBondContact OD1-CA 3.45Å; D205-W207 PolarHBondContact OD1-N 3.35Å; D205-N208 PolarHBondContact O-N 2.98Å; D205-N208 VanDerWaalsContact O-N 3.16Å; D205-N208 PolarHBondContact OD1-N 3.28Å; D205-N208 VanDerWaalsContact OD1-N 3.08Å; D205-Y209 PolarHBondContact N-O 3.21Å; D205-Y209 VanDerWaalsContact N-O 3.11Å; D205-Y209 PolarHBondContact OD1-N 2.88Å
206	N	95.6	Very high	96.6	Very high	97 Å²	97	42 Å²	42	52%	0.519	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.9	-178.1	-66.5	-10.9	0	0	0	114.4	D173 G174 G175	D173-N206 PolarHBondContact O-ND2 3.23Å; G174-N206 VanDerWaalsContact C-CG 3.46Å; G174-N206 VanDerWaalsContact C-ND2 3.26Å; G174-N206 WeakPolarHBondContact O-CB 3.47Å; G174-N206 PolarHBondContact O-N 3.11Å; G174-N206 PolarHBondContact O-ND2 2.82Å; G175-N206 WeakPolarHBondContact CA-OD1 3.19Å
207	W	96.1	Very high	96.6	Very high	142 Å²	142	40.6 Å²	40.6	54%	0.538	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	15.4	176.8	-60.6	-82.6	0	0	0	112.4	D205 Y209 T239	D205-W207 PolarHBondContact O-N 3.17Å; D205-W207 WeakPolarHBondContact OD1-CA 3.45Å; D205-W207 PolarHBondContact OD1-N 3.35Å; W207-Y209 HydrophobicContact CB-CD2 3.66Å; W207-Y209 HydrophobicContact CB-CE2 3.96Å; W207-Y209 WeakPolarHBondContact O-CD2 3.48Å; W207-Y209 PolarHBondContact O-N 2.93Å; W207-T239 WeakPolarHBondContact O-CG2 3.4Å; W207-T239 PolarHBondContact O-N 3.18Å; W207-T239 PolarHBondContact O-OG1 3.36Å
208	N	95.3	Very high	96.6	Very high	67 Å²	67	40.4 Å²	40.4	36%	0.358	20%	0.2	S	C	.	.			trans	58.8	20	-174.2	-69.6	-34.7	0	0	0	114.9	R204 D205 T239	R204-N208 WeakPolarHBondContact CD-OD1 3.31Å; D205-N208 PolarHBondContact O-N 2.98Å; D205-N208 VanDerWaalsContact O-N 3.16Å; D205-N208 PolarHBondContact OD1-N 3.28Å; D205-N208 VanDerWaalsContact OD1-N 3.08Å; N208-T239 HydrophobicContact CB-CG2 4.47Å
209	Y	97.3	Very high	96.6	Very high	42 Å²	42	39.1 Å²	39.1	17%	0.165	19%	0.187	C	C	.	.			trans	-72.6	136.9	169.5	-76.8	-116.9	0	0	0	109.5	H180 D205 W207 H213 I217 N238 L247	H180-Y209 PolarHBondContact NE2-O 3.04Å; D205-Y209 PolarHBondContact N-O 3.21Å; D205-Y209 VanDerWaalsContact N-O 3.11Å; D205-Y209 PolarHBondContact OD1-N 2.88Å; W207-Y209 HydrophobicContact CB-CD2 3.66Å; W207-Y209 HydrophobicContact CB-CE2 3.96Å; W207-Y209 WeakPolarHBondContact O-CD2 3.48Å; W207-Y209 PolarHBondContact O-N 2.93Å; Y209-H213 HydrophobicContact CD1-CB 3.67Å; Y209-H213 HydrophobicContact CE1-CB 4.45Å; Y209-H213 HydrophobicContact CG-CB 4.29Å; Y209-I217 HydrophobicContact CD1-CD1 4.11Å; Y209-I217 HydrophobicContact CE1-CD1 3.57Å; Y209-N238 HydrophobicContact CD2-CB 3.85Å; Y209-N238 HydrophobicContact CE2-CB 3.8Å; Y209-N238 WeakPolarHBondContact CE2-ND2 3.18Å; Y209-N238 HydrophobicContact CG-CB 4.47Å; Y209-N238 PolarHBondContact OH-ND2 3.5Å; Y209-N238 VanDerWaalsContact OH-ND2 3.09Å; Y209-L247 HydrophobicContact CE1-CD1 4.15Å
210	T	97.9	Very high	96.5	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.199	C	C	.	.			trans	-100.5	163.2	171.9	69.5	0	0	0	0	110.5	H180 A203 R204 L212 H213 E214 I236	H180-T210 WeakPolarHBondContact NE2-CA 3.26Å; H180-T210 PolarHBondContact NE2-N 3.02Å; A203-T210 WeakPolarHBondContact O-CA 3.39Å; R204-T210 HydrophobicContact CG-CG2 4.26Å; T210-L212 PolarHBondContact O-N 3.23Å; T210-L212 PolarHBondContact OG1-N 3.34Å; T210-H213 PolarHBondContact N-ND1 3.1Å; T210-H213 WeakPolarHBondContact O-CB 3.41Å; T210-H213 PolarHBondContact O-N 3.13Å; T210-H213 PolarHBondContact OG1-ND1 2.86Å; T210-E214 PolarHBondContact O-N 3.4Å; T210-I236 HydrophobicContact CG2-CB 4.24Å; T210-I236 HydrophobicContact CG2-CD1 4.01Å; T210-I236 HydrophobicContact CG2-CG2 3.77Å
211	P	98	Very high	96.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-52.3	-29.2	172.8	-27.1	34.2	0	0	0	113.7	L179 C183 P201 A203 A215 L227	L179-P211 HydrophobicContact CB-CG 4.39Å; L179-P211 HydrophobicContact CD2-CB 4.15Å; L179-P211 HydrophobicContact CD2-CG 3.78Å; L179-P211 HydrophobicContact CG-CB 3.99Å; L179-P211 HydrophobicContact CG-CG 3.9Å; C183-P211 HydrophobicContact CB-CB 4.23Å; C183-P211 WeakPolarHBondContact CB-O 3.45Å; P201-P211 WeakPolarHBondContact O-CD 3.2Å; A203-P211 WeakPolarHBondContact O-CD 3.07Å; P211-A215 WeakPolarHBondContact O-CB 3.11Å; P211-A215 PolarHBondContact O-N 2.95Å; P211-L227 HydrophobicContact CB-CD1 4.19Å; P211-L227 HydrophobicContact CB-CD2 3.99Å
212	L	97.7	Very high	96.3	Very high	1 Å²	1	45 Å²	45	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-72.3	-33.2	175.5	-171.3	61.8	0	0	0	113.2	T210 A216 C224 L227 L228 A232 P234 A244 L256	T210-L212 PolarHBondContact O-N 3.23Å; T210-L212 PolarHBondContact OG1-N 3.34Å; L212-A216 WeakPolarHBondContact O-CB 3.31Å; L212-A216 PolarHBondContact O-N 3.23Å; L212-C224 HydrophobicContact CD1-CB 4.14Å; L212-L227 HydrophobicContact CB-CD1 4.07Å; L212-L227 HydrophobicContact CD1-CB 4.09Å; L212-L227 HydrophobicContact CD1-CD1 3.96Å; L212-L228 HydrophobicContact CD2-CD2 4.04Å; L212-A232 HydrophobicContact CB-CB 4.27Å; L212-A232 HydrophobicContact CD2-CB 3.93Å; L212-P234 HydrophobicContact CD2-CB 4.1Å; L212-A244 HydrophobicContact CD2-CB 4.39Å; L212-A244 HydrophobicContact CG-CB 4.05Å; L212-L256 HydrophobicContact CD1-CD2 4.09Å; L212-L256 HydrophobicContact CD2-CD2 4.05Å; L212-L256 HydrophobicContact CG-CD2 4.23Å
213	H	97.4	Very high	96.2	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-47.5	171.7	-70.6	77.9	0	0	0	110.6	Y209 T210 A216 I217 I236 K242 A244	Y209-H213 HydrophobicContact CD1-CB 3.67Å; Y209-H213 HydrophobicContact CE1-CB 4.45Å; Y209-H213 HydrophobicContact CG-CB 4.29Å; T210-H213 PolarHBondContact N-ND1 3.1Å; T210-H213 WeakPolarHBondContact O-CB 3.41Å; T210-H213 PolarHBondContact O-N 3.13Å; T210-H213 PolarHBondContact OG1-ND1 2.86Å; H213-A216 PolarHBondContact O-N 2.86Å; H213-I217 WeakPolarHBondContact O-CB 3.46Å; H213-I217 WeakPolarHBondContact O-CD1 3.41Å; H213-I217 VanDerWaalsContact O-CG1 3.25Å; H213-I217 WeakPolarHBondContact O-CG1 3.41Å; H213-I217 PolarHBondContact O-N 3.23Å; H213-I236 PolarHBondContact CE1-O 3.08Å; H213-I236 PolarHBondContact NE2-O 3.48Å; H213-K242 PolarHBondContact NE2-O 3.15Å; H213-A244 PolarHBondContact NE2-N 3.1Å
214	E	96.1	Very high	96.2	Very high	35 Å²	35	43 Å²	43	16%	0.164	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-50.6	176.4	-80.5	-61.8	138.7	0	0	111.8	S184 T210 A216 I217 K218	S184-E214 VanDerWaalsContact CB-OE2 3.22Å; S184-E214 WeakPolarHBondContact CB-OE2 3.25Å; S184-E214 PolarHBondContact OG-OE2 2.99Å; T210-E214 PolarHBondContact O-N 3.4Å; E214-A216 VanDerWaalsContact C-N 3.33Å; E214-A216 PolarHBondContact O-N 2.96Å; E214-I217 PolarHBondContact O-N 3.01Å; E214-K218 WeakPolarHBondContact O-CB 3.39Å; E214-K218 WeakPolarHBondContact O-CG 3.4Å; E214-K218 PolarHBondContact O-N 2.88Å; E214-K218 VanDerWaalsContact O-N 3.14Å
215	A	97.3	Very high	96.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-42	178.1	0	0	0	0	0	112.6	C183 P211 K218 G219 K220 V223 C224 L227	C183-A215 HydrophobicContact CB-CB 4.32Å; P211-A215 WeakPolarHBondContact O-CB 3.11Å; P211-A215 PolarHBondContact O-N 2.95Å; A215-K218 PolarHBondContact O-N 3.49Å; A215-G219 PolarHBondContact O-N 2.82Å; A215-K220 HydrophobicContact CB-CB 4.32Å; A215-K220 PolarHBondContact O-N 3.23Å; A215-V223 HydrophobicContact CB-CB 4.17Å; A215-V223 HydrophobicContact CB-CG1 3.52Å; A215-C224 VanDerWaalsContact CB-SG 3.59Å; A215-L227 HydrophobicContact CB-CD1 4Å
216	A	96.9	Very high	96.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-46	-178.9	0	0	0	0	0	112.7	L212 H213 E214 K218 G219 A244 A248 D249 L256	L212-A216 WeakPolarHBondContact O-CB 3.31Å; L212-A216 PolarHBondContact O-N 3.23Å; H213-A216 PolarHBondContact O-N 2.86Å; E214-A216 VanDerWaalsContact C-N 3.33Å; E214-A216 PolarHBondContact O-N 2.96Å; A216-K218 VanDerWaalsContact C-N 3.26Å; A216-K218 PolarHBondContact O-N 3.08Å; A216-G219 PolarHBondContact O-N 3.08Å; A216-A244 HydrophobicContact CB-CB 4.3Å; A216-A244 WeakPolarHBondContact CB-O 3.41Å; A216-A248 HydrophobicContact CB-CB 4.06Å; A216-D249 PolarHBondContact O-N 3.09Å; A216-L256 HydrophobicContact CB-CD1 3.82Å
217	I	96.1	Very high	96.3	Very high	54 Å²	54	33.9 Å²	33.9	28%	0.277	16%	0.162	S	C	.	.	H	α-helix	trans	-62.6	-35.3	178	-70.9	161.3	0	0	0	111.4	Y209 H213 E214 L247	Y209-I217 HydrophobicContact CD1-CD1 4.11Å; Y209-I217 HydrophobicContact CE1-CD1 3.57Å; H213-I217 WeakPolarHBondContact O-CB 3.46Å; H213-I217 WeakPolarHBondContact O-CD1 3.41Å; H213-I217 VanDerWaalsContact O-CG1 3.25Å; H213-I217 WeakPolarHBondContact O-CG1 3.41Å; H213-I217 PolarHBondContact O-N 3.23Å; E214-I217 PolarHBondContact O-N 3.01Å; I217-L247 HydrophobicContact CD1-CB 4.04Å; I217-L247 HydrophobicContact CD1-CD1 4.32Å; I217-L247 HydrophobicContact CG1-CB 3.73Å; I217-L247 WeakPolarHBondContact CG1-O 3.28Å
218	K	94.9	Very high	96.2	Very high	110 Å²	110	27.3 Å²	27.3	48%	0.478	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.2	-177.3	-55.2	-64.6	-177.8	-170.3	0	113.6	S184 E214 A215 A216 K220	S184-K218 WeakPolarHBondContact O-CB 3.36Å; S184-K218 WeakPolarHBondContact O-CG 3.29Å; S184-K218 WeakPolarHBondContact OG-CE 3.38Å; E214-K218 WeakPolarHBondContact O-CB 3.39Å; E214-K218 WeakPolarHBondContact O-CG 3.4Å; E214-K218 PolarHBondContact O-N 2.88Å; E214-K218 VanDerWaalsContact O-N 3.14Å; A215-K218 PolarHBondContact O-N 3.49Å; A216-K218 VanDerWaalsContact C-N 3.26Å; A216-K218 PolarHBondContact O-N 3.08Å; K218-K220 VanDerWaalsContact C-N 3.32Å; K218-K220 HydrophobicContact CB-CD 4.38Å; K218-K220 HydrophobicContact CB-CG 3.85Å; K218-K220 WeakPolarHBondContact O-CD 3.44Å; K218-K220 VanDerWaalsContact O-CE 3.3Å; K218-K220 WeakPolarHBondContact O-CE 3.27Å; K218-K220 PolarHBondContact O-N 3.27Å
219	G	94.8	Very high	96.1	Very high	18 Å²	18	26.5 Å²	26.5	19%	0.186	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	26.6	177.5	0	0	0	0	0	114.8	A215 A216 I221	A215-G219 PolarHBondContact O-N 2.82Å; A216-G219 PolarHBondContact O-N 3.08Å; G219-I221 PolarHBondContact O-N 3.03Å
220	K	95.4	Very high	96	Very high	69 Å²	69	28 Å²	28	30%	0.3	14%	0.14	S	C	.	.			trans	-87.5	72.2	-171.9	-53.5	-56.8	-178.4	160.7	0	111.6	S184 F185 A215 K218 D222 V223 C224	S184-K220 WeakPolarHBondContact O-CE 3.39Å; F185-K220 WeakPolarHBondContact O-CE 3.18Å; F185-K220 PolarHBondContact O-NZ 3.31Å; A215-K220 HydrophobicContact CB-CB 4.32Å; A215-K220 PolarHBondContact O-N 3.23Å; K218-K220 VanDerWaalsContact C-N 3.32Å; K218-K220 HydrophobicContact CB-CD 4.38Å; K218-K220 HydrophobicContact CB-CG 3.85Å; K218-K220 WeakPolarHBondContact O-CD 3.44Å; K218-K220 VanDerWaalsContact O-CE 3.3Å; K218-K220 WeakPolarHBondContact O-CE 3.27Å; K218-K220 PolarHBondContact O-N 3.27Å; K220-D222 PolarHBondContact O-N 3.01Å; K220-V223 HydrophobicContact CB-CB 3.94Å; K220-V223 HydrophobicContact CB-CG2 4.22Å; K220-V223 WeakPolarHBondContact O-CB 3.47Å; K220-V223 PolarHBondContact O-N 2.87Å; K220-V223 VanDerWaalsContact O-N 3.1Å; K220-C224 PolarHBondContact O-N 3.14Å; K220-C224 PolarHBondContact O-SG 2.58Å
221	I	94.9	Very high	95.8	Very high	35 Å²	35	30.2 Å²	30.2	18%	0.179	16%	0.162	C	C	.	.	H	α-helix	trans	-42.6	-58	-177.5	-62.5	171.9	0	0	0	112.6	G219 V223 C224 I225 V255 Y260	G219-I221 PolarHBondContact O-N 3.03Å; I221-V223 VanDerWaalsContact C-N 3.29Å; I221-V223 PolarHBondContact O-N 3.3Å; I221-C224 WeakPolarHBondContact O-CB 3.35Å; I221-C224 PolarHBondContact O-N 3.12Å; I221-C224 VanDerWaalsContact O-N 3.09Å; I221-I225 HydrophobicContact CG2-CD1 4.07Å; I221-I225 WeakPolarHBondContact O-CG1 3.48Å; I221-I225 PolarHBondContact O-N 3.42Å; I221-V255 HydrophobicContact CG2-CG2 3.89Å; I221-Y260 HydrophobicContact CD1-CE2 3.93Å; I221-Y260 HydrophobicContact CG2-CD1 4.4Å; I221-Y260 HydrophobicContact CG2-CD2 4.41Å; I221-Y260 HydrophobicContact CG2-CE1 3.82Å; I221-Y260 HydrophobicContact CG2-CE2 3.84Å
222	D	94.2	Very high	95.7	Very high	107 Å²	107	30.5 Å²	30.5	57%	0.572	17%	0.165	S	C	*	.	H	α-helix	trans	-64.9	-35.3	-173.5	-50.1	-38.4	0	0	0	111.8	A188 K220 I225 V226	A188-D222 HydrophobicContact CB-CB 4.23Å; K220-D222 PolarHBondContact O-N 3.01Å; D222-I225 PolarHBondContact O-N 3.29Å; D222-V226 WeakPolarHBondContact O-CG2 3.06Å; D222-V226 PolarHBondContact O-N 3.25Å
223	V	96.4	Very high	95.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-67.5	-42.5	173.5	171	0	0	0	0	111.2	C183 A188 V191 A215 K220 I221 I225 V226 L227	C183-V223 HydrophobicContact CB-CG1 3.81Å; C183-V223 VanDerWaalsContact SG-CG1 3.55Å; A188-V223 HydrophobicContact CB-CG2 4.2Å; V191-V223 HydrophobicContact CG1-CG1 4.32Å; V191-V223 HydrophobicContact CG2-CG1 4.13Å; V191-V223 HydrophobicContact CG2-CG2 4.18Å; A215-V223 HydrophobicContact CB-CB 4.17Å; A215-V223 HydrophobicContact CB-CG1 3.52Å; K220-V223 HydrophobicContact CB-CB 3.94Å; K220-V223 HydrophobicContact CB-CG2 4.22Å; K220-V223 WeakPolarHBondContact O-CB 3.47Å; K220-V223 PolarHBondContact O-N 2.87Å; K220-V223 VanDerWaalsContact O-N 3.1Å; I221-V223 VanDerWaalsContact C-N 3.29Å; I221-V223 PolarHBondContact O-N 3.3Å; V223-I225 VanDerWaalsContact C-N 3.28Å; V223-I225 PolarHBondContact O-N 3.22Å; V223-V226 PolarHBondContact O-N 2.78Å; V223-L227 HydrophobicContact CG1-CD1 3.8Å; V223-L227 HydrophobicContact CG1-CG 4.2Å; V223-L227 WeakPolarHBondContact O-CB 3.4Å; V223-L227 VanDerWaalsContact O-CG 3.3Å; V223-L227 WeakPolarHBondContact O-CG 3.28Å; V223-L227 PolarHBondContact O-N 2.97Å
224	C	96.7	Very high	95.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-40.7	175.1	-67.1	0	0	0	0	111.4	L212 A215 K220 I221 L228 V255	L212-C224 HydrophobicContact CD1-CB 4.14Å; A215-C224 VanDerWaalsContact CB-SG 3.59Å; K220-C224 PolarHBondContact O-N 3.14Å; K220-C224 PolarHBondContact O-SG 2.58Å; I221-C224 WeakPolarHBondContact O-CB 3.35Å; I221-C224 PolarHBondContact O-N 3.12Å; I221-C224 VanDerWaalsContact O-N 3.09Å; C224-L228 WeakPolarHBondContact O-CB 3.47Å; C224-L228 WeakPolarHBondContact O-CD1 3.35Å; C224-L228 WeakPolarHBondContact O-CG 3.47Å; C224-L228 PolarHBondContact O-N 3.17Å; C224-V255 HydrophobicContact CB-CB 4.5Å; C224-V255 HydrophobicContact CB-CG1 4.11Å
225	I	95.3	Very high	95.4	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-52.9	175.9	-66.8	170.9	0	0	0	110.4	I221 D222 V223 L227 L228 Q229 V255 Y260 T282	I221-I225 HydrophobicContact CG2-CD1 4.07Å; I221-I225 WeakPolarHBondContact O-CG1 3.48Å; I221-I225 PolarHBondContact O-N 3.42Å; D222-I225 PolarHBondContact O-N 3.29Å; V223-I225 VanDerWaalsContact C-N 3.28Å; V223-I225 PolarHBondContact O-N 3.22Å; I225-L227 PolarHBondContact O-N 3.15Å; I225-L228 PolarHBondContact O-N 3.03Å; I225-Q229 HydrophobicContact CG2-CG 4.37Å; I225-Q229 VanDerWaalsContact O-CG 3.31Å; I225-Q229 WeakPolarHBondContact O-CG 3.36Å; I225-Q229 PolarHBondContact O-N 3.31Å; I225-V255 HydrophobicContact CG1-CG1 3.73Å; I225-V255 HydrophobicContact CG1-CG2 4.47Å; I225-Y260 HydrophobicContact CD1-CD1 4.17Å; I225-Y260 HydrophobicContact CD1-CE1 4.11Å; I225-T282 HydrophobicContact CB-CG2 4.33Å; I225-T282 HydrophobicContact CG1-CG2 4.24Å; I225-T282 HydrophobicContact CG2-CG2 4Å
226	V	96.2	Very high	95.3	Very high	22 Å²	22	38.9 Å²	38.9	13%	0.133	21%	0.212	C	C	.	.	H	α-helix	trans	-60	-43.2	179.8	173	0	0	0	0	111.8	V191 L195 D222 V223 L228 Q229 H230	V191-V226 HydrophobicContact CG1-CB 4.45Å; V191-V226 HydrophobicContact CG1-CG1 3.9Å; L195-V226 HydrophobicContact CD1-CG1 3.85Å; D222-V226 WeakPolarHBondContact O-CG2 3.06Å; D222-V226 PolarHBondContact O-N 3.25Å; V223-V226 PolarHBondContact O-N 2.78Å; V226-L228 PolarHBondContact O-N 2.96Å; V226-Q229 PolarHBondContact O-N 3.49Å; V226-H230 PolarHBondContact O-CD2 3.37Å; V226-H230 VanDerWaalsContact O-CD2 3.29Å; V226-H230 PolarHBondContact O-N 3.3Å
227	L	96.9	Very high	95.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-45.4	176.7	-76.7	171.8	0	0	0	112.2	L179 V191 L195 P201 P211 L212 A215 V223 I225 H230 G231 A232	L179-L227 HydrophobicContact CD2-CD2 4.35Å; V191-L227 HydrophobicContact CG1-CD2 4.28Å; V191-L227 HydrophobicContact CG1-CG 4.32Å; L195-L227 HydrophobicContact CD1-CD2 4.24Å; L195-L227 HydrophobicContact CD2-CD2 4.46Å; P201-L227 HydrophobicContact CB-CD2 4.36Å; P211-L227 HydrophobicContact CB-CD1 4.19Å; P211-L227 HydrophobicContact CB-CD2 3.99Å; L212-L227 HydrophobicContact CB-CD1 4.07Å; L212-L227 HydrophobicContact CD1-CB 4.09Å; L212-L227 HydrophobicContact CD1-CD1 3.96Å; A215-L227 HydrophobicContact CB-CD1 4Å; V223-L227 HydrophobicContact CG1-CD1 3.8Å; V223-L227 HydrophobicContact CG1-CG 4.2Å; V223-L227 WeakPolarHBondContact O-CB 3.4Å; V223-L227 VanDerWaalsContact O-CG 3.3Å; V223-L227 WeakPolarHBondContact O-CG 3.28Å; V223-L227 PolarHBondContact O-N 2.97Å; I225-L227 PolarHBondContact O-N 3.15Å; L227-H230 CarbonylContact O-C 3.6Å; L227-H230 PolarHBondContact O-N 3.46Å; L227-G231 PolarHBondContact O-N 3.1Å; L227-A232 HydrophobicContact CB-CB 3.87Å; L227-A232 WeakPolarHBondContact O-CB 3.39Å; L227-A232 PolarHBondContact O-N 2.91Å
228	L	95.3	Very high	95.3	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-38.8	176.8	-71.4	169.4	0	0	0	112	L212 C224 I225 V226 H230 G231 P234 V255 L256 T282 P283 L284	L212-L228 HydrophobicContact CD2-CD2 4.04Å; C224-L228 WeakPolarHBondContact O-CB 3.47Å; C224-L228 WeakPolarHBondContact O-CD1 3.35Å; C224-L228 WeakPolarHBondContact O-CG 3.47Å; C224-L228 PolarHBondContact O-N 3.17Å; I225-L228 PolarHBondContact O-N 3.03Å; V226-L228 PolarHBondContact O-N 2.96Å; L228-H230 VanDerWaalsContact C-N 3.25Å; L228-H230 PolarHBondContact O-N 3.28Å; L228-G231 PolarHBondContact O-N 2.88Å; L228-P234 HydrophobicContact CD2-CG 4.41Å; L228-V255 HydrophobicContact CD1-CG1 3.89Å; L228-L256 HydrophobicContact CD1-CD2 4.34Å; L228-T282 HydrophobicContact CB-CG2 4.17Å; L228-T282 HydrophobicContact CD1-CG2 4.07Å; L228-P283 WeakPolarHBondContact O-CD 3.47Å; L228-P283 WeakPolarHBondContact O-CG 3.41Å; L228-L284 HydrophobicContact CD1-CD1 3.81Å; L228-L284 HydrophobicContact CD1-CG 4.44Å; L228-L284 HydrophobicContact CD2-CD1 3.94Å; L228-L284 HydrophobicContact CD2-CG 4.38Å
229	Q	93.2	Very high	95.3	Very high	50 Å²	50	42.5 Å²	42.5	23%	0.234	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-32.9	175.2	-74.2	174.2	-12.8	0	0	112.7	I225 V226 M278 L281	I225-Q229 HydrophobicContact CG2-CG 4.37Å; I225-Q229 VanDerWaalsContact O-CG 3.31Å; I225-Q229 WeakPolarHBondContact O-CG 3.36Å; I225-Q229 PolarHBondContact O-N 3.31Å; V226-Q229 PolarHBondContact O-N 3.49Å; Q229-M278 PolarHBondContact NE2-O 3.39Å; Q229-L281 VanDerWaalsContact CG-O 3.29Å; Q229-L281 WeakPolarHBondContact CG-O 3.24Å; Q229-L281 PolarHBondContact NE2-O 3.27Å
230	H	94.6	Very high	95.2	Very high	75 Å²	75	46.2 Å²	46.2	35%	0.347	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	11.7	176.8	-76.9	-97.2	0	0	0	114.2	L195 V226 L227 L228	L195-H230 HydrophobicContact CB-CB 4.26Å; L195-H230 HydrophobicContact CD1-CB 3.87Å; L195-H230 HydrophobicContact CD2-CB 4.11Å; L195-H230 HydrophobicContact CG-CB 4.31Å; V226-H230 PolarHBondContact O-CD2 3.37Å; V226-H230 VanDerWaalsContact O-CD2 3.29Å; V226-H230 PolarHBondContact O-N 3.3Å; L227-H230 CarbonylContact O-C 3.6Å; L227-H230 PolarHBondContact O-N 3.46Å; L228-H230 VanDerWaalsContact C-N 3.25Å; L228-H230 PolarHBondContact O-N 3.28Å
231	G	93.9	Very high	95.1	Very high	45 Å²	45	44.7 Å²	44.7	46%	0.464	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.7	24.2	171.1	0	0	0	0	0	116.3	N202 L227 L228 D233	N202-G231 PolarHBondContact ND2-O 3.12Å; L227-G231 PolarHBondContact O-N 3.1Å; L228-G231 PolarHBondContact O-N 2.88Å; G231-D233 PolarHBondContact O-N 2.88Å
232	A	96.4	Very high	95.2	Very high	7 Å²	7	47.4 Å²	47.4	6%	0.058	26%	0.258	C	S	.	.			trans	-63.1	129.4	165.7	0	0	0	0	0	111.1	P201 N202 L212 L227 P234	P201-A232 HydrophobicContact CB-CB 4.02Å; N202-A232 WeakPolarHBondContact OD1-CA 3.44Å; L212-A232 HydrophobicContact CB-CB 4.27Å; L212-A232 HydrophobicContact CD2-CB 3.93Å; L227-A232 HydrophobicContact CB-CB 3.87Å; L227-A232 WeakPolarHBondContact O-CB 3.39Å; L227-A232 PolarHBondContact O-N 2.91Å; A232-P234 WeakPolarHBondContact O-CD 3.38Å
233	D	94.9	Very high	95.3	Very high	63 Å²	63	42.8 Å²	42.8	34%	0.337	23%	0.234	S	C	.	.			trans	-88	113.6	176.1	176.3	15.6	0	0	0	110.3	N202 G231 N235 I236	N202-D233 PolarHBondContact OD1-N 3.2Å; G231-D233 PolarHBondContact O-N 2.88Å; D233-N235 PolarHBondContact O-N 2.8Å; D233-N235 VanDerWaalsContact OD1-CB 3.28Å; D233-N235 WeakPolarHBondContact OD1-CB 3.33Å; D233-N235 PolarHBondContact OD1-N 3.24Å; D233-N235 PolarHBondContact OD1-ND2 3.07Å; D233-I236 HydrophobicContact CB-CD1 3.98Å; D233-I236 HydrophobicContact CB-CG1 3.99Å
234	P	94.5	Very high	95.2	Very high	18 Å²	18	42.7 Å²	42.7	12%	0.117	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.4	178.4	31.3	-36.8	0	0	0	113.6	L212 L228 A232 L256 L284	L212-P234 HydrophobicContact CD2-CB 4.1Å; L228-P234 HydrophobicContact CD2-CG 4.41Å; A232-P234 WeakPolarHBondContact O-CD 3.38Å; P234-L256 HydrophobicContact CB-CD2 4.25Å; P234-L284 HydrophobicContact CG-CD1 4.32Å; P234-L284 HydrophobicContact CG-CD2 4.28Å
235	N	94.9	Very high	95.1	Very high	119 Å²	119	45.2 Å²	45.2	64%	0.636	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.7	-175.1	-53.7	-78.3	0	0	0	113.9	D233 R237	D233-N235 PolarHBondContact O-N 2.8Å; D233-N235 VanDerWaalsContact OD1-CB 3.28Å; D233-N235 WeakPolarHBondContact OD1-CB 3.33Å; D233-N235 PolarHBondContact OD1-N 3.24Å; D233-N235 PolarHBondContact OD1-ND2 3.07Å; N235-R237 PolarHBondContact O-N 3.03Å
236	I	95.7	Very high	95.1	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.067	27%	0.27	C	S	.	.			trans	-58.6	135.5	174.7	-64.5	173.4	0	0	0	108.9	N202 T210 H213 D233 S243	N202-I236 HydrophobicContact CB-CD1 3.78Å; N202-I236 WeakPolarHBondContact OD1-CD1 3.44Å; T210-I236 HydrophobicContact CG2-CB 4.24Å; T210-I236 HydrophobicContact CG2-CD1 4.01Å; T210-I236 HydrophobicContact CG2-CG2 3.77Å; H213-I236 PolarHBondContact CE1-O 3.08Å; H213-I236 PolarHBondContact NE2-O 3.48Å; D233-I236 HydrophobicContact CB-CD1 3.98Å; D233-I236 HydrophobicContact CB-CG1 3.99Å; I236-S243 WeakPolarHBondContact O-CA 3.37Å
237	R	96.1	Very high	95	Very high	151 Å²	151	50.3 Å²	50.3	57%	0.57	27%	0.274	S	S	*	.	B	Isolated β-bridge	trans	-106.6	139.1	178.6	-66.2	175.6	-177.3	-85.3	-5.9	111.3	N235 G241 K242	N235-R237 PolarHBondContact O-N 3.03Å; R237-G241 VanDerWaalsContact CD-O 3.31Å; R237-G241 WeakPolarHBondContact CD-O 3.46Å; R237-G241 PolarHBondContact NH1-O 3.21Å; R237-K242 CarbonylContact C-O 3.56Å; R237-K242 VanDerWaalsContact CA-O 3.28Å; R237-K242 WeakPolarHBondContact CA-O 3.22Å
238	N	94.9	Very high	94.9	Very high	7 Å²	7	51.2 Å²	51.2	4%	0.037	28%	0.281	C	S	.	.			trans	-74.3	-176.8	172.5	81.5	-18.4	0	0	0	111.9	Y209 D240 G241 K242	Y209-N238 HydrophobicContact CD2-CB 3.85Å; Y209-N238 HydrophobicContact CE2-CB 3.8Å; Y209-N238 WeakPolarHBondContact CE2-ND2 3.18Å; Y209-N238 HydrophobicContact CG-CB 4.47Å; Y209-N238 PolarHBondContact OH-ND2 3.5Å; Y209-N238 VanDerWaalsContact OH-ND2 3.09Å; N238-D240 PolarHBondContact ND2-OD2 3.42Å; N238-D240 PolarHBondContact O-N 3.4Å; N238-D240 WeakPolarHBondContact OD1-CA 3.3Å; N238-D240 WeakPolarHBondContact OD1-CB 3.31Å; N238-D240 PolarHBondContact OD1-N 3.47Å; N238-G241 PolarHBondContact O-N 2.98Å; N238-G241 PolarHBondContact OD1-N 3.04Å; N238-K242 PolarHBondContact N-O 3.11Å; N238-K242 PolarHBondContact OD1-N 3.18Å; N238-K242 PolarHBondContact OD1-O 2.89Å
239	T	95.2	Very high	94.9	Very high	81 Å²	81	54 Å²	54	50%	0.497	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.5	175.9	47.3	0	0	0	0	114.8	W207 N208 G241	W207-T239 WeakPolarHBondContact O-CG2 3.4Å; W207-T239 PolarHBondContact O-N 3.18Å; W207-T239 PolarHBondContact O-OG1 3.36Å; N208-T239 HydrophobicContact CB-CG2 4.47Å; T239-G241 PolarHBondContact O-N 2.88Å
240	D	93.4	Very high	94.7	Very high	97 Å²	97	56.9 Å²	56.9	52%	0.519	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.5	174	-46.5	-49	0	0	0	112.7	N238 K242	N238-D240 PolarHBondContact ND2-OD2 3.42Å; N238-D240 PolarHBondContact O-N 3.4Å; N238-D240 WeakPolarHBondContact OD1-CA 3.3Å; N238-D240 WeakPolarHBondContact OD1-CB 3.31Å; N238-D240 PolarHBondContact OD1-N 3.47Å; D240-K242 VanDerWaalsContact C-N 3.25Å; D240-K242 HydrophobicContact CB-CD 4.29Å; D240-K242 HydrophobicContact CB-CG 4.24Å; D240-K242 PolarHBondContact O-N 2.93Å
241	G	93.4	Very high	94.3	Very high	36 Å²	36	55.5 Å²	55.5	37%	0.371	32%	0.317	S	S	.	.	S	Bend	trans	73.1	11.2	-174.6	0	0	0	0	0	114.4	R237 N238 T239	R237-G241 VanDerWaalsContact CD-O 3.31Å; R237-G241 WeakPolarHBondContact CD-O 3.46Å; R237-G241 PolarHBondContact NH1-O 3.21Å; N238-G241 PolarHBondContact O-N 2.98Å; N238-G241 PolarHBondContact OD1-N 3.04Å; T239-G241 PolarHBondContact O-N 2.88Å
242	K	96.4	Very high	94.2	Very high	92 Å²	92	53.3 Å²	53.3	40%	0.4	30%	0.295	S	S	.	.			trans	-94.1	141.8	-178.6	-66.3	177.4	-175.9	169.8	0	111.5	H213 R237 N238 D240 D246 L247	H213-K242 PolarHBondContact NE2-O 3.15Å; R237-K242 CarbonylContact C-O 3.56Å; R237-K242 VanDerWaalsContact CA-O 3.28Å; R237-K242 WeakPolarHBondContact CA-O 3.22Å; N238-K242 PolarHBondContact N-O 3.11Å; N238-K242 PolarHBondContact OD1-N 3.18Å; N238-K242 PolarHBondContact OD1-O 2.89Å; D240-K242 VanDerWaalsContact C-N 3.25Å; D240-K242 HydrophobicContact CB-CD 4.29Å; D240-K242 HydrophobicContact CB-CG 4.24Å; D240-K242 PolarHBondContact O-N 2.93Å; K242-D246 HydrophobicContact CB-CB 4.05Å; K242-D246 HydrophobicContact CG-CB 4.38Å; K242-L247 HydrophobicContact CB-CD1 3.78Å; K242-L247 HydrophobicContact CB-CG 3.95Å; K242-L247 HydrophobicContact CD-CD1 4.23Å; K242-L247 HydrophobicContact CD-CD2 3.65Å; K242-L247 HydrophobicContact CD-CG 3.89Å
243	S	96.4	Very high	94.1	Very high	10 Å²	10	58.1 Å²	58.1	7%	0.07	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-85.6	170.2	171.6	67.3	0	0	0	0	112.3	I236 L245 D246 L247	I236-S243 WeakPolarHBondContact O-CA 3.37Å; S243-L245 PolarHBondContact O-N 3.17Å; S243-L245 PolarHBondContact OG-N 3.27Å; S243-D246 WeakPolarHBondContact CB-OD2 3.5Å; S243-D246 PolarHBondContact N-OD2 3.2Å; S243-D246 PolarHBondContact O-N 3.37Å; S243-D246 VanDerWaalsContact O-N 3.13Å; S243-D246 VanDerWaalsContact OG-CG 3.22Å; S243-D246 PolarHBondContact OG-N 3.24Å; S243-D246 PolarHBondContact OG-OD2 3.06Å; S243-L247 PolarHBondContact O-N 3.49Å
244	A	94.8	Very high	93.9	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.008	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.3	171.8	0	0	0	0	0	112.2	L212 H213 A216 A248 L256	L212-A244 HydrophobicContact CD2-CB 4.39Å; L212-A244 HydrophobicContact CG-CB 4.05Å; H213-A244 PolarHBondContact NE2-N 3.1Å; A216-A244 HydrophobicContact CB-CB 4.3Å; A216-A244 WeakPolarHBondContact CB-O 3.41Å; A244-A248 WeakPolarHBondContact O-CB 3.25Å; A244-A248 PolarHBondContact O-N 3.14Å; A244-A248 VanDerWaalsContact O-N 3.12Å; A244-L256 HydrophobicContact CB-CD1 4.24Å
245	L	95.4	Very high	93.9	Very high	53 Å²	53	55.9 Å²	55.9	28%	0.277	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-34.8	177.6	178.9	66.5	0	0	0	113	S243 L247 K253 L256 T257	S243-L245 PolarHBondContact O-N 3.17Å; S243-L245 PolarHBondContact OG-N 3.27Å; L245-L247 VanDerWaalsContact C-N 3.27Å; L245-L247 PolarHBondContact O-N 2.83Å; L245-K253 HydrophobicContact CD1-CG 3.78Å; L245-L256 HydrophobicContact CB-CB 4.41Å; L245-L256 HydrophobicContact CB-CD1 4.36Å; L245-L256 HydrophobicContact CD1-CB 3.67Å; L245-T257 HydrophobicContact CD1-CG2 3.76Å; L245-T257 HydrophobicContact CD2-CG2 4.48Å
246	D	95	Very high	93.8	Very high	95 Å²	95	50.7 Å²	50.7	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-26.2	179.1	-61.8	-52.6	0	0	0	112.3	K242 S243	K242-D246 HydrophobicContact CB-CB 4.05Å; K242-D246 HydrophobicContact CG-CB 4.38Å; S243-D246 WeakPolarHBondContact CB-OD2 3.5Å; S243-D246 PolarHBondContact N-OD2 3.2Å; S243-D246 PolarHBondContact O-N 3.37Å; S243-D246 VanDerWaalsContact O-N 3.13Å; S243-D246 VanDerWaalsContact OG-CG 3.22Å; S243-D246 PolarHBondContact OG-N 3.24Å; S243-D246 PolarHBondContact OG-OD2 3.06Å
247	L	94	Very high	93.6	Very high	40 Å²	40	53.5 Å²	53.5	21%	0.209	30%	0.296	C	S	.	.	S	Bend	trans	-103.4	-1.9	-177.4	-72.4	166.5	0	0	0	113.4	Y209 I217 K242 S243 L245	Y209-L247 HydrophobicContact CE1-CD1 4.15Å; I217-L247 HydrophobicContact CD1-CB 4.04Å; I217-L247 HydrophobicContact CD1-CD1 4.32Å; I217-L247 HydrophobicContact CG1-CB 3.73Å; I217-L247 WeakPolarHBondContact CG1-O 3.28Å; K242-L247 HydrophobicContact CB-CD1 3.78Å; K242-L247 HydrophobicContact CB-CG 3.95Å; K242-L247 HydrophobicContact CD-CD1 4.23Å; K242-L247 HydrophobicContact CD-CD2 3.65Å; K242-L247 HydrophobicContact CD-CG 3.89Å; S243-L247 PolarHBondContact O-N 3.49Å; L245-L247 VanDerWaalsContact C-N 3.27Å; L245-L247 PolarHBondContact O-N 2.83Å
248	A	95.4	Very high	93.3	Very high	18 Å²	18	46.4 Å²	46.4	15%	0.149	27%	0.27	C	S	.	.			trans	-68.4	137.9	-173.9	0	0	0	0	0	113.8	A216 A244 A252 K253 L256	A216-A248 HydrophobicContact CB-CB 4.06Å; A244-A248 WeakPolarHBondContact O-CB 3.25Å; A244-A248 PolarHBondContact O-N 3.14Å; A244-A248 VanDerWaalsContact O-N 3.12Å; A248-A252 HydrophobicContact CB-CB 4.49Å; A248-K253 HydrophobicContact CB-CB 4.06Å; A248-L256 HydrophobicContact CB-CD1 3.92Å
249	D	93.9	Very high	93	Very high	64 Å²	64	50.7 Å²	50.7	34%	0.342	29%	0.29	S	S	.	.			trans	-55.7	145.3	159.7	177.1	-87.6	0	0	0	110.4	A216 S251 A252 K253	A216-D249 PolarHBondContact O-N 3.09Å; D249-S251 PolarHBondContact O-N 3.34Å; D249-S251 VanDerWaalsContact OD1-CB 3.27Å; D249-S251 WeakPolarHBondContact OD1-CB 3.39Å; D249-S251 PolarHBondContact OD1-N 2.79Å; D249-S251 PolarHBondContact OD1-OG 2.99Å; D249-A252 PolarHBondContact O-N 3.23Å; D249-K253 PolarHBondContact O-N 3.45Å
250	P	88.7	Confident	92.8	Very high	110 Å²	110	48.8 Å²	48.8	71%	0.714	27%	0.274	S	S	*	.	H	α-helix	trans	-51.6	-30.5	-178.8	-29.8	36.8	0	0	0	115.2
251	S	86.4	Confident	92.7	Very high	45 Å²	45	48.5 Å²	48.5	32%	0.315	27%	0.268	S	S	.	.	H	α-helix	trans	-74.7	-42.2	177.7	68.8	0	0	0	0	113	D249	D249-S251 PolarHBondContact O-N 3.34Å; D249-S251 VanDerWaalsContact OD1-CB 3.27Å; D249-S251 WeakPolarHBondContact OD1-CB 3.39Å; D249-S251 PolarHBondContact OD1-N 2.79Å; D249-S251 PolarHBondContact OD1-OG 2.99Å
252	A	92.7	Very high	92.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-72.6	-29.5	175.4	0	0	0	0	0	112.3	A248 D249 A254 V255 L256	A248-A252 HydrophobicContact CB-CB 4.49Å; D249-A252 PolarHBondContact O-N 3.23Å; A252-A254 VanDerWaalsContact C-N 3.26Å; A252-A254 PolarHBondContact O-N 3.32Å; A252-V255 WeakPolarHBondContact O-CB 3.5Å; A252-V255 PolarHBondContact O-N 2.95Å; A252-L256 PolarHBondContact O-N 3.01Å
253	K	93.6	Very high	92.2	Very high	107 Å²	107	47.3 Å²	47.3	47%	0.465	26%	0.256	S	S	.	.	H	α-helix	trans	-54.9	-40.6	178.3	-170.6	165.5	-170.9	160.9	0	112.6	L245 A248 D249 V255 L256 T257	L245-K253 HydrophobicContact CD1-CG 3.78Å; A248-K253 HydrophobicContact CB-CB 4.06Å; D249-K253 PolarHBondContact O-N 3.45Å; K253-V255 VanDerWaalsContact C-N 3.27Å; K253-V255 PolarHBondContact O-N 2.7Å; K253-L256 PolarHBondContact O-N 3.42Å; K253-T257 WeakPolarHBondContact O-CG2 3.33Å; K253-T257 PolarHBondContact O-N 3.26Å; K253-T257 PolarHBondContact O-OG1 3.47Å
254	A	91.3	Very high	92	Very high	31 Å²	31	50.1 Å²	50.1	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-30.5	176.8	0	0	0	0	0	113.5	A252 T257 G258 E259 Y260	A252-A254 VanDerWaalsContact C-N 3.26Å; A252-A254 PolarHBondContact O-N 3.32Å; A254-T257 PolarHBondContact O-OG1 3.44Å; A254-G258 PolarHBondContact O-N 3.14Å; A254-E259 PolarHBondContact O-N 2.78Å; A254-Y260 HydrophobicContact CB-CD2 4.36Å; A254-Y260 PolarHBondContact O-N 3.27Å
255	V	93.9	Very high	91.9	Very high	3 Å²	3	50 Å²	50	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-70.5	-47.3	175.4	-175.8	0	0	0	0	109.5	I221 C224 I225 L228 A252 K253 T257 G258 Y260	I221-V255 HydrophobicContact CG2-CG2 3.89Å; C224-V255 HydrophobicContact CB-CB 4.5Å; C224-V255 HydrophobicContact CB-CG1 4.11Å; I225-V255 HydrophobicContact CG1-CG1 3.73Å; I225-V255 HydrophobicContact CG1-CG2 4.47Å; L228-V255 HydrophobicContact CD1-CG1 3.89Å; A252-V255 WeakPolarHBondContact O-CB 3.5Å; A252-V255 PolarHBondContact O-N 2.95Å; K253-V255 VanDerWaalsContact C-N 3.27Å; K253-V255 PolarHBondContact O-N 2.7Å; V255-T257 PolarHBondContact O-N 3.28Å; V255-G258 PolarHBondContact O-N 3.12Å; V255-Y260 HydrophobicContact CG2-CD1 4.24Å; V255-Y260 HydrophobicContact CG2-CD2 4.04Å; V255-Y260 HydrophobicContact CG2-CG 3.77Å
256	L	94	Very high	91.7	Very high	11 Å²	11	47.6 Å²	47.6	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-70.2	-13.8	-178.9	-62.8	174.8	0	0	0	114	L212 A216 L228 P234 A244 L245 A248 A252 K253	L212-L256 HydrophobicContact CD1-CD2 4.09Å; L212-L256 HydrophobicContact CD2-CD2 4.05Å; L212-L256 HydrophobicContact CG-CD2 4.23Å; A216-L256 HydrophobicContact CB-CD1 3.82Å; L228-L256 HydrophobicContact CD1-CD2 4.34Å; P234-L256 HydrophobicContact CB-CD2 4.25Å; A244-L256 HydrophobicContact CB-CD1 4.24Å; L245-L256 HydrophobicContact CB-CB 4.41Å; L245-L256 HydrophobicContact CB-CD1 4.36Å; L245-L256 HydrophobicContact CD1-CB 3.67Å; A248-L256 HydrophobicContact CB-CD1 3.92Å; A252-L256 PolarHBondContact O-N 3.01Å; K253-L256 PolarHBondContact O-N 3.42Å
257	T	91.3	Very high	91.6	Very high	71 Å²	71	46.9 Å²	46.9	44%	0.436	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	2.2	168.6	65.1	0	0	0	0	113.8	L245 K253 A254 V255 E259	L245-T257 HydrophobicContact CD1-CG2 3.76Å; L245-T257 HydrophobicContact CD2-CG2 4.48Å; K253-T257 WeakPolarHBondContact O-CG2 3.33Å; K253-T257 PolarHBondContact O-N 3.26Å; K253-T257 PolarHBondContact O-OG1 3.47Å; A254-T257 PolarHBondContact O-OG1 3.44Å; V255-T257 PolarHBondContact O-N 3.28Å; T257-E259 PolarHBondContact O-N 3.35Å
258	G	89.5	Confident	91.6	Very high	2 Å²	2	45.1 Å²	45.1	2%	0.021	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	7.5	-178.8	0	0	0	0	0	115.8	A254 V255 N285	A254-G258 PolarHBondContact O-N 3.14Å; V255-G258 PolarHBondContact O-N 3.12Å; G258-N285 VanDerWaalsContact O-CB 3.26Å; G258-N285 WeakPolarHBondContact O-CB 3.11Å
259	E	87.9	Confident	91.5	Very high	97 Å²	97	44.2 Å²	44.2	45%	0.453	23%	0.233	S	C	.	.			trans	-94.8	-9.3	-177.6	-68.1	-63.7	128.7	0	0	113.2	A254 T257 K261 K262	A254-E259 PolarHBondContact O-N 2.78Å; T257-E259 PolarHBondContact O-N 3.35Å; E259-K261 PolarHBondContact O-N 3.42Å; E259-K261 VanDerWaalsContact O-N 3.16Å; E259-K262 PolarHBondContact O-N 3.4Å; E259-K262 IonicContact OE1-NZ 2.76Å; E259-K262 PolarHBondContact OE1-NZ 3.18Å; E259-K262 VanDerWaalsContact OE2-CD 3.25Å; E259-K262 WeakPolarHBondContact OE2-CD 3.43Å; E259-K262 IonicContact OE2-NZ 3.47Å; E259-K262 PolarHBondContact OE2-NZ 3.47Å
260	Y	91.4	Very high	91.5	Very high	42 Å²	42	45.3 Å²	45.3	17%	0.165	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	118.2	178.5	-175.8	-100.7	0	0	0	112.1	I221 I225 A254 V255 K262 L280	I221-Y260 HydrophobicContact CD1-CE2 3.93Å; I221-Y260 HydrophobicContact CG2-CD1 4.4Å; I221-Y260 HydrophobicContact CG2-CD2 4.41Å; I221-Y260 HydrophobicContact CG2-CE1 3.82Å; I221-Y260 HydrophobicContact CG2-CE2 3.84Å; I225-Y260 HydrophobicContact CD1-CD1 4.17Å; I225-Y260 HydrophobicContact CD1-CE1 4.11Å; A254-Y260 HydrophobicContact CB-CD2 4.36Å; A254-Y260 PolarHBondContact O-N 3.27Å; V255-Y260 HydrophobicContact CG2-CD1 4.24Å; V255-Y260 HydrophobicContact CG2-CD2 4.04Å; V255-Y260 HydrophobicContact CG2-CG 3.77Å; Y260-K262 PolarHBondContact O-N 3.46Å; Y260-L280 HydrophobicContact CD1-CD2 4.23Å; Y260-L280 HydrophobicContact CE1-CD2 3.83Å
261	K	91.4	Very high	91.7	Very high	90 Å²	90	42.6 Å²	42.6	39%	0.391	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	29.3	176	-70.8	-171.3	166.1	-166.9	0	115.2	E259 D263 E264 L265 L280	E259-K261 PolarHBondContact O-N 3.42Å; E259-K261 VanDerWaalsContact O-N 3.16Å; K261-D263 VanDerWaalsContact C-N 3.32Å; K261-D263 PolarHBondContact O-N 3.16Å; K261-E264 HydrophobicContact CB-CB 4.27Å; K261-E264 HydrophobicContact CB-CG 4.38Å; K261-E264 WeakPolarHBondContact CD-OE1 3.2Å; K261-E264 WeakPolarHBondContact CE-OE1 3.35Å; K261-E264 WeakPolarHBondContact CG-OE1 3.45Å; K261-E264 IonicContact NZ-OE1 2.97Å; K261-E264 WeakPolarHBondContact O-CA 3.1Å; K261-E264 WeakPolarHBondContact O-CB 3.38Å; K261-E264 PolarHBondContact O-N 3.17Å; K261-L265 PolarHBondContact O-N 2.92Å; K261-L280 HydrophobicContact CB-CD1 4.14Å; K261-L280 HydrophobicContact CB-CD2 4.02Å; K261-L280 HydrophobicContact CD-CD2 3.83Å
262	K	89.2	Confident	92.1	Very high	22 Å²	22	41.7 Å²	41.7	10%	0.096	21%	0.214	C	C	.	.	H	α-helix	trans	-51.3	-41.5	-177.3	177	170.4	162.3	-170.5	0	114.8	E259 Y260 E264 L265 L266 C288 H289	E259-K262 PolarHBondContact O-N 3.4Å; E259-K262 IonicContact OE1-NZ 2.76Å; E259-K262 PolarHBondContact OE1-NZ 3.18Å; E259-K262 VanDerWaalsContact OE2-CD 3.25Å; E259-K262 WeakPolarHBondContact OE2-CD 3.43Å; E259-K262 IonicContact OE2-NZ 3.47Å; E259-K262 PolarHBondContact OE2-NZ 3.47Å; Y260-K262 PolarHBondContact O-N 3.46Å; K262-E264 VanDerWaalsContact C-N 3.34Å; K262-E264 PolarHBondContact O-N 2.87Å; K262-L265 PolarHBondContact O-N 3.02Å; K262-L266 HydrophobicContact CG-CD1 4.25Å; K262-L266 WeakPolarHBondContact O-CD1 3.21Å; K262-L266 VanDerWaalsContact O-CG 3.28Å; K262-L266 WeakPolarHBondContact O-CG 3.47Å; K262-L266 PolarHBondContact O-N 3.48Å; K262-C288 HydrophobicContact CD-CB 3.97Å; K262-C288 HydrophobicContact CG-CB 4.01Å; K262-H289 WeakPolarHBondContact CE-O 3.38Å; K262-H289 PolarHBondContact NZ-O 2.88Å
263	D	89.3	Confident	92.2	Very high	81 Å²	81	44.9 Å²	44.9	43%	0.433	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-33.2	174.2	-86.7	-58.2	0	0	0	113.2	K261 E267 K300	K261-D263 VanDerWaalsContact C-N 3.32Å; K261-D263 PolarHBondContact O-N 3.16Å; D263-E267 PolarHBondContact O-N 2.98Å; D263-K300 IonicContact OD1-NZ 3.78Å; D263-K300 PolarHBondContact OD1-NZ 2.82Å
264	E	92	Very high	92.3	Very high	69 Å²	69	43.8 Å²	43.8	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-72.3	-36.6	175.4	-59.2	-171.2	-127	0	0	111.8	K261 K262 A268 K276 L280	K261-E264 HydrophobicContact CB-CB 4.27Å; K261-E264 HydrophobicContact CB-CG 4.38Å; K261-E264 WeakPolarHBondContact CD-OE1 3.2Å; K261-E264 WeakPolarHBondContact CE-OE1 3.35Å; K261-E264 WeakPolarHBondContact CG-OE1 3.45Å; K261-E264 IonicContact NZ-OE1 2.97Å; K261-E264 WeakPolarHBondContact O-CA 3.1Å; K261-E264 WeakPolarHBondContact O-CB 3.38Å; K261-E264 PolarHBondContact O-N 3.17Å; K262-E264 VanDerWaalsContact C-N 3.34Å; K262-E264 PolarHBondContact O-N 2.87Å; E264-A268 WeakPolarHBondContact O-CB 3.38Å; E264-A268 PolarHBondContact O-N 2.89Å; E264-K276 WeakPolarHBondContact OE2-CE 3.32Å; E264-K276 IonicContact OE2-NZ 2.74Å; E264-K276 PolarHBondContact OE2-NZ 3.47Å; E264-L280 HydrophobicContact CB-CD1 3.85Å
265	L	93.7	Very high	92.5	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-45.6	173.2	-179.2	72.5	0	0	0	111.3	K261 K262 A268 A269 L277 L280 L281 N285 P305	K261-L265 PolarHBondContact O-N 2.92Å; K262-L265 PolarHBondContact O-N 3.02Å; L265-A268 PolarHBondContact O-N 3.34Å; L265-A269 PolarHBondContact O-N 3.02Å; L265-L277 HydrophobicContact CD1-CD1 3.77Å; L265-L277 HydrophobicContact CD1-CG 4.23Å; L265-L280 HydrophobicContact CB-CB 4.42Å; L265-L280 HydrophobicContact CB-CD1 4.48Å; L265-L280 HydrophobicContact CD1-CB 3.92Å; L265-L281 HydrophobicContact CD1-CB 4.14Å; L265-L281 HydrophobicContact CD1-CD1 4.31Å; L265-N285 HydrophobicContact CD2-CB 4.12Å; L265-N285 WeakPolarHBondContact CD2-OD1 3.5Å; L265-P305 HydrophobicContact CD2-CG 4.35Å
266	L	91.9	Very high	92.5	Very high	1 Å²	1	54 Å²	54	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-41.8	177.1	-72.3	164.3	0	0	0	112	K262 A269 R270 A290 P305 L308	K262-L266 HydrophobicContact CG-CD1 4.25Å; K262-L266 WeakPolarHBondContact O-CD1 3.21Å; K262-L266 VanDerWaalsContact O-CG 3.28Å; K262-L266 WeakPolarHBondContact O-CG 3.47Å; K262-L266 PolarHBondContact O-N 3.48Å; L266-A269 PolarHBondContact O-N 2.84Å; L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 PolarHBondContact O-N 3.09Å; L266-A290 HydrophobicContact CD1-CB 3.92Å; L266-P305 HydrophobicContact CD2-CG 3.89Å; L266-L308 HydrophobicContact CB-CD1 3.94Å; L266-L308 HydrophobicContact CD2-CD1 3.78Å; L266-L308 HydrophobicContact CG-CD1 4.47Å; L266-L308 WeakPolarHBondContact O-CD1 3.45Å
267	E	91.5	Very high	92.6	Very high	80 Å²	80	53.5 Å²	53.5	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-73.4	-32	176.2	-170.7	56.7	-136.7	0	0	112.1	D263 R270 S271	D263-E267 PolarHBondContact O-N 2.98Å; E267-R270 PolarHBondContact O-N 2.86Å; E267-R270 IonicContact OE1-NH1 3.53Å; E267-R270 VanDerWaalsContact OE2-CD 3.3Å; E267-R270 WeakPolarHBondContact OE2-CD 3.46Å; E267-R270 IonicContact OE2-CZ 2.64Å; E267-R270 IonicContact OE2-NH1 2.65Å; E267-R270 PolarHBondContact OE2-NH1 3.49Å; E267-S271 VanDerWaalsContact O-CB 3.23Å; E267-S271 WeakPolarHBondContact O-CB 3.39Å; E267-S271 PolarHBondContact O-N 3.48Å; E267-S271 PolarHBondContact O-OG 2.88Å
268	A	94.1	Very high	92.7	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-45.8	169.8	0	0	0	0	0	111.2	E264 L265 R270 S271 G272 N273 K276 L277	E264-A268 WeakPolarHBondContact O-CB 3.38Å; E264-A268 PolarHBondContact O-N 2.89Å; L265-A268 PolarHBondContact O-N 3.34Å; A268-R270 VanDerWaalsContact C-N 3.33Å; A268-R270 PolarHBondContact O-N 3.38Å; A268-S271 PolarHBondContact O-N 3.09Å; A268-S271 PolarHBondContact O-OG 3.35Å; A268-G272 PolarHBondContact O-N 3.18Å; A268-N273 HydrophobicContact CB-CB 4.35Å; A268-N273 PolarHBondContact O-N 3.05Å; A268-K276 HydrophobicContact CB-CB 4.16Å; A268-K276 HydrophobicContact CB-CG 4.24Å; A268-L277 HydrophobicContact CB-CB 4.28Å; A268-L277 HydrophobicContact CB-CD1 4.49Å
269	A	94.4	Very high	92.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.3	-36.1	177.6	0	0	0	0	0	113.3	L265 L266 L277 P305 R314 I317	L265-A269 PolarHBondContact O-N 3.02Å; L266-A269 PolarHBondContact O-N 2.84Å; A269-L277 HydrophobicContact CB-CD1 3.85Å; A269-P305 HydrophobicContact CB-CB 3.81Å; A269-R314 WeakPolarHBondContact O-CG 3.44Å; A269-I317 HydrophobicContact CB-CG2 4.04Å
270	R	92.4	Very high	93.3	Very high	87 Å²	87	51.7 Å²	51.7	33%	0.328	26%	0.263	S	S	.	.	H	α-helix	trans	-73.6	-46.2	176.4	-172.8	-166.4	-178.7	-157.9	0.4	113	L266 E267 A268 G272 L308 Y312 R314	L266-R270 WeakPolarHBondContact O-CB 3.48Å; L266-R270 PolarHBondContact O-N 3.09Å; E267-R270 PolarHBondContact O-N 2.86Å; E267-R270 IonicContact OE1-NH1 3.53Å; E267-R270 VanDerWaalsContact OE2-CD 3.3Å; E267-R270 WeakPolarHBondContact OE2-CD 3.46Å; E267-R270 IonicContact OE2-CZ 2.64Å; E267-R270 IonicContact OE2-NH1 2.65Å; E267-R270 PolarHBondContact OE2-NH1 3.49Å; A268-R270 VanDerWaalsContact C-N 3.33Å; A268-R270 PolarHBondContact O-N 3.38Å; R270-G272 VanDerWaalsContact C-N 3.34Å; R270-L308 HydrophobicContact CB-CB 4.19Å; R270-L308 HydrophobicContact CB-CD1 4.48Å; R270-Y312 HydrophobicContact CG-CD1 4.12Å; R270-Y312 HydrophobicContact CG-CD2 3.8Å; R270-Y312 HydrophobicContact CG-CE1 4.1Å; R270-Y312 HydrophobicContact CG-CE2 3.79Å; R270-Y312 HydrophobicContact CG-CG 3.97Å; R270-Y312 VanDerWaalsContact NE-CZ 3.3Å; R270-Y312 PolarHBondContact NE-OH 3.25Å; R270-Y312 VanDerWaalsContact NE-OH 3.13Å; R270-Y312 PolarHBondContact NH2-OH 3.24Å; R270-R314 PolarHBondContact O-NE 2.74Å; R270-R314 PolarHBondContact O-NH2 2.94Å
271	S	93.9	Very high	93.4	Very high	53 Å²	53	49.7 Å²	49.7	37%	0.371	26%	0.255	S	S	.	.	H	α-helix	trans	-74	-24.3	-176.8	58.3	0	0	0	0	113.1	E267 A268 R314	E267-S271 VanDerWaalsContact O-CB 3.23Å; E267-S271 WeakPolarHBondContact O-CB 3.39Å; E267-S271 PolarHBondContact O-N 3.48Å; E267-S271 PolarHBondContact O-OG 2.88Å; A268-S271 PolarHBondContact O-N 3.09Å; A268-S271 PolarHBondContact O-OG 3.35Å; S271-R314 PolarHBondContact O-NE 3.34Å; S271-R314 PolarHBondContact O-NH2 2.82Å; S271-R314 VanDerWaalsContact O-NH2 3.1Å
272	G	94.6	Very high	93.6	Very high	26 Å²	26	45.4 Å²	45.4	27%	0.268	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	19.4	-174.8	0	0	0	0	0	113.7	A268 R270 E274	A268-G272 PolarHBondContact O-N 3.18Å; R270-G272 VanDerWaalsContact C-N 3.34Å; G272-E274 PolarHBondContact O-N 2.95Å
273	N	95.6	Very high	93.7	Very high	67 Å²	67	47.7 Å²	47.7	36%	0.358	25%	0.254	S	S	.	.			trans	-83.3	94.4	-178.2	-171.4	-33	0	0	0	110.7	A268 E275 K276 L277	A268-N273 HydrophobicContact CB-CB 4.35Å; A268-N273 PolarHBondContact O-N 3.05Å; N273-E275 PolarHBondContact OD1-N 3.29Å; N273-K276 HydrophobicContact CB-CB 4.19Å; N273-K276 VanDerWaalsContact CG-CB 3.45Å; N273-K276 VanDerWaalsContact OD1-CB 3.22Å; N273-K276 WeakPolarHBondContact OD1-CB 3.49Å; N273-K276 PolarHBondContact OD1-N 3.09Å; N273-L277 WeakPolarHBondContact O-CB 3.3Å; N273-L277 PolarHBondContact O-N 2.91Å
274	E	95.6	Very high	93.8	Very high	83 Å²	83	47.1 Å²	47.1	39%	0.388	25%	0.25	S	S	.	.	H	α-helix	trans	-62.9	-48.3	-177.8	-66.4	179.1	-136.5	0	0	112.8	G272 K276 L277 M278 R316 I317 L320	G272-E274 PolarHBondContact O-N 2.95Å; E274-K276 VanDerWaalsContact C-N 3.34Å; E274-K276 PolarHBondContact O-N 3.24Å; E274-L277 WeakPolarHBondContact O-CB 3.49Å; E274-L277 PolarHBondContact O-N 3.18Å; E274-M278 WeakPolarHBondContact O-CB 3.44Å; E274-M278 WeakPolarHBondContact O-CG 3.31Å; E274-M278 PolarHBondContact O-N 2.89Å; E274-R316 HydrophobicContact CG-CG 4.21Å; E274-R316 WeakPolarHBondContact OE1-CG 3.37Å; E274-R316 WeakPolarHBondContact OE2-CG 3.44Å; E274-R316 IonicContact OE2-NE 2.65Å; E274-I317 HydrophobicContact CB-CD1 4.39Å; E274-I317 HydrophobicContact CG-CD1 3.74Å; E274-L320 HydrophobicContact CB-CD1 4.38Å; E274-L320 HydrophobicContact CG-CD1 4.17Å
275	E	94	Very high	93.9	Very high	170 Å²	170	44 Å²	44	79%	0.794	24%	0.236	S	C	*	.	H	α-helix	trans	-58	-47	-179.7	-64.4	176.5	-179.3	0	0	111.3	N273 M278 A279	N273-E275 PolarHBondContact OD1-N 3.29Å; E275-M278 PolarHBondContact O-N 3.01Å; E275-A279 WeakPolarHBondContact O-CB 3.47Å; E275-A279 PolarHBondContact O-N 3.37Å
276	K	94.9	Very high	93.9	Very high	80 Å²	80	44.2 Å²	44.2	35%	0.348	24%	0.237	S	C	.	.	H	α-helix	trans	-72.4	-30.8	-179.8	-168.6	170.1	-174.2	179.5	0	112.9	E264 A268 N273 E274 L280	E264-K276 WeakPolarHBondContact OE2-CE 3.32Å; E264-K276 IonicContact OE2-NZ 2.74Å; E264-K276 PolarHBondContact OE2-NZ 3.47Å; A268-K276 HydrophobicContact CB-CB 4.16Å; A268-K276 HydrophobicContact CB-CG 4.24Å; N273-K276 HydrophobicContact CB-CB 4.19Å; N273-K276 VanDerWaalsContact CG-CB 3.45Å; N273-K276 VanDerWaalsContact OD1-CB 3.22Å; N273-K276 WeakPolarHBondContact OD1-CB 3.49Å; N273-K276 PolarHBondContact OD1-N 3.09Å; E274-K276 VanDerWaalsContact C-N 3.34Å; E274-K276 PolarHBondContact O-N 3.24Å; K276-L280 HydrophobicContact CG-CD1 4.26Å; K276-L280 WeakPolarHBondContact O-CG 3.31Å
277	L	95.8	Very high	93.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.6	-54.8	170.2	-171.8	91	0	0	0	109.4	L265 A268 A269 N273 E274 A279 L280 L281 I317 L320 L321	L265-L277 HydrophobicContact CD1-CD1 3.77Å; L265-L277 HydrophobicContact CD1-CG 4.23Å; A268-L277 HydrophobicContact CB-CB 4.28Å; A268-L277 HydrophobicContact CB-CD1 4.49Å; A269-L277 HydrophobicContact CB-CD1 3.85Å; N273-L277 WeakPolarHBondContact O-CB 3.3Å; N273-L277 PolarHBondContact O-N 2.91Å; E274-L277 WeakPolarHBondContact O-CB 3.49Å; E274-L277 PolarHBondContact O-N 3.18Å; L277-A279 VanDerWaalsContact C-N 3.29Å; L277-A279 PolarHBondContact O-N 2.99Å; L277-L280 PolarHBondContact O-N 3.41Å; L277-L281 HydrophobicContact CD2-CD2 4.15Å; L277-L281 HydrophobicContact CG-CD2 4.4Å; L277-L281 WeakPolarHBondContact O-CB 3.26Å; L277-L281 PolarHBondContact O-N 3.25Å; L277-I317 HydrophobicContact CB-CD1 4.25Å; L277-I317 HydrophobicContact CD1-CG2 4.32Å; L277-I317 HydrophobicContact CD2-CD1 3.96Å; L277-I317 HydrophobicContact CD2-CG2 4.06Å; L277-L320 HydrophobicContact CD2-CB 4.18Å; L277-L320 HydrophobicContact CD2-CD1 4.4Å; L277-L321 HydrophobicContact CD1-CD2 4.29Å; L277-L321 HydrophobicContact CD2-CD2 4.33Å; L277-L321 HydrophobicContact CD2-CG 4.36Å
278	M	94.6	Very high	93.8	Very high	57 Å²	57	43.4 Å²	43.4	28%	0.281	24%	0.236	S	C	.	.	H	α-helix	trans	-65.4	-29.4	-176	-67.4	-50.8	-58.4	0	0	113.4	Q229 E274 E275 L280 L281 L320	Q229-M278 PolarHBondContact NE2-O 3.39Å; E274-M278 WeakPolarHBondContact O-CB 3.44Å; E274-M278 WeakPolarHBondContact O-CG 3.31Å; E274-M278 PolarHBondContact O-N 2.89Å; E275-M278 PolarHBondContact O-N 3.01Å; M278-L280 PolarHBondContact O-N 3.09Å; M278-L281 HydrophobicContact SD-CD2 4.3Å; M278-L320 HydrophobicContact CG-CD1 4.32Å; M278-L320 HydrophobicContact SD-CB 4.33Å; M278-L320 HydrophobicContact SD-CD1 4.13Å; M278-L320 HydrophobicContact SD-CD2 4.05Å; M278-L320 HydrophobicContact SD-CG 4.4Å
279	A	93.3	Very high	93.5	Very high	62 Å²	62	46.3 Å²	46.3	51%	0.512	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.4	173.1	0	0	0	0	0	114.3	E275 L277	E275-A279 WeakPolarHBondContact O-CB 3.47Å; E275-A279 PolarHBondContact O-N 3.37Å; L277-A279 VanDerWaalsContact C-N 3.29Å; L277-A279 PolarHBondContact O-N 2.99Å
280	L	94.6	Very high	92.7	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.063	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-20.5	-174.3	-62.8	178.9	0	0	0	114	Y260 K261 E264 L265 K276 L277 M278 N285	Y260-L280 HydrophobicContact CD1-CD2 4.23Å; Y260-L280 HydrophobicContact CE1-CD2 3.83Å; K261-L280 HydrophobicContact CB-CD1 4.14Å; K261-L280 HydrophobicContact CB-CD2 4.02Å; K261-L280 HydrophobicContact CD-CD2 3.83Å; E264-L280 HydrophobicContact CB-CD1 3.85Å; L265-L280 HydrophobicContact CB-CB 4.42Å; L265-L280 HydrophobicContact CB-CD1 4.48Å; L265-L280 HydrophobicContact CD1-CB 3.92Å; K276-L280 HydrophobicContact CG-CD1 4.26Å; K276-L280 WeakPolarHBondContact O-CG 3.31Å; L277-L280 PolarHBondContact O-N 3.41Å; M278-L280 PolarHBondContact O-N 3.09Å; L280-N285 PolarHBondContact O-ND2 2.94Å
281	L	95.2	Very high	91.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	26%	0.255	C	S	.	.			trans	-72.5	130.4	-172.3	-176.3	62.3	0	0	0	111.6	Q229 L265 L277 M278 V286 L321 H324	Q229-L281 VanDerWaalsContact CG-O 3.29Å; Q229-L281 WeakPolarHBondContact CG-O 3.24Å; Q229-L281 PolarHBondContact NE2-O 3.27Å; L265-L281 HydrophobicContact CD1-CB 4.14Å; L265-L281 HydrophobicContact CD1-CD1 4.31Å; L277-L281 HydrophobicContact CD2-CD2 4.15Å; L277-L281 HydrophobicContact CG-CD2 4.4Å; L277-L281 WeakPolarHBondContact O-CB 3.26Å; L277-L281 PolarHBondContact O-N 3.25Å; M278-L281 HydrophobicContact SD-CD2 4.3Å; L281-V286 HydrophobicContact CD1-CB 3.8Å; L281-V286 HydrophobicContact CD1-CG2 3.97Å; L281-L321 HydrophobicContact CD1-CD2 3.94Å; L281-L321 HydrophobicContact CD2-CD2 4.19Å; L281-H324 HydrophobicContact CD2-CB 3.82Å; L281-H324 HydrophobicContact CG-CB 4.33Å
282	T	94.1	Very high	89.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.266	C	S	.	.			trans	-139.1	159.4	174.6	61.8	0	0	0	0	109.6	I225 L228 L284 N285 V286	I225-T282 HydrophobicContact CB-CG2 4.33Å; I225-T282 HydrophobicContact CG1-CG2 4.24Å; I225-T282 HydrophobicContact CG2-CG2 4Å; L228-T282 HydrophobicContact CB-CG2 4.17Å; L228-T282 HydrophobicContact CD1-CG2 4.07Å; T282-L284 PolarHBondContact O-N 3.44Å; T282-N285 PolarHBondContact N-OD1 3.38Å; T282-N285 PolarHBondContact O-N 3.24Å; T282-N285 PolarHBondContact O-OD1 3.49Å; T282-N285 VanDerWaalsContact O-OD1 3.1Å; T282-N285 VanDerWaalsContact OG1-CG 3.23Å; T282-N285 PolarHBondContact OG1-N 3.39Å; T282-N285 PolarHBondContact OG1-ND2 3.47Å; T282-N285 PolarHBondContact OG1-OD1 3.35Å; T282-V286 PolarHBondContact O-N 2.63Å
283	P	91.8	Very high	87.5	Confident	70 Å²	70	49.7 Å²	49.7	46%	0.455	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-22.5	172.1	-26.4	35.9	0	0	0	113.9	L228	L228-P283 WeakPolarHBondContact O-CD 3.47Å; L228-P283 WeakPolarHBondContact O-CG 3.41Å
284	L	92.1	Very high	85	Confident	69 Å²	69	58.8 Å²	58.8	36%	0.361	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-20.9	-179.9	-54	-178.9	0	0	0	113.6	L228 P234 T282	L228-L284 HydrophobicContact CD1-CD1 3.81Å; L228-L284 HydrophobicContact CD1-CG 4.44Å; L228-L284 HydrophobicContact CD2-CD1 3.94Å; L228-L284 HydrophobicContact CD2-CG 4.38Å; P234-L284 HydrophobicContact CG-CD1 4.32Å; P234-L284 HydrophobicContact CG-CD2 4.28Å; T282-L284 PolarHBondContact O-N 3.44Å
285	N	93.1	Very high	82.4	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-5	-177.4	72.3	14.5	0	0	0	114.9	G258 L265 L280 T282 N287 C288	G258-N285 VanDerWaalsContact O-CB 3.26Å; G258-N285 WeakPolarHBondContact O-CB 3.11Å; L265-N285 HydrophobicContact CD2-CB 4.12Å; L265-N285 WeakPolarHBondContact CD2-OD1 3.5Å; L280-N285 PolarHBondContact O-ND2 2.94Å; T282-N285 PolarHBondContact N-OD1 3.38Å; T282-N285 PolarHBondContact O-N 3.24Å; T282-N285 PolarHBondContact O-OD1 3.49Å; T282-N285 VanDerWaalsContact O-OD1 3.1Å; T282-N285 VanDerWaalsContact OG1-CG 3.23Å; T282-N285 PolarHBondContact OG1-N 3.39Å; T282-N285 PolarHBondContact OG1-ND2 3.47Å; T282-N285 PolarHBondContact OG1-OD1 3.35Å; N285-N287 PolarHBondContact O-N 3.42Å; N285-N287 VanDerWaalsContact O-N 3.11Å; N285-C288 HydrophobicContact CB-CB 4.36Å; N285-C288 WeakPolarHBondContact O-CB 3.18Å; N285-C288 PolarHBondContact O-N 3.07Å; N285-C288 PolarHBondContact O-SG 3.47Å
286	V	93.9	Very high	79.9	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.018	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.7	177.7	64.4	0	0	0	0	113.4	L281 T282 P305 L321 A326	L281-V286 HydrophobicContact CD1-CB 3.8Å; L281-V286 HydrophobicContact CD1-CG2 3.97Å; T282-V286 PolarHBondContact O-N 2.63Å; V286-P305 WeakPolarHBondContact O-CD 3.38Å; V286-L321 HydrophobicContact CG2-CD2 4.12Å; V286-A326 HydrophobicContact CG2-CB 3.64Å
287	N	91.9	Very high	77.3	Confident	54 Å²	54	63.9 Å²	63.9	29%	0.289	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	20.4	177.5	-65.3	-44.2	0	0	0	113.4	N285 G325 A326 D327	N285-N287 PolarHBondContact O-N 3.42Å; N285-N287 VanDerWaalsContact O-N 3.11Å; N287-G325 PolarHBondContact ND2-O 3.15Å; N287-A326 WeakPolarHBondContact OD1-CA 3.49Å; N287-D327 PolarHBondContact OD1-N 3.16Å
288	C	90.6	Very high	74.8	Confident	11 Å²	11	68 Å²	68	7%	0.074	38%	0.381	C	S	.	.			trans	-62.4	146.6	178.3	74.2	0	0	0	0	111.6	K262 N285 T304 P305	K262-C288 HydrophobicContact CD-CB 3.97Å; K262-C288 HydrophobicContact CG-CB 4.01Å; N285-C288 HydrophobicContact CB-CB 4.36Å; N285-C288 WeakPolarHBondContact O-CB 3.18Å; N285-C288 PolarHBondContact O-N 3.07Å; N285-C288 PolarHBondContact O-SG 3.47Å; C288-T304 WeakPolarHBondContact O-CA 3.4Å; C288-P305 VanDerWaalsContact O-CD 3.24Å; C288-P305 WeakPolarHBondContact O-CD 3.41Å
289	H	86.8	Confident	72.5	Confident	64 Å²	64	73.8 Å²	73.8	30%	0.296	41%	0.408	S	S	.	.			trans	-106.7	142.4	177.1	-64.3	-97.3	0	0	0	111.9	K262 S291 L302 K331	K262-H289 WeakPolarHBondContact CE-O 3.38Å; K262-H289 PolarHBondContact NZ-O 2.88Å; H289-S291 PolarHBondContact O-N 3.43Å; H289-L302 HydrophobicContact CB-CB 4.36Å; H289-L302 HydrophobicContact CB-CD2 3.83Å; H289-L302 HydrophobicContact CB-CG 3.84Å; H289-L302 PolarHBondContact ND1-O 2.84Å; H289-K331 PolarHBondContact CE1-O 2.85Å
290	A	77.1	Confident	70.4	Confident	3 Å²	3	75.4 Å²	75.4	3%	0.025	40%	0.403	C	S	.	.			trans	-52.5	133.4	174.9	0	0	0	0	0	112.9	L266 K300 L302 S303	L266-A290 HydrophobicContact CD1-CB 3.92Å; A290-K300 HydrophobicContact CB-CD 4.25Å; A290-K300 HydrophobicContact CB-CG 4.1Å; A290-L302 VanDerWaalsContact O-CD1 3.25Å; A290-L302 WeakPolarHBondContact O-CD1 3.41Å; A290-L302 WeakPolarHBondContact O-CG 3.23Å; A290-S303 PolarHBondContact N-O 3.41Å
291	S	69.8	Low	68.6	Low	61 Å²	61	78.2 Å²	78.2	43%	0.427	42%	0.417	S	S	.	.			trans	-68	143.6	-178.1	-57.6	0	0	0	0	112.4	H289 G293	H289-S291 PolarHBondContact O-N 3.43Å; S291-G293 PolarHBondContact O-N 3.16Å
292	D	55.2	Low	67.3	Low	114 Å²	114	80.2 Å²	80.2	61%	0.61	43%	0.427	S	S	*	.			trans	-71.4	65.2	-179	-95.4	-26	0	0	0	113.6	L302 K333	D292-L302 VanDerWaalsContact OD1-CD1 3.3Å; D292-L302 WeakPolarHBondContact OD1-CD1 3.48Å; D292-K333 IonicContact OD1-NZ 2.64Å; D292-K333 PolarHBondContact OD1-NZ 2.84Å; D292-K333 IonicContact OD2-NZ 3.29Å; D292-K333 PolarHBondContact OD2-NZ 2.9Å
293	G	47.7	Very low	66.8	Low	59 Å²	59	80.8 Å²	80.8	61%	0.608	43%	0.431	S	S	*	.			trans	-91.4	111.6	-178.4	0	0	0	0	0	113.6	S291 K295	S291-G293 PolarHBondContact O-N 3.16Å; G293-K295 PolarHBondContact O-N 2.78Å
294	R	43.2	Very low	66.8	Low	258 Å²	258	77.5 Å²	77.5	97%	0.974	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	42.4	172.7	-80.8	-176.4	-97.3	166.1	-8.8	114.7
295	K	41.7	Very low	67	Low	211 Å²	211	74.2 Å²	74.2	92%	0.917	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.8	11.8	-175.4	-71.8	-167.3	178.4	-176.7	0	115.9	G293	G293-K295 PolarHBondContact O-N 2.78Å
296	S	40.3	Very low	67.1	Low	70 Å²	70	74 Å²	74	49%	0.49	39%	0.391	S	S	.	.			trans	-116	124.1	169.8	174.3	0	0	0	0	110.6	S298	S296-S298 PolarHBondContact O-N 3.27Å; S296-S298 PolarHBondContact OG-N 2.94Å; S296-S298 PolarHBondContact OG-O 2.78Å
297	T	40.5	Very low	67.2	Low	159 Å²	159	73.9 Å²	73.9	98%	0.975	39%	0.391	S	S	*	.	S	Bend	trans	-78.3	-0.4	172.1	43.4	0	0	0	0	113.4
298	S	44.1	Very low	67.2	Low	86 Å²	86	72.4 Å²	72.4	60%	0.601	38%	0.383	S	S	*	.	S	Bend	trans	-107.5	141.9	165.2	-73.5	0	0	0	0	110.8	S296 K300	S296-S298 PolarHBondContact O-N 3.27Å; S296-S298 PolarHBondContact OG-N 2.94Å; S296-S298 PolarHBondContact OG-O 2.78Å; S298-K300 VanDerWaalsContact C-N 3.3Å; S298-K300 PolarHBondContact O-N 2.84Å
299	Q	45.2	Very low	67.5	Low	179 Å²	179	71.9 Å²	71.9	84%	0.836	38%	0.379	S	S	*	.			trans	-60.3	74	-174.4	-62.1	174.4	-13.6	0	0	113.7	M301	Q299-M301 PolarHBondContact O-N 3.26Å
300	K	50.6	Low	67.9	Low	95 Å²	95	68.9 Å²	68.9	41%	0.413	37%	0.365	S	S	.	.			trans	-76.1	79.8	169.1	-154	-179.7	-171.6	-176.3	0	107.9	D263 A290 S298	D263-K300 IonicContact OD1-NZ 3.78Å; D263-K300 PolarHBondContact OD1-NZ 2.82Å; A290-K300 HydrophobicContact CB-CD 4.25Å; A290-K300 HydrophobicContact CB-CG 4.1Å; S298-K300 VanDerWaalsContact C-N 3.3Å; S298-K300 PolarHBondContact O-N 2.84Å
301	M	56.7	Low	68.7	Low	72 Å²	72	69 Å²	69	36%	0.355	37%	0.367	S	S	.	.			trans	-60	170.5	168.6	-60.8	-143.5	-143.3	0	0	110	Q299 S303	Q299-M301 PolarHBondContact O-N 3.26Å; M301-S303 PolarHBondContact O-N 3.37Å
302	L	66.8	Low	69.9	Low	42 Å²	42	71 Å²	71	22%	0.22	37%	0.366	C	S	.	.	S	Bend	trans	-72.4	48.2	177.5	-118.9	85.2	0	0	0	112.3	H289 A290 D292 K333	H289-L302 HydrophobicContact CB-CB 4.36Å; H289-L302 HydrophobicContact CB-CD2 3.83Å; H289-L302 HydrophobicContact CB-CG 3.84Å; H289-L302 PolarHBondContact ND1-O 2.84Å; A290-L302 VanDerWaalsContact O-CD1 3.25Å; A290-L302 WeakPolarHBondContact O-CD1 3.41Å; A290-L302 WeakPolarHBondContact O-CG 3.23Å; D292-L302 VanDerWaalsContact OD1-CD1 3.3Å; D292-L302 WeakPolarHBondContact OD1-CD1 3.48Å; L302-K333 HydrophobicContact CB-CB 4.26Å; L302-K333 HydrophobicContact CB-CD 4.21Å; L302-K333 HydrophobicContact CB-CG 3.98Å; L302-K333 HydrophobicContact CD1-CD 3.98Å
303	S	83.4	Confident	71.8	Confident	13 Å²	13	69.1 Å²	69.1	9%	0.091	36%	0.356	C	S	.	.			trans	-72.5	138.9	-178.7	-55.4	0	0	0	0	110.9	A290 M301	A290-S303 PolarHBondContact N-O 3.41Å; M301-S303 PolarHBondContact O-N 3.37Å
304	T	92.8	Very high	74.2	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.343	C	S	.	.			trans	-79.4	167.2	169.6	70.1	0	0	0	0	111.2	C288 L306 H307 L308 A330	C288-T304 WeakPolarHBondContact O-CA 3.4Å; T304-L306 PolarHBondContact O-N 2.96Å; T304-L306 VanDerWaalsContact O-N 3.16Å; T304-L306 PolarHBondContact OG1-N 3.07Å; T304-H307 PolarHBondContact N-ND1 2.84Å; T304-H307 WeakPolarHBondContact O-CB 3.43Å; T304-H307 PolarHBondContact O-N 3.29Å; T304-H307 VanDerWaalsContact O-N 3.08Å; T304-H307 PolarHBondContact OG1-N 3.16Å; T304-H307 PolarHBondContact OG1-ND1 3.4Å; T304-L308 PolarHBondContact O-N 3.41Å; T304-A330 HydrophobicContact CG2-CB 4.05Å
305	P	95.1	Very high	76.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-49.4	-39.3	171.3	-29.9	36.2	0	0	0	112.6	L265 L266 A269 V286 C288 L308 A309 L321	L265-P305 HydrophobicContact CD2-CG 4.35Å; L266-P305 HydrophobicContact CD2-CG 3.89Å; A269-P305 HydrophobicContact CB-CB 3.81Å; V286-P305 WeakPolarHBondContact O-CD 3.38Å; C288-P305 VanDerWaalsContact O-CD 3.24Å; C288-P305 WeakPolarHBondContact O-CD 3.41Å; P305-L308 PolarHBondContact O-N 3.27Å; P305-A309 VanDerWaalsContact O-CB 3.3Å; P305-A309 WeakPolarHBondContact O-CB 2.95Å; P305-A309 PolarHBondContact O-N 3.43Å; P305-L321 VanDerWaalsContact C-CD1 3.49Å; P305-L321 HydrophobicContact CB-CD1 3.74Å; P305-L321 HydrophobicContact CB-CD2 3.78Å; P305-L321 HydrophobicContact CB-CG 4.45Å
306	L	96.5	Very high	79.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68	-38.7	-179.9	-170.3	61.4	0	0	0	112.6	T304 L308 A310 V318 L321 L322 A326 V328 P338 L354	T304-L306 PolarHBondContact O-N 2.96Å; T304-L306 VanDerWaalsContact O-N 3.16Å; T304-L306 PolarHBondContact OG1-N 3.07Å; L306-L308 VanDerWaalsContact C-N 3.33Å; L306-L308 PolarHBondContact O-N 3.44Å; L306-A310 WeakPolarHBondContact O-CB 3.25Å; L306-A310 PolarHBondContact O-N 3.41Å; L306-V318 HydrophobicContact CD1-CB 4.45Å; L306-V318 HydrophobicContact CD1-CG1 3.9Å; L306-V318 HydrophobicContact CD1-CG2 4.45Å; L306-L321 HydrophobicContact CB-CD1 4.31Å; L306-L321 HydrophobicContact CD1-CB 4.21Å; L306-L321 HydrophobicContact CD1-CD1 4.32Å; L306-L322 HydrophobicContact CD1-CD2 4.32Å; L306-L322 HydrophobicContact CD1-CG 4.27Å; L306-L322 HydrophobicContact CD2-CD2 3.98Å; L306-A326 HydrophobicContact CB-CB 4.21Å; L306-A326 HydrophobicContact CD1-CB 4.48Å; L306-A326 HydrophobicContact CD2-CB 3.85Å; L306-A326 HydrophobicContact CG-CB 4.41Å; L306-V328 HydrophobicContact CD2-CG1 4.29Å; L306-P338 HydrophobicContact CB-CG 4.19Å; L306-P338 HydrophobicContact CD2-CB 4.25Å; L306-P338 HydrophobicContact CD2-CG 3.88Å; L306-P338 HydrophobicContact CG-CB 3.94Å; L306-P338 HydrophobicContact CG-CG 3.86Å; L306-L354 HydrophobicContact CD1-CD2 4.18Å; L306-L354 HydrophobicContact CD2-CD2 4.11Å; L306-L354 HydrophobicContact CG-CD2 4.29Å
307	H	94.8	Very high	82.1	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-40.1	173.5	-75.1	88.6	0	0	0	112.7	T304 G311 A330 L336 P338 N341	T304-H307 PolarHBondContact N-ND1 2.84Å; T304-H307 WeakPolarHBondContact O-CB 3.43Å; T304-H307 PolarHBondContact O-N 3.29Å; T304-H307 VanDerWaalsContact O-N 3.08Å; T304-H307 PolarHBondContact OG1-N 3.16Å; T304-H307 PolarHBondContact OG1-ND1 3.4Å; H307-G311 PolarHBondContact O-N 3.29Å; H307-A330 PolarHBondContact CE1-O 3.42Å; H307-A330 PolarHBondContact NE2-O 2.84Å; H307-L336 PolarHBondContact NE2-O 3.16Å; H307-P338 WeakPolarHBondContact NE2-CD 3.45Å; H307-N341 PolarHBondContact O-ND2 2.64Å
308	L	93.2	Very high	84.8	Confident	24 Å²	24	44.4 Å²	44.4	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-72.4	-50.1	179.5	-65.1	174.8	0	0	0	110.5	L266 R270 T304 P305 L306 A310 G311 Y312	L266-L308 HydrophobicContact CB-CD1 3.94Å; L266-L308 HydrophobicContact CD2-CD1 3.78Å; L266-L308 HydrophobicContact CG-CD1 4.47Å; L266-L308 WeakPolarHBondContact O-CD1 3.45Å; R270-L308 HydrophobicContact CB-CB 4.19Å; R270-L308 HydrophobicContact CB-CD1 4.48Å; T304-L308 PolarHBondContact O-N 3.41Å; P305-L308 PolarHBondContact O-N 3.27Å; L306-L308 VanDerWaalsContact C-N 3.33Å; L306-L308 PolarHBondContact O-N 3.44Å; L308-A310 VanDerWaalsContact C-N 3.26Å; L308-A310 PolarHBondContact O-N 2.97Å; L308-G311 PolarHBondContact O-N 2.64Å; L308-Y312 WeakPolarHBondContact O-CB 3.48Å; L308-Y312 VanDerWaalsContact O-CD2 3.31Å; L308-Y312 WeakPolarHBondContact O-CD2 3.33Å; L308-Y312 PolarHBondContact O-N 3.43Å
309	A	96.4	Very high	87.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.3	-41.5	176.3	0	0	0	0	0	111.6	P305 N313 R314 I317 V318 L321	P305-A309 VanDerWaalsContact O-CB 3.3Å; P305-A309 WeakPolarHBondContact O-CB 2.95Å; P305-A309 PolarHBondContact O-N 3.43Å; A309-N313 PolarHBondContact O-N 3.11Å; A309-R314 HydrophobicContact CB-CB 4.17Å; A309-R314 PolarHBondContact O-N 3.3Å; A309-I317 HydrophobicContact CB-CB 4.09Å; A309-I317 HydrophobicContact CB-CG2 3.51Å; A309-V318 HydrophobicContact CB-CG2 3.65Å; A309-L321 HydrophobicContact CB-CD1 3.92Å
310	A	95.9	Very high	89.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-47.9	177.6	0	0	0	0	0	112.6	L306 L308 Y312 N313 P338 A342 H347 V350 L354	L306-A310 WeakPolarHBondContact O-CB 3.25Å; L306-A310 PolarHBondContact O-N 3.41Å; L308-A310 VanDerWaalsContact C-N 3.26Å; L308-A310 PolarHBondContact O-N 2.97Å; A310-Y312 VanDerWaalsContact C-N 3.33Å; A310-Y312 PolarHBondContact O-N 2.77Å; A310-N313 PolarHBondContact O-N 2.85Å; A310-P338 HydrophobicContact CB-CB 4.24Å; A310-A342 HydrophobicContact CB-CB 4.41Å; A310-H347 PolarHBondContact O-CD2 3.14Å; A310-V350 HydrophobicContact CB-CG1 3.77Å; A310-L354 HydrophobicContact CB-CD1 4.16Å
311	G	93.5	Very high	92	Very high	7 Å²	7	31 Å²	31	7%	0.072	14%	0.143	C	C	.	.	H	α-helix	trans	-68.8	-26	-179.6	0	0	0	0	0	114.8	H307 L308 H347	H307-G311 PolarHBondContact O-N 3.29Å; L308-G311 PolarHBondContact O-N 2.64Å; G311-H347 PolarHBondContact O-CD2 3.35Å; G311-H347 PolarHBondContact O-NE2 3.25Å
312	Y	93.9	Very high	93.8	Very high	103 Å²	103	28.2 Å²	28.2	40%	0.404	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	17.2	-179.6	-73.1	-99.7	0	0	0	113.7	R270 L308 A310 R314	R270-Y312 HydrophobicContact CG-CD1 4.12Å; R270-Y312 HydrophobicContact CG-CD2 3.8Å; R270-Y312 HydrophobicContact CG-CE1 4.1Å; R270-Y312 HydrophobicContact CG-CE2 3.79Å; R270-Y312 HydrophobicContact CG-CG 3.97Å; R270-Y312 VanDerWaalsContact NE-CZ 3.3Å; R270-Y312 PolarHBondContact NE-OH 3.25Å; R270-Y312 VanDerWaalsContact NE-OH 3.13Å; R270-Y312 PolarHBondContact NH2-OH 3.24Å; L308-Y312 WeakPolarHBondContact O-CB 3.48Å; L308-Y312 VanDerWaalsContact O-CD2 3.31Å; L308-Y312 WeakPolarHBondContact O-CD2 3.33Å; L308-Y312 PolarHBondContact O-N 3.43Å; A310-Y312 VanDerWaalsContact C-N 3.33Å; A310-Y312 PolarHBondContact O-N 2.77Å; Y312-R314 VanDerWaalsContact C-N 3.35Å; Y312-R314 WeakPolarHBondContact O-CD 3.34Å; Y312-R314 PolarHBondContact O-N 2.78Å; Y312-R314 PolarHBondContact O-NE 3.05Å
313	N	95.7	Very high	95.1	Very high	74 Å²	74	32.3 Å²	32.3	40%	0.396	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	41.5	179	-158.2	25.1	0	0	0	115	A309 A310 V315 H347 V350	A309-N313 PolarHBondContact O-N 3.11Å; A310-N313 PolarHBondContact O-N 2.85Å; N313-V315 VanDerWaalsContact C-N 3.3Å; N313-V315 PolarHBondContact O-N 2.8Å; N313-V315 VanDerWaalsContact O-N 3.15Å; N313-H347 HydrophobicContact CB-CB 4.49Å; N313-V350 WeakPolarHBondContact OD1-CG2 3.4Å
314	R	96.9	Very high	95.5	Very high	91 Å²	91	34.2 Å²	34.2	34%	0.343	16%	0.155	S	C	.	.			trans	-90	64.4	-179.1	-53.8	-51.2	-173	-173	1.8	110.8	A269 R270 S271 A309 Y312 R316 I317 V318	A269-R314 WeakPolarHBondContact O-CG 3.44Å; R270-R314 PolarHBondContact O-NE 2.74Å; R270-R314 PolarHBondContact O-NH2 2.94Å; S271-R314 PolarHBondContact O-NE 3.34Å; S271-R314 PolarHBondContact O-NH2 2.82Å; S271-R314 VanDerWaalsContact O-NH2 3.1Å; A309-R314 HydrophobicContact CB-CB 4.17Å; A309-R314 PolarHBondContact O-N 3.3Å; Y312-R314 VanDerWaalsContact C-N 3.35Å; Y312-R314 WeakPolarHBondContact O-CD 3.34Å; Y312-R314 PolarHBondContact O-N 2.78Å; Y312-R314 PolarHBondContact O-NE 3.05Å; R314-R316 VanDerWaalsContact C-N 3.25Å; R314-R316 PolarHBondContact O-N 2.98Å; R314-R316 VanDerWaalsContact O-N 3.1Å; R314-I317 HydrophobicContact CB-CB 3.74Å; R314-I317 HydrophobicContact CB-CG1 3.81Å; R314-I317 CarbonylContact O-C 3.47Å; R314-I317 WeakPolarHBondContact O-CA 3.27Å; R314-I317 WeakPolarHBondContact O-CB 3.01Å; R314-I317 PolarHBondContact O-N 3.33Å; R314-V318 WeakPolarHBondContact O-CG2 3.19Å; R314-V318 PolarHBondContact O-N 3.31Å
315	V	96.8	Very high	95.4	Very high	31 Å²	31	36.6 Å²	36.6	19%	0.188	18%	0.179	C	C	.	.	H	α-helix	trans	-45	-48.1	-173.7	-179.2	0	0	0	0	112.5	N313 V318 Q319 E349 V350	N313-V315 VanDerWaalsContact C-N 3.3Å; N313-V315 PolarHBondContact O-N 2.8Å; N313-V315 VanDerWaalsContact O-N 3.15Å; V315-V318 PolarHBondContact O-N 2.97Å; V315-Q319 WeakPolarHBondContact O-CG 3.39Å; V315-Q319 PolarHBondContact O-N 3.38Å; V315-E349 HydrophobicContact CG2-CB 4.21Å; V315-V350 HydrophobicContact CG2-CG2 3.9Å
316	R	97.3	Very high	95.5	Very high	112 Å²	112	37 Å²	37	42%	0.423	18%	0.183	S	C	.	.	H	α-helix	trans	-68.5	-39.2	-179.6	-173.5	52.8	179.8	171.4	3.8	113.8	E274 R314 V318 Q319 L320	E274-R316 HydrophobicContact CG-CG 4.21Å; E274-R316 WeakPolarHBondContact OE1-CG 3.37Å; E274-R316 WeakPolarHBondContact OE2-CG 3.44Å; E274-R316 IonicContact OE2-NE 2.65Å; R314-R316 VanDerWaalsContact C-N 3.25Å; R314-R316 PolarHBondContact O-N 2.98Å; R314-R316 VanDerWaalsContact O-N 3.1Å; R316-V318 VanDerWaalsContact C-N 3.35Å; R316-Q319 WeakPolarHBondContact O-CB 3.46Å; R316-Q319 PolarHBondContact O-N 2.98Å; R316-L320 HydrophobicContact CG-CD1 4.5Å; R316-L320 WeakPolarHBondContact O-CG 3.39Å; R316-L320 PolarHBondContact O-N 2.82Å
317	I	97.8	Very high	95.4	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-42	171.2	-60.1	-65.2	0	0	0	110.8	A269 E274 L277 A309 R314 Q319 L320 L321	A269-I317 HydrophobicContact CB-CG2 4.04Å; E274-I317 HydrophobicContact CB-CD1 4.39Å; E274-I317 HydrophobicContact CG-CD1 3.74Å; L277-I317 HydrophobicContact CB-CD1 4.25Å; L277-I317 HydrophobicContact CD1-CG2 4.32Å; L277-I317 HydrophobicContact CD2-CD1 3.96Å; L277-I317 HydrophobicContact CD2-CG2 4.06Å; A309-I317 HydrophobicContact CB-CB 4.09Å; A309-I317 HydrophobicContact CB-CG2 3.51Å; R314-I317 HydrophobicContact CB-CB 3.74Å; R314-I317 HydrophobicContact CB-CG1 3.81Å; R314-I317 CarbonylContact O-C 3.47Å; R314-I317 WeakPolarHBondContact O-CA 3.27Å; R314-I317 WeakPolarHBondContact O-CB 3.01Å; R314-I317 PolarHBondContact O-N 3.33Å; I317-Q319 VanDerWaalsContact C-N 3.33Å; I317-Q319 PolarHBondContact O-N 3.21Å; I317-L320 PolarHBondContact O-N 2.88Å; I317-L321 HydrophobicContact CG2-CD1 3.71Å; I317-L321 HydrophobicContact CG2-CG 4.09Å; I317-L321 WeakPolarHBondContact O-CB 3.36Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.34Å; I317-L321 PolarHBondContact O-N 3.35Å
318	V	97.9	Very high	95.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-44.4	176.8	176.2	0	0	0	0	110.2	L306 A309 R314 V315 R316 L321 L322 V350 L353 L354	L306-V318 HydrophobicContact CD1-CB 4.45Å; L306-V318 HydrophobicContact CD1-CG1 3.9Å; L306-V318 HydrophobicContact CD1-CG2 4.45Å; A309-V318 HydrophobicContact CB-CG2 3.65Å; R314-V318 WeakPolarHBondContact O-CG2 3.19Å; R314-V318 PolarHBondContact O-N 3.31Å; V315-V318 PolarHBondContact O-N 2.97Å; R316-V318 VanDerWaalsContact C-N 3.35Å; V318-L321 PolarHBondContact O-N 3.5Å; V318-L322 HydrophobicContact CG1-CD1 3.74Å; V318-L322 HydrophobicContact CG1-CG 4.38Å; V318-L322 WeakPolarHBondContact O-CB 3.33Å; V318-L322 WeakPolarHBondContact O-CD1 3.33Å; V318-L322 WeakPolarHBondContact O-CG 3.36Å; V318-L322 PolarHBondContact O-N 3.05Å; V318-V350 HydrophobicContact CG2-CG1 4.25Å; V318-V350 HydrophobicContact CG2-CG2 4.4Å; V318-L353 HydrophobicContact CB-CD2 4.17Å; V318-L353 HydrophobicContact CG1-CD2 3.66Å; V318-L353 HydrophobicContact CG1-CG 4.35Å; V318-L354 HydrophobicContact CG1-CD2 4.37Å
319	Q	97.3	Very high	95.6	Very high	65 Å²	65	44 Å²	44	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-57.6	-50.1	173.3	-69	173.5	-3.2	0	0	112.3	V315 R316 I317 L322 Q323 L353	V315-Q319 WeakPolarHBondContact O-CG 3.39Å; V315-Q319 PolarHBondContact O-N 3.38Å; R316-Q319 WeakPolarHBondContact O-CB 3.46Å; R316-Q319 PolarHBondContact O-N 2.98Å; I317-Q319 VanDerWaalsContact C-N 3.33Å; I317-Q319 PolarHBondContact O-N 3.21Å; Q319-L322 PolarHBondContact O-N 2.91Å; Q319-Q323 WeakPolarHBondContact O-CB 3.34Å; Q319-Q323 VanDerWaalsContact O-CG 3.25Å; Q319-Q323 WeakPolarHBondContact O-CG 3.29Å; Q319-Q323 PolarHBondContact O-N 3.19Å; Q319-L353 HydrophobicContact CB-CD2 4.46Å; Q319-L353 HydrophobicContact CG-CD2 3.55Å
320	L	96.1	Very high	95.4	Very high	13 Å²	13	44.4 Å²	44.4	7%	0.068	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-45	-179.3	-69	169.2	0	0	0	111.7	E274 L277 M278 R316 I317 L322 Q323 H324	E274-L320 HydrophobicContact CB-CD1 4.38Å; E274-L320 HydrophobicContact CG-CD1 4.17Å; L277-L320 HydrophobicContact CD2-CB 4.18Å; L277-L320 HydrophobicContact CD2-CD1 4.4Å; M278-L320 HydrophobicContact CG-CD1 4.32Å; M278-L320 HydrophobicContact SD-CB 4.33Å; M278-L320 HydrophobicContact SD-CD1 4.13Å; M278-L320 HydrophobicContact SD-CD2 4.05Å; M278-L320 HydrophobicContact SD-CG 4.4Å; R316-L320 HydrophobicContact CG-CD1 4.5Å; R316-L320 WeakPolarHBondContact O-CG 3.39Å; R316-L320 PolarHBondContact O-N 2.82Å; I317-L320 PolarHBondContact O-N 2.88Å; L320-L322 PolarHBondContact O-N 3.08Å; L320-Q323 PolarHBondContact O-N 3.27Å; L320-H324 PolarHBondContact O-CD2 2.99Å; L320-H324 VanDerWaalsContact O-CD2 3.29Å; L320-H324 PolarHBondContact O-N 3.18Å
321	L	96.9	Very high	95.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.5	-45	176.7	-73.6	174.9	0	0	0	111.7	L277 L281 V286 P305 L306 A309 I317 V318 H324 G325 A326	L277-L321 HydrophobicContact CD1-CD2 4.29Å; L277-L321 HydrophobicContact CD2-CD2 4.33Å; L277-L321 HydrophobicContact CD2-CG 4.36Å; L281-L321 HydrophobicContact CD1-CD2 3.94Å; L281-L321 HydrophobicContact CD2-CD2 4.19Å; V286-L321 HydrophobicContact CG2-CD2 4.12Å; P305-L321 VanDerWaalsContact C-CD1 3.49Å; P305-L321 HydrophobicContact CB-CD1 3.74Å; P305-L321 HydrophobicContact CB-CD2 3.78Å; P305-L321 HydrophobicContact CB-CG 4.45Å; L306-L321 HydrophobicContact CB-CD1 4.31Å; L306-L321 HydrophobicContact CD1-CB 4.21Å; L306-L321 HydrophobicContact CD1-CD1 4.32Å; A309-L321 HydrophobicContact CB-CD1 3.92Å; I317-L321 HydrophobicContact CG2-CD1 3.71Å; I317-L321 HydrophobicContact CG2-CG 4.09Å; I317-L321 WeakPolarHBondContact O-CB 3.36Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.34Å; I317-L321 PolarHBondContact O-N 3.35Å; V318-L321 PolarHBondContact O-N 3.5Å; L321-H324 CarbonylContact O-C 3.43Å; L321-H324 PolarHBondContact O-N 3.29Å; L321-G325 PolarHBondContact O-N 3.31Å; L321-A326 VanDerWaalsContact C-CB 3.48Å; L321-A326 HydrophobicContact CB-CB 3.82Å; L321-A326 WeakPolarHBondContact O-CB 3.38Å; L321-A326 PolarHBondContact O-N 3.14Å
322	L	95.7	Very high	94.8	Very high	15 Å²	15	50 Å²	50	8%	0.079	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-37.2	177.6	-68.1	169.3	0	0	0	112.3	L306 V318 Q319 L320 H324 G325 V328 L353 L354 H357	L306-L322 HydrophobicContact CD1-CD2 4.32Å; L306-L322 HydrophobicContact CD1-CG 4.27Å; L306-L322 HydrophobicContact CD2-CD2 3.98Å; V318-L322 HydrophobicContact CG1-CD1 3.74Å; V318-L322 HydrophobicContact CG1-CG 4.38Å; V318-L322 WeakPolarHBondContact O-CB 3.33Å; V318-L322 WeakPolarHBondContact O-CD1 3.33Å; V318-L322 WeakPolarHBondContact O-CG 3.36Å; V318-L322 PolarHBondContact O-N 3.05Å; Q319-L322 PolarHBondContact O-N 2.91Å; L320-L322 PolarHBondContact O-N 3.08Å; L322-H324 VanDerWaalsContact C-N 3.28Å; L322-H324 PolarHBondContact O-N 2.83Å; L322-G325 PolarHBondContact O-N 2.86Å; L322-V328 HydrophobicContact CD2-CG1 3.41Å; L322-V328 VanDerWaalsContact CD2-CG1 3.41Å; L322-L353 HydrophobicContact CD1-CD1 4.49Å; L322-L353 HydrophobicContact CD1-CD2 4.15Å; L322-L353 HydrophobicContact CD1-CG 3.84Å; L322-L354 HydrophobicContact CD1-CD2 4.47Å; L322-L354 HydrophobicContact CD2-CD2 4.48Å; L322-H357 HydrophobicContact CD1-CB 4.23Å; L322-H357 HydrophobicContact CD2-CB 4.15Å
323	Q	93.4	Very high	94.2	Very high	128 Å²	128	50.3 Å²	50.3	60%	0.598	25%	0.248	S	C	*	.	H	α-helix	trans	-62.6	-34.8	173	-74.6	169.4	3.6	0	0	112.2	Q319 L320	Q319-Q323 WeakPolarHBondContact O-CB 3.34Å; Q319-Q323 VanDerWaalsContact O-CG 3.25Å; Q319-Q323 WeakPolarHBondContact O-CG 3.29Å; Q319-Q323 PolarHBondContact O-N 3.19Å; L320-Q323 PolarHBondContact O-N 3.27Å
324	H	91.5	Very high	93.6	Very high	53 Å²	53	46.9 Å²	46.9	25%	0.245	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	20.1	177.4	-74.8	-79.7	0	0	0	114.3	L281 L320 L321 L322	L281-H324 HydrophobicContact CD2-CB 3.82Å; L281-H324 HydrophobicContact CG-CB 4.33Å; L320-H324 PolarHBondContact O-CD2 2.99Å; L320-H324 VanDerWaalsContact O-CD2 3.29Å; L320-H324 PolarHBondContact O-N 3.18Å; L321-H324 CarbonylContact O-C 3.43Å; L321-H324 PolarHBondContact O-N 3.29Å; L322-H324 VanDerWaalsContact C-N 3.28Å; L322-H324 PolarHBondContact O-N 2.83Å
325	G	91.8	Very high	93.3	Very high	49 Å²	49	42.7 Å²	42.7	51%	0.505	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	26.9	170.2	0	0	0	0	0	115.6	N287 L321 L322 D327	N287-G325 PolarHBondContact ND2-O 3.15Å; L321-G325 PolarHBondContact O-N 3.31Å; L322-G325 PolarHBondContact O-N 2.86Å; G325-D327 PolarHBondContact O-N 2.89Å
326	A	95.9	Very high	93.1	Very high	10 Å²	10	42.3 Å²	42.3	8%	0.083	21%	0.212	C	C	.	.			trans	-63.2	131.5	171.1	0	0	0	0	0	111.8	V286 N287 L306 L321 V328	V286-A326 HydrophobicContact CG2-CB 3.64Å; N287-A326 WeakPolarHBondContact OD1-CA 3.49Å; L306-A326 HydrophobicContact CB-CB 4.21Å; L306-A326 HydrophobicContact CD1-CB 4.48Å; L306-A326 HydrophobicContact CD2-CB 3.85Å; L306-A326 HydrophobicContact CG-CB 4.41Å; L321-A326 VanDerWaalsContact C-CB 3.48Å; L321-A326 HydrophobicContact CB-CB 3.82Å; L321-A326 WeakPolarHBondContact O-CB 3.38Å; L321-A326 PolarHBondContact O-N 3.14Å; A326-V328 PolarHBondContact O-N 3.26Å
327	D	94.8	Very high	93	Very high	66 Å²	66	37.1 Å²	37.1	35%	0.353	19%	0.193	S	C	.	.			trans	-80	112.6	-177.6	175.7	19	0	0	0	110.9	N287 G325 H329 A330	N287-D327 PolarHBondContact OD1-N 3.16Å; G325-D327 PolarHBondContact O-N 2.89Å; D327-H329 PolarHBondContact O-N 3.16Å; D327-H329 WeakPolarHBondContact OD1-CA 3.13Å; D327-H329 WeakPolarHBondContact OD1-CB 3.34Å; D327-H329 IonicContact OD1-CD2 2.68Å; D327-H329 IonicContact OD1-CG 2.82Å; D327-H329 PolarHBondContact OD1-N 3.46Å; D327-A330 HydrophobicContact CB-CB 4.07Å; D327-A330 VanDerWaalsContact CG-N 3.28Å; D327-A330 WeakPolarHBondContact O-CB 3.45Å; D327-A330 PolarHBondContact O-N 2.68Å; D327-A330 PolarHBondContact OD1-N 2.85Å; D327-A330 WeakPolarHBondContact OD2-CA 3.28Å; D327-A330 PolarHBondContact OD2-N 3.02Å
328	V	96.1	Very high	92.9	Very high	13 Å²	13	37 Å²	37	8%	0.079	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-13.9	175	-66.3	0	0	0	0	113.7	L306 L322 A326 L354 H357 A359	L306-V328 HydrophobicContact CD2-CG1 4.29Å; L322-V328 HydrophobicContact CD2-CG1 3.41Å; L322-V328 VanDerWaalsContact CD2-CG1 3.41Å; A326-V328 PolarHBondContact O-N 3.26Å; V328-L354 HydrophobicContact CG1-CD2 4.05Å; V328-H357 HydrophobicContact CG1-CB 4.1Å; V328-A359 HydrophobicContact CB-CB 4.07Å; V328-A359 HydrophobicContact CG2-CB 4.47Å
329	H	95.4	Very high	92.9	Very high	91 Å²	91	37 Å²	37	42%	0.421	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-0.8	177.3	-54.1	-60	0	0	0	113.4	D327 K331 V337 G358	D327-H329 PolarHBondContact O-N 3.16Å; D327-H329 WeakPolarHBondContact OD1-CA 3.13Å; D327-H329 WeakPolarHBondContact OD1-CB 3.34Å; D327-H329 IonicContact OD1-CD2 2.68Å; D327-H329 IonicContact OD1-CG 2.82Å; D327-H329 PolarHBondContact OD1-N 3.46Å; H329-K331 PolarHBondContact O-N 3.33Å; H329-V337 WeakPolarHBondContact O-CG1 3.43Å; H329-G358 PolarHBondContact CE1-O 2.81Å
330	A	92.6	Very high	92.9	Very high	9 Å²	9	34 Å²	34	7%	0.074	18%	0.178	C	C	.	.			trans	-53.4	132.6	177.5	0	0	0	0	0	109.3	T304 H307 D327 V337 P338	T304-A330 HydrophobicContact CG2-CB 4.05Å; H307-A330 PolarHBondContact CE1-O 3.42Å; H307-A330 PolarHBondContact NE2-O 2.84Å; D327-A330 HydrophobicContact CB-CB 4.07Å; D327-A330 VanDerWaalsContact CG-N 3.28Å; D327-A330 WeakPolarHBondContact O-CB 3.45Å; D327-A330 PolarHBondContact O-N 2.68Å; D327-A330 PolarHBondContact OD1-N 2.85Å; D327-A330 WeakPolarHBondContact OD2-CA 3.28Å; D327-A330 PolarHBondContact OD2-N 3.02Å; A330-V337 WeakPolarHBondContact O-CA 3.38Å; A330-P338 WeakPolarHBondContact O-CD 3.41Å
331	K	90.4	Very high	92.8	Very high	111 Å²	111	34.7 Å²	34.7	48%	0.483	18%	0.182	S	C	.	.			trans	-103.9	135	179.8	-68.5	-165.2	176.1	-151.7	0	111.5	H289 H329 L336 V337 M364	H289-K331 PolarHBondContact CE1-O 2.85Å; H329-K331 PolarHBondContact O-N 3.33Å; K331-L336 CarbonylContact C-O 3.58Å; K331-L336 VanDerWaalsContact CA-O 3.31Å; K331-L336 WeakPolarHBondContact CA-O 3.45Å; K331-V337 HydrophobicContact CG-CG1 3.93Å; K331-M364 PolarHBondContact NZ-O 3.37Å
332	D	87	Confident	92.9	Very high	14 Å²	14	34.7 Å²	34.7	8%	0.075	18%	0.182	C	C	.	.			trans	-80.5	-173.2	167	87.1	-9.2	0	0	0	112	G334 G335 L336	D332-G334 VanDerWaalsContact C-N 3.26Å; D332-G334 PolarHBondContact O-N 3.32Å; D332-G334 WeakPolarHBondContact OD1-CA 3.26Å; D332-G334 PolarHBondContact OD1-N 2.79Å; D332-G335 PolarHBondContact O-N 3.32Å; D332-G335 PolarHBondContact OD1-N 3.34Å; D332-L336 PolarHBondContact N-O 3.28Å; D332-L336 WeakPolarHBondContact OD1-CB 3.49Å; D332-L336 PolarHBondContact OD1-N 3.43Å; D332-L336 VanDerWaalsContact OD1-N 3.08Å
333	K	81.4	Confident	92.9	Very high	108 Å²	108	34 Å²	34	47%	0.47	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-24.7	179.5	-106.5	-179.8	175.6	177.7	0	115	D292 L302 G335 L366	D292-K333 IonicContact OD1-NZ 2.64Å; D292-K333 PolarHBondContact OD1-NZ 2.84Å; D292-K333 IonicContact OD2-NZ 3.29Å; D292-K333 PolarHBondContact OD2-NZ 2.9Å; L302-K333 HydrophobicContact CB-CB 4.26Å; L302-K333 HydrophobicContact CB-CD 4.21Å; L302-K333 HydrophobicContact CB-CG 3.98Å; L302-K333 HydrophobicContact CD1-CD 3.98Å; K333-G335 VanDerWaalsContact C-N 3.29Å; K333-L366 WeakPolarHBondContact O-CD1 3.42Å
334	G	83.3	Confident	93	Very high	2 Å²	2	28.8 Å²	28.8	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.9	172.6	0	0	0	0	0	113.1	D332 L336 L366	D332-G334 VanDerWaalsContact C-N 3.26Å; D332-G334 PolarHBondContact O-N 3.32Å; D332-G334 WeakPolarHBondContact OD1-CA 3.26Å; D332-G334 PolarHBondContact OD1-N 2.79Å; G334-L336 PolarHBondContact O-N 3.13Å; G334-L366 WeakPolarHBondContact O-CB 3.32Å; G334-L366 VanDerWaalsContact O-CG 3.28Å; G334-L366 WeakPolarHBondContact O-CG 3.39Å; G334-L366 PolarHBondContact O-N 2.92Å
335	G	89.1	Confident	93.1	Very high	4 Å²	4	33 Å²	33	4%	0.041	17%	0.171	C	C	.	.	S	Bend	trans	77.9	5.1	-170.8	0	0	0	0	0	113.6	D332 K333	D332-G335 PolarHBondContact O-N 3.32Å; D332-G335 PolarHBondContact OD1-N 3.34Å; K333-G335 VanDerWaalsContact C-N 3.29Å
336	L	92.8	Very high	93.3	Very high	23 Å²	23	31.9 Å²	31.9	12%	0.12	16%	0.159	C	C	.	.			trans	-67.1	140.7	177.5	-60.2	165.2	0	0	0	108.8	H307 K331 D332 G334 H340 D365	H307-L336 PolarHBondContact NE2-O 3.16Å; K331-L336 CarbonylContact C-O 3.58Å; K331-L336 VanDerWaalsContact CA-O 3.31Å; K331-L336 WeakPolarHBondContact CA-O 3.45Å; D332-L336 PolarHBondContact N-O 3.28Å; D332-L336 WeakPolarHBondContact OD1-CB 3.49Å; D332-L336 PolarHBondContact OD1-N 3.43Å; D332-L336 VanDerWaalsContact OD1-N 3.08Å; G334-L336 PolarHBondContact O-N 3.13Å; L336-H340 HydrophobicContact CB-CB 4.24Å; L336-H340 HydrophobicContact CD2-CB 3.74Å; L336-D365 HydrophobicContact CD2-CB 3.82Å; L336-D365 HydrophobicContact CG-CB 4.34Å
337	V	95.6	Very high	93.3	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.018	16%	0.163	C	C	.	.			trans	-99.8	160.8	166.3	-60.6	0	0	0	0	110	H329 A330 K331 L339 H340 A363	H329-V337 WeakPolarHBondContact O-CG1 3.43Å; A330-V337 WeakPolarHBondContact O-CA 3.38Å; K331-V337 HydrophobicContact CG-CG1 3.93Å; V337-L339 HydrophobicContact CG2-CB 4.12Å; V337-L339 PolarHBondContact O-N 3.42Å; V337-H340 VanDerWaalsContact CG2-ND1 3.32Å; V337-H340 WeakPolarHBondContact CG2-ND1 3.23Å; V337-H340 PolarHBondContact N-ND1 3.15Å; V337-H340 WeakPolarHBondContact O-CB 3.3Å; V337-H340 PolarHBondContact O-N 3.03Å; V337-H340 PolarHBondContact O-ND1 3.01Å; V337-A363 HydrophobicContact CG1-CB 4.47Å; V337-A363 HydrophobicContact CG2-CB 3.75Å
338	P	96.3	Very high	93.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-52.8	-29.3	-176.1	-28.4	35.1	0	0	0	114.9	L306 H307 A310 A330 H340 N341 A342 L354	L306-P338 HydrophobicContact CB-CG 4.19Å; L306-P338 HydrophobicContact CD2-CB 4.25Å; L306-P338 HydrophobicContact CD2-CG 3.88Å; L306-P338 HydrophobicContact CG-CB 3.94Å; L306-P338 HydrophobicContact CG-CG 3.86Å; H307-P338 WeakPolarHBondContact NE2-CD 3.45Å; A310-P338 HydrophobicContact CB-CB 4.24Å; A330-P338 WeakPolarHBondContact O-CD 3.41Å; P338-H340 VanDerWaalsContact C-N 3.31Å; P338-H340 PolarHBondContact O-N 2.96Å; P338-N341 PolarHBondContact O-N 3.23Å; P338-A342 PolarHBondContact O-N 2.88Å; P338-L354 HydrophobicContact CB-CD1 4.2Å; P338-L354 HydrophobicContact CB-CD2 4.38Å
339	L	97.8	Very high	93.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-35.9	175.5	-171.6	62.3	0	0	0	112.8	V337 N341 A342 C343 T351 L354 L355 A359 P371 L387	V337-L339 HydrophobicContact CG2-CB 4.12Å; V337-L339 PolarHBondContact O-N 3.42Å; L339-N341 VanDerWaalsContact C-N 3.34Å; L339-N341 PolarHBondContact O-N 3.34Å; L339-A342 PolarHBondContact O-N 3.31Å; L339-C343 VanDerWaalsContact O-CB 3.32Å; L339-C343 WeakPolarHBondContact O-CB 3.22Å; L339-C343 PolarHBondContact O-N 3.24Å; L339-C343 PolarHBondContact O-SG 3.5Å; L339-T351 HydrophobicContact CD1-CG2 3.8Å; L339-L354 HydrophobicContact CB-CD1 4.44Å; L339-L354 HydrophobicContact CD1-CB 4.08Å; L339-L354 HydrophobicContact CD1-CD1 4.33Å; L339-L355 HydrophobicContact CD1-CD2 4.34Å; L339-L355 HydrophobicContact CD1-CG 4.16Å; L339-L355 HydrophobicContact CD2-CD2 3.83Å; L339-A359 HydrophobicContact CB-CB 4.32Å; L339-A359 HydrophobicContact CD2-CB 3.99Å; L339-P371 HydrophobicContact CB-CG 4.29Å; L339-P371 HydrophobicContact CD2-CB 4.22Å; L339-P371 HydrophobicContact CD2-CG 3.82Å; L339-P371 HydrophobicContact CG-CB 3.99Å; L339-P371 HydrophobicContact CG-CG 3.88Å; L339-L387 HydrophobicContact CD2-CD2 4.48Å
340	H	97.4	Very high	93.6	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-43.2	175.6	-70	81	0	0	0	111.6	L336 V337 P338 C343 S344 A363 F369 P371	L336-H340 HydrophobicContact CB-CB 4.24Å; L336-H340 HydrophobicContact CD2-CB 3.74Å; V337-H340 VanDerWaalsContact CG2-ND1 3.32Å; V337-H340 WeakPolarHBondContact CG2-ND1 3.23Å; V337-H340 PolarHBondContact N-ND1 3.15Å; V337-H340 WeakPolarHBondContact O-CB 3.3Å; V337-H340 PolarHBondContact O-N 3.03Å; V337-H340 PolarHBondContact O-ND1 3.01Å; P338-H340 VanDerWaalsContact C-N 3.31Å; P338-H340 PolarHBondContact O-N 2.96Å; H340-C343 PolarHBondContact O-N 3.01Å; H340-S344 WeakPolarHBondContact O-CB 3.31Å; H340-S344 PolarHBondContact O-N 2.74Å; H340-A363 PolarHBondContact CE1-O 3.29Å; H340-A363 PolarHBondContact NE2-O 3.49Å; H340-F369 PolarHBondContact NE2-O 3.26Å; H340-P371 WeakPolarHBondContact NE2-CD 3.41Å
341	N	94.7	Very high	93.9	Very high	29 Å²	29	34.9 Å²	34.9	16%	0.155	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-46.3	179.2	-71.5	9.1	0	0	0	111.1	H307 P338 L339 C343 Y345	H307-N341 PolarHBondContact O-ND2 2.64Å; P338-N341 PolarHBondContact O-N 3.23Å; L339-N341 VanDerWaalsContact C-N 3.34Å; L339-N341 PolarHBondContact O-N 3.34Å; N341-C343 VanDerWaalsContact C-N 3.3Å; N341-C343 PolarHBondContact O-N 3.14Å; N341-Y345 VanDerWaalsContact O-CD2 3.32Å; N341-Y345 WeakPolarHBondContact O-CD2 3.47Å; N341-Y345 PolarHBondContact O-N 3.32Å
342	A	97.3	Very high	94.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-45.2	175	0	0	0	0	0	111.3	A310 P338 L339 G346 H347 V350 L354	A310-A342 HydrophobicContact CB-CB 4.41Å; P338-A342 PolarHBondContact O-N 2.88Å; L339-A342 PolarHBondContact O-N 3.31Å; A342-G346 PolarHBondContact O-N 3.05Å; A342-H347 PolarHBondContact O-N 2.92Å; A342-V350 HydrophobicContact CB-CB 4.28Å; A342-V350 HydrophobicContact CB-CG1 3.63Å; A342-L354 HydrophobicContact CB-CD1 4.08Å
343	C	97.4	Very high	94.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-71.8	-40.5	-176.1	-66.6	0	0	0	0	114.4	L339 H340 N341 Y345 G346 P371 A375 R380 V383 L387	L339-C343 VanDerWaalsContact O-CB 3.32Å; L339-C343 WeakPolarHBondContact O-CB 3.22Å; L339-C343 PolarHBondContact O-N 3.24Å; L339-C343 PolarHBondContact O-SG 3.5Å; H340-C343 PolarHBondContact O-N 3.01Å; N341-C343 VanDerWaalsContact C-N 3.3Å; N341-C343 PolarHBondContact O-N 3.14Å; C343-Y345 PolarHBondContact O-N 3.5Å; C343-G346 PolarHBondContact O-N 2.87Å; C343-P371 HydrophobicContact CB-CB 4.09Å; C343-P371 WeakPolarHBondContact CB-O 3.36Å; C343-A375 HydrophobicContact CB-CB 4.24Å; C343-R380 WeakPolarHBondContact O-CG 3.38Å; C343-V383 HydrophobicContact CB-CG1 4.01Å; C343-L387 HydrophobicContact CB-CD1 4.41Å
344	S	94.7	Very high	95.5	Very high	18 Å²	18	28.1 Å²	28.1	13%	0.126	14%	0.136	C	C	.	.	H	α-helix	trans	-63.9	-40.4	179.6	-163.5	0	0	0	0	112.1	H340 E374 R380	H340-S344 WeakPolarHBondContact O-CB 3.31Å; H340-S344 PolarHBondContact O-N 2.74Å; S344-E374 WeakPolarHBondContact CB-OE2 3.34Å; S344-E374 PolarHBondContact OG-OE2 3.37Å; S344-R380 PolarHBondContact O-NE 3.09Å; S344-R380 PolarHBondContact O-NH2 2.84Å; S344-R380 VanDerWaalsContact O-NH2 3.15Å
345	Y	93.6	Very high	96.1	Very high	142 Å²	142	28.7 Å²	28.7	56%	0.557	14%	0.139	S	C	*	.	H	α-helix	trans	-82.6	-16.8	177.3	-69.6	-70.5	0	0	0	114.2	N341 C343 H347 R380	N341-Y345 VanDerWaalsContact O-CD2 3.32Å; N341-Y345 WeakPolarHBondContact O-CD2 3.47Å; N341-Y345 PolarHBondContact O-N 3.32Å; C343-Y345 PolarHBondContact O-N 3.5Å; Y345-H347 WeakPolarHBondContact CB-NE2 3.4Å; Y345-H347 AromaticContact CG-NE2 3.98Å; Y345-R380 PolarHBondContact O-NH2 3.47Å
346	G	95.2	Very high	96.4	Very high	26 Å²	26	34.7 Å²	34.7	27%	0.268	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	23.2	175.3	0	0	0	0	0	114.9	A342 C343 Y348	A342-G346 PolarHBondContact O-N 3.05Å; C343-G346 PolarHBondContact O-N 2.87Å; G346-Y348 PolarHBondContact O-N 3.19Å
347	H	97.4	Very high	96.6	Very high	35 Å²	35	38.1 Å²	38.1	16%	0.162	18%	0.179	C	C	.	.			trans	-80.3	88.1	-173.9	-58.1	-39.8	0	0	0	111.2	A310 G311 N313 A342 Y345 V350 T351	A310-H347 PolarHBondContact O-CD2 3.14Å; G311-H347 PolarHBondContact O-CD2 3.35Å; G311-H347 PolarHBondContact O-NE2 3.25Å; N313-H347 HydrophobicContact CB-CB 4.49Å; A342-H347 PolarHBondContact O-N 2.92Å; Y345-H347 WeakPolarHBondContact CB-NE2 3.4Å; Y345-H347 AromaticContact CG-NE2 3.98Å; H347-V350 HydrophobicContact CB-CB 4.04Å; H347-V350 HydrophobicContact CB-CG2 4.27Å; H347-V350 PolarHBondContact O-N 3.48Å; H347-T351 WeakPolarHBondContact O-CB 3.3Å; H347-T351 PolarHBondContact O-N 3.19Å; H347-T351 PolarHBondContact O-OG1 3.15Å
348	Y	96.7	Very high	96.6	Very high	92 Å²	92	40.1 Å²	40.1	36%	0.361	20%	0.2	S	C	.	.	H	α-helix	trans	-55.9	-53.8	-173.1	-173.4	-86.2	0	0	0	113.7	G346 V350 T351 E352 E382 L386	G346-Y348 PolarHBondContact O-N 3.19Å; Y348-V350 PolarHBondContact O-N 3.41Å; Y348-T351 WeakPolarHBondContact O-CB 3.03Å; Y348-T351 PolarHBondContact O-N 3.38Å; Y348-T351 VanDerWaalsContact O-N 3.14Å; Y348-E352 PolarHBondContact O-N 2.94Å; Y348-E382 HydrophobicContact CD2-CB 4.04Å; Y348-E382 HydrophobicContact CE2-CB 4.36Å; Y348-L386 HydrophobicContact CD2-CB 4.43Å; Y348-L386 HydrophobicContact CD2-CD2 4.07Å; Y348-L386 HydrophobicContact CE1-CD2 4.45Å; Y348-L386 HydrophobicContact CE2-CB 3.85Å; Y348-L386 HydrophobicContact CE2-CD2 3.92Å; Y348-L386 HydrophobicContact CE2-CG 4.32Å; Y348-L386 HydrophobicContact CG-CD2 4.43Å
349	E	97.1	Very high	96.7	Very high	124 Å²	124	40.4 Å²	40.4	58%	0.579	20%	0.203	S	C	*	.	H	α-helix	trans	-62.5	-42.3	-176.8	-64.2	178.6	-176.6	0	0	112.4	V315 E352 L353	V315-E349 HydrophobicContact CG2-CB 4.21Å; E349-E352 PolarHBondContact O-N 3.49Å; E349-L353 WeakPolarHBondContact O-CB 3.42Å; E349-L353 PolarHBondContact O-N 3.18Å
350	V	97.9	Very high	96.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-43.4	174.1	172.3	0	0	0	0	110.9	A310 N313 V315 V318 A342 H347 Y348 L353 L354	A310-V350 HydrophobicContact CB-CG1 3.77Å; N313-V350 WeakPolarHBondContact OD1-CG2 3.4Å; V315-V350 HydrophobicContact CG2-CG2 3.9Å; V318-V350 HydrophobicContact CG2-CG1 4.25Å; V318-V350 HydrophobicContact CG2-CG2 4.4Å; A342-V350 HydrophobicContact CB-CB 4.28Å; A342-V350 HydrophobicContact CB-CG1 3.63Å; H347-V350 HydrophobicContact CB-CB 4.04Å; H347-V350 HydrophobicContact CB-CG2 4.27Å; H347-V350 PolarHBondContact O-N 3.48Å; Y348-V350 PolarHBondContact O-N 3.41Å; V350-L353 PolarHBondContact O-N 3.22Å; V350-L354 HydrophobicContact CG1-CD1 3.93Å; V350-L354 HydrophobicContact CG1-CG 4.39Å; V350-L354 WeakPolarHBondContact O-CB 3.11Å; V350-L354 VanDerWaalsContact O-CG 3.3Å; V350-L354 WeakPolarHBondContact O-CG 3.44Å; V350-L354 PolarHBondContact O-N 3.14Å
351	T	98.1	Very high	96.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-47.6	177.8	-57.8	0	0	0	0	110.4	L339 H347 Y348 L353 L354 L355 V383 L386 L387	L339-T351 HydrophobicContact CD1-CG2 3.8Å; H347-T351 WeakPolarHBondContact O-CB 3.3Å; H347-T351 PolarHBondContact O-N 3.19Å; H347-T351 PolarHBondContact O-OG1 3.15Å; Y348-T351 WeakPolarHBondContact O-CB 3.03Å; Y348-T351 PolarHBondContact O-N 3.38Å; Y348-T351 VanDerWaalsContact O-N 3.14Å; T351-L353 PolarHBondContact O-N 3.25Å; T351-L354 PolarHBondContact O-N 3.26Å; T351-L355 HydrophobicContact CG2-CD1 3.94Å; T351-L355 WeakPolarHBondContact O-CB 3.36Å; T351-L355 VanDerWaalsContact O-CG 3.25Å; T351-L355 WeakPolarHBondContact O-CG 3.47Å; T351-L355 PolarHBondContact O-N 3.41Å; T351-V383 HydrophobicContact CG2-CG1 4.25Å; T351-L386 HydrophobicContact CG2-CD2 3.76Å; T351-L387 HydrophobicContact CG2-CD2 4.29Å
352	E	96.8	Very high	96.7	Very high	64 Å²	64	45 Å²	45	30%	0.299	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-42.9	178.7	-159.8	-150.7	-161.6	0	0	111.6	Y348 E349 L355 K356 L386	Y348-E352 PolarHBondContact O-N 2.94Å; E349-E352 PolarHBondContact O-N 3.49Å; E352-L355 PolarHBondContact O-N 3.31Å; E352-K356 HydrophobicContact CG-CD 4.35Å; E352-K356 WeakPolarHBondContact O-CB 3.49Å; E352-K356 VanDerWaalsContact O-CG 3.31Å; E352-K356 WeakPolarHBondContact O-CG 3.42Å; E352-K356 PolarHBondContact O-N 2.85Å; E352-K356 VanDerWaalsContact OE1-CE 3.25Å; E352-K356 WeakPolarHBondContact OE1-CE 3.32Å; E352-K356 IonicContact OE1-NZ 3.16Å; E352-K356 PolarHBondContact OE1-NZ 2.91Å; E352-K356 IonicContact OE2-NZ 3.93Å; E352-K356 PolarHBondContact OE2-NZ 3.26Å; E352-L386 HydrophobicContact CB-CD2 3.91Å; E352-L386 HydrophobicContact CG-CD1 4.19Å; E352-L386 HydrophobicContact CG-CD2 4.43Å
353	L	97.5	Very high	96.6	Very high	28 Å²	28	45.6 Å²	45.6	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-44.4	178.1	-176.1	63	0	0	0	112.1	V318 Q319 L322 E349 V350 T351 K356 H357	V318-L353 HydrophobicContact CB-CD2 4.17Å; V318-L353 HydrophobicContact CG1-CD2 3.66Å; V318-L353 HydrophobicContact CG1-CG 4.35Å; Q319-L353 HydrophobicContact CB-CD2 4.46Å; Q319-L353 HydrophobicContact CG-CD2 3.55Å; L322-L353 HydrophobicContact CD1-CD1 4.49Å; L322-L353 HydrophobicContact CD1-CD2 4.15Å; L322-L353 HydrophobicContact CD1-CG 3.84Å; E349-L353 WeakPolarHBondContact O-CB 3.42Å; E349-L353 PolarHBondContact O-N 3.18Å; V350-L353 PolarHBondContact O-N 3.22Å; T351-L353 PolarHBondContact O-N 3.25Å; L353-K356 PolarHBondContact O-N 3.15Å; L353-H357 PolarHBondContact O-CD2 3.42Å; L353-H357 VanDerWaalsContact O-CD2 3.31Å; L353-H357 PolarHBondContact O-N 2.93Å
354	L	98	Very high	96.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-43	175.8	-71.5	171.9	0	0	0	111.7	L306 A310 V318 L322 V328 P338 L339 A342 V350 T351 H357 G358 A359	L306-L354 HydrophobicContact CD1-CD2 4.18Å; L306-L354 HydrophobicContact CD2-CD2 4.11Å; L306-L354 HydrophobicContact CG-CD2 4.29Å; A310-L354 HydrophobicContact CB-CD1 4.16Å; V318-L354 HydrophobicContact CG1-CD2 4.37Å; L322-L354 HydrophobicContact CD1-CD2 4.47Å; L322-L354 HydrophobicContact CD2-CD2 4.48Å; V328-L354 HydrophobicContact CG1-CD2 4.05Å; P338-L354 HydrophobicContact CB-CD1 4.2Å; P338-L354 HydrophobicContact CB-CD2 4.38Å; L339-L354 HydrophobicContact CB-CD1 4.44Å; L339-L354 HydrophobicContact CD1-CB 4.08Å; L339-L354 HydrophobicContact CD1-CD1 4.33Å; A342-L354 HydrophobicContact CB-CD1 4.08Å; V350-L354 HydrophobicContact CG1-CD1 3.93Å; V350-L354 HydrophobicContact CG1-CG 4.39Å; V350-L354 WeakPolarHBondContact O-CB 3.11Å; V350-L354 VanDerWaalsContact O-CG 3.3Å; V350-L354 WeakPolarHBondContact O-CG 3.44Å; V350-L354 PolarHBondContact O-N 3.14Å; T351-L354 PolarHBondContact O-N 3.26Å; L354-H357 CarbonylContact O-C 3.45Å; L354-H357 PolarHBondContact O-N 3.47Å; L354-G358 PolarHBondContact O-N 3.19Å; L354-A359 HydrophobicContact CB-CB 3.99Å; L354-A359 WeakPolarHBondContact O-CB 3.41Å; L354-A359 PolarHBondContact O-N 2.9Å
355	L	96.9	Very high	96.5	Very high	14 Å²	14	48.3 Å²	48.3	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-40.6	176.5	-69.8	167.4	0	0	0	112.1	L339 T351 E352 H357 G358 V361 L386 L387 H390	L339-L355 HydrophobicContact CD1-CD2 4.34Å; L339-L355 HydrophobicContact CD1-CG 4.16Å; L339-L355 HydrophobicContact CD2-CD2 3.83Å; T351-L355 HydrophobicContact CG2-CD1 3.94Å; T351-L355 WeakPolarHBondContact O-CB 3.36Å; T351-L355 VanDerWaalsContact O-CG 3.25Å; T351-L355 WeakPolarHBondContact O-CG 3.47Å; T351-L355 PolarHBondContact O-N 3.41Å; E352-L355 PolarHBondContact O-N 3.31Å; L355-H357 VanDerWaalsContact C-N 3.28Å; L355-H357 PolarHBondContact O-N 2.98Å; L355-G358 PolarHBondContact O-N 2.88Å; L355-V361 HydrophobicContact CD2-CB 3.95Å; L355-V361 HydrophobicContact CD2-CG2 3.93Å; L355-L386 HydrophobicContact CD1-CD2 4.38Å; L355-L386 HydrophobicContact CD1-CG 4.1Å; L355-L387 HydrophobicContact CD1-CD2 4.31Å; L355-H390 HydrophobicContact CD1-CB 4.13Å; L355-H390 HydrophobicContact CD2-CB 4.27Å
356	K	95.9	Very high	96.4	Very high	130 Å²	130	47.4 Å²	47.4	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-62.1	-33.8	173.8	-77.1	170.6	178.2	170.2	0	112.6	E352 L353 G358	E352-K356 HydrophobicContact CG-CD 4.35Å; E352-K356 WeakPolarHBondContact O-CB 3.49Å; E352-K356 VanDerWaalsContact O-CG 3.31Å; E352-K356 WeakPolarHBondContact O-CG 3.42Å; E352-K356 PolarHBondContact O-N 2.85Å; E352-K356 VanDerWaalsContact OE1-CE 3.25Å; E352-K356 WeakPolarHBondContact OE1-CE 3.32Å; E352-K356 IonicContact OE1-NZ 3.16Å; E352-K356 PolarHBondContact OE1-NZ 2.91Å; E352-K356 IonicContact OE2-NZ 3.93Å; E352-K356 PolarHBondContact OE2-NZ 3.26Å; L353-K356 PolarHBondContact O-N 3.15Å; K356-G358 PolarHBondContact O-N 3.1Å
357	H	96.8	Very high	96.2	Very high	94 Å²	94	52.3 Å²	52.3	44%	0.435	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	16.4	173.2	-78.5	-100.6	0	0	0	113.9	L322 V328 L353 L354 L355	L322-H357 HydrophobicContact CD1-CB 4.23Å; L322-H357 HydrophobicContact CD2-CB 4.15Å; V328-H357 HydrophobicContact CG1-CB 4.1Å; L353-H357 PolarHBondContact O-CD2 3.42Å; L353-H357 VanDerWaalsContact O-CD2 3.31Å; L353-H357 PolarHBondContact O-N 2.93Å; L354-H357 CarbonylContact O-C 3.45Å; L354-H357 PolarHBondContact O-N 3.47Å; L355-H357 VanDerWaalsContact C-N 3.28Å; L355-H357 PolarHBondContact O-N 2.98Å
358	G	95.9	Very high	96.1	Very high	46 Å²	46	55.2 Å²	55.2	47%	0.474	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	9.3	169.5	0	0	0	0	0	115.9	H329 L354 L355 K356 C360	H329-G358 PolarHBondContact CE1-O 2.81Å; L354-G358 PolarHBondContact O-N 3.19Å; L355-G358 PolarHBondContact O-N 2.88Å; K356-G358 PolarHBondContact O-N 3.1Å; G358-C360 PolarHBondContact O-N 2.96Å
359	A	96.9	Very high	96.1	Very high	6 Å²	6	52.2 Å²	52.2	5%	0.05	27%	0.266	C	S	.	.			trans	-54.9	129.3	177.2	0	0	0	0	0	111.6	V328 L339 L354 V361	V328-A359 HydrophobicContact CB-CB 4.07Å; V328-A359 HydrophobicContact CG2-CB 4.47Å; L339-A359 HydrophobicContact CB-CB 4.32Å; L339-A359 HydrophobicContact CD2-CB 3.99Å; L354-A359 HydrophobicContact CB-CB 3.99Å; L354-A359 WeakPolarHBondContact O-CB 3.41Å; L354-A359 PolarHBondContact O-N 2.9Å; A359-V361 PolarHBondContact O-N 3.47Å; A359-V361 VanDerWaalsContact O-N 3.09Å
360	C	96.1	Very high	96.1	Very high	61 Å²	61	46.3 Å²	46.3	41%	0.412	24%	0.238	S	C	.	.			trans	-70	110.2	-176.3	179.2	0	0	0	0	110.6	G358 N362 A363	G358-C360 PolarHBondContact O-N 2.96Å; C360-N362 PolarHBondContact O-N 3.45Å; C360-A363 HydrophobicContact CB-CB 4.12Å; C360-A363 VanDerWaalsContact O-CB 3.23Å; C360-A363 WeakPolarHBondContact O-CB 3.28Å; C360-A363 PolarHBondContact O-N 2.87Å
361	V	96.8	Very high	96.1	Very high	17 Å²	17	46.3 Å²	46.3	10%	0.103	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.7	-175.1	75.6	0	0	0	0	113.6	L355 A359 P371 L387 H390 A392	L355-V361 HydrophobicContact CD2-CB 3.95Å; L355-V361 HydrophobicContact CD2-CG2 3.93Å; A359-V361 PolarHBondContact O-N 3.47Å; A359-V361 VanDerWaalsContact O-N 3.09Å; V361-P371 WeakPolarHBondContact O-CD 3.36Å; V361-L387 HydrophobicContact CG2-CB 4.29Å; V361-L387 HydrophobicContact CG2-CD2 3.68Å; V361-H390 HydrophobicContact CG2-CB 4.21Å; V361-A392 HydrophobicContact CG2-CB 3.76Å
362	N	97.1	Very high	96.1	Very high	47 Å²	47	46.3 Å²	46.3	25%	0.251	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	24.3	177.7	-66.3	-49.4	0	0	0	112.1	C360 M364 G391 A392 D393 L396	C360-N362 PolarHBondContact O-N 3.45Å; N362-M364 PolarHBondContact O-N 3Å; N362-G391 PolarHBondContact ND2-O 2.9Å; N362-A392 WeakPolarHBondContact OD1-CA 3.43Å; N362-D393 PolarHBondContact OD1-N 3.4Å; N362-L396 HydrophobicContact CB-CD1 4Å
363	A	96.5	Very high	96.2	Very high	13 Å²	13	43.3 Å²	43.3	11%	0.107	22%	0.224	C	C	.	.			trans	-55.5	133.9	174	0	0	0	0	0	110.4	V337 H340 C360 T370 P371	V337-A363 HydrophobicContact CG1-CB 4.47Å; V337-A363 HydrophobicContact CG2-CB 3.75Å; H340-A363 PolarHBondContact CE1-O 3.29Å; H340-A363 PolarHBondContact NE2-O 3.49Å; C360-A363 HydrophobicContact CB-CB 4.12Å; C360-A363 VanDerWaalsContact O-CB 3.23Å; C360-A363 WeakPolarHBondContact O-CB 3.28Å; C360-A363 PolarHBondContact O-N 2.87Å; A363-T370 WeakPolarHBondContact O-CA 3.41Å; A363-P371 WeakPolarHBondContact O-CD 3.41Å
364	M	95.2	Very high	96.1	Very high	60 Å²	60	43.6 Å²	43.6	30%	0.296	23%	0.225	S	C	.	.			trans	-104	135.4	176.2	-78.4	178.3	166.1	0	0	111.8	K331 N362 Q368 F369 T370 L396	K331-M364 PolarHBondContact NZ-O 3.37Å; N362-M364 PolarHBondContact O-N 3Å; M364-Q368 HydrophobicContact CE-CB 4.34Å; M364-Q368 HydrophobicContact SD-CB 4.07Å; M364-Q368 HydrophobicContact SD-CG 4.22Å; M364-F369 WeakPolarHBondContact CA-O 3.07Å; M364-T370 HydrophobicContact CE-CG2 4.2Å; M364-T370 HydrophobicContact CG-CG2 3.95Å; M364-L396 HydrophobicContact CE-CB 4.16Å; M364-L396 HydrophobicContact CE-CD1 4.36Å
365	D	93.6	Very high	96.1	Very high	15 Å²	15	43.6 Å²	43.6	8%	0.08	23%	0.225	C	C	.	.			trans	-79.7	-174.2	167.9	80.2	-5.2	0	0	0	112.1	L336 W367 Q368 F369	L336-D365 HydrophobicContact CD2-CB 3.82Å; L336-D365 HydrophobicContact CG-CB 4.34Å; D365-W367 PolarHBondContact O-N 2.99Å; D365-W367 VanDerWaalsContact OD1-C 3.24Å; D365-W367 VanDerWaalsContact OD1-CA 3.31Å; D365-W367 WeakPolarHBondContact OD1-CA 3.48Å; D365-W367 PolarHBondContact OD1-N 3.35Å; D365-Q368 PolarHBondContact O-N 2.74Å; D365-Q368 PolarHBondContact OD1-N 2.77Å; D365-F369 PolarHBondContact N-O 2.83Å; D365-F369 VanDerWaalsContact N-O 3.11Å; D365-F369 PolarHBondContact OD1-N 3.37Å
366	L	91.5	Very high	96.2	Very high	123 Å²	123	43 Å²	43	64%	0.644	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.9	179.5	-67.8	176.8	0	0	0	114	K333 G334	K333-L366 WeakPolarHBondContact O-CD1 3.42Å; G334-L366 WeakPolarHBondContact O-CB 3.32Å; G334-L366 VanDerWaalsContact O-CG 3.28Å; G334-L366 WeakPolarHBondContact O-CG 3.39Å; G334-L366 PolarHBondContact O-N 2.92Å
367	W	91.8	Very high	96.2	Very high	130 Å²	130	38.3 Å²	38.3	49%	0.492	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.3	177.2	-59.9	-77.9	0	0	0	112.5	D365 F369 C399	D365-W367 PolarHBondContact O-N 2.99Å; D365-W367 VanDerWaalsContact OD1-C 3.24Å; D365-W367 VanDerWaalsContact OD1-CA 3.31Å; D365-W367 WeakPolarHBondContact OD1-CA 3.48Å; D365-W367 PolarHBondContact OD1-N 3.35Å; W367-F369 HydrophobicContact CB-CD2 3.83Å; W367-F369 HydrophobicContact CB-CE2 4.2Å; W367-F369 PolarHBondContact O-N 3.39Å; W367-C399 VanDerWaalsContact O-CB 3.27Å; W367-C399 WeakPolarHBondContact O-CB 3.45Å; W367-C399 PolarHBondContact O-N 3.03Å; W367-C399 PolarHBondContact O-SG 3.38Å
368	Q	94.4	Very high	96.2	Very high	96 Å²	96	39 Å²	39	45%	0.449	21%	0.207	S	C	.	.			trans	59.6	22.5	-175.9	-60	167.9	87	0	0	113.7	M364 D365 N398	M364-Q368 HydrophobicContact CE-CB 4.34Å; M364-Q368 HydrophobicContact SD-CB 4.07Å; M364-Q368 HydrophobicContact SD-CG 4.22Å; D365-Q368 PolarHBondContact O-N 2.74Å; D365-Q368 PolarHBondContact OD1-N 2.77Å; Q368-N398 WeakPolarHBondContact O-CA 3.31Å
369	F	96.7	Very high	96.2	Very high	29 Å²	29	40 Å²	40	13%	0.127	20%	0.202	C	C	.	.			trans	-71.5	144	165.5	-79.5	-121.3	0	0	0	108.8	H340 M364 D365 W367 H373 N398 H400 M407	H340-F369 PolarHBondContact NE2-O 3.26Å; M364-F369 WeakPolarHBondContact CA-O 3.07Å; D365-F369 PolarHBondContact N-O 2.83Å; D365-F369 VanDerWaalsContact N-O 3.11Å; D365-F369 PolarHBondContact OD1-N 3.37Å; W367-F369 HydrophobicContact CB-CD2 3.83Å; W367-F369 HydrophobicContact CB-CE2 4.2Å; W367-F369 PolarHBondContact O-N 3.39Å; F369-H373 HydrophobicContact CB-CB 4.29Å; F369-H373 HydrophobicContact CD1-CB 3.71Å; F369-H373 HydrophobicContact CE1-CB 4.44Å; F369-H373 HydrophobicContact CG-CB 4.25Å; F369-N398 HydrophobicContact CD2-CB 3.82Å; F369-N398 HydrophobicContact CE2-CB 3.96Å; F369-N398 WeakPolarHBondContact CE2-ND2 3.43Å; F369-N398 HydrophobicContact CG-CB 4.44Å; F369-N398 VanDerWaalsContact CZ-ND2 3.27Å; F369-N398 WeakPolarHBondContact CZ-ND2 3.34Å; F369-H400 AromaticContact CE2-ND1 3.92Å; F369-M407 HydrophobicContact CD1-CE 4.47Å; F369-M407 HydrophobicContact CE1-CE 3.43Å; F369-M407 VanDerWaalsContact CE1-CE 3.43Å; F369-M407 HydrophobicContact CE1-SD 3.81Å; F369-M407 HydrophobicContact CZ-CE 3.88Å; F369-M407 HydrophobicContact CZ-SD 4.09Å
370	T	98	Very high	96.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.			trans	-107.6	164.2	169.3	68.2	0	0	0	0	109.6	A363 M364 L372 H373 E374 L396	A363-T370 WeakPolarHBondContact O-CA 3.41Å; M364-T370 HydrophobicContact CE-CG2 4.2Å; M364-T370 HydrophobicContact CG-CG2 3.95Å; T370-L372 PolarHBondContact O-N 2.82Å; T370-H373 PolarHBondContact N-ND1 3.07Å; T370-H373 WeakPolarHBondContact O-CB 3.08Å; T370-H373 PolarHBondContact O-N 3.19Å; T370-H373 PolarHBondContact OG1-ND1 2.87Å; T370-E374 PolarHBondContact O-N 3.35Å; T370-L396 HydrophobicContact CG2-CD1 4.18Å
371	P	98.3	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-53.4	-28.4	173.7	-27.2	34.4	0	0	0	113.6	L339 H340 C343 V361 A363 A375 L387	L339-P371 HydrophobicContact CB-CG 4.29Å; L339-P371 HydrophobicContact CD2-CB 4.22Å; L339-P371 HydrophobicContact CD2-CG 3.82Å; L339-P371 HydrophobicContact CG-CB 3.99Å; L339-P371 HydrophobicContact CG-CG 3.88Å; H340-P371 WeakPolarHBondContact NE2-CD 3.41Å; C343-P371 HydrophobicContact CB-CB 4.09Å; C343-P371 WeakPolarHBondContact CB-O 3.36Å; V361-P371 WeakPolarHBondContact O-CD 3.36Å; A363-P371 WeakPolarHBondContact O-CD 3.41Å; P371-A375 WeakPolarHBondContact O-CB 3.44Å; P371-A375 PolarHBondContact O-N 2.91Å; P371-L387 HydrophobicContact CB-CD1 4.29Å; P371-L387 HydrophobicContact CB-CD2 4.22Å
372	L	98.2	Very high	96	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-74.1	-33	175.2	-172.3	60.6	0	0	0	113.2	T370 A376 C384 L387 L388 A392 P394 A404 L417	T370-L372 PolarHBondContact O-N 2.82Å; L372-A376 WeakPolarHBondContact O-CB 3.28Å; L372-A376 PolarHBondContact O-N 2.93Å; L372-C384 HydrophobicContact CD1-CB 3.94Å; L372-L387 HydrophobicContact CB-CD1 4.07Å; L372-L387 HydrophobicContact CD1-CB 4.14Å; L372-L387 HydrophobicContact CD1-CD1 3.94Å; L372-L388 HydrophobicContact CD2-CD2 3.8Å; L372-L388 HydrophobicContact CD2-CG 4.37Å; L372-A392 HydrophobicContact CB-CB 4.26Å; L372-A392 HydrophobicContact CD2-CB 3.73Å; L372-A392 HydrophobicContact CG-CB 4.49Å; L372-P394 HydrophobicContact CD2-CB 3.79Å; L372-A404 HydrophobicContact CB-CB 4.49Å; L372-A404 HydrophobicContact CD2-CB 4.23Å; L372-A404 HydrophobicContact CG-CB 3.91Å; L372-L417 HydrophobicContact CD1-CD2 4Å
373	H	98.1	Very high	96.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-43.6	171.4	-71.9	87.7	0	0	0	111.1	F369 T370 S377 L396 K402 A404 M407	F369-H373 HydrophobicContact CB-CB 4.29Å; F369-H373 HydrophobicContact CD1-CB 3.71Å; F369-H373 HydrophobicContact CE1-CB 4.44Å; F369-H373 HydrophobicContact CG-CB 4.25Å; T370-H373 PolarHBondContact N-ND1 3.07Å; T370-H373 WeakPolarHBondContact O-CB 3.08Å; T370-H373 PolarHBondContact O-N 3.19Å; T370-H373 PolarHBondContact OG1-ND1 2.87Å; H373-S377 VanDerWaalsContact O-CB 3.3Å; H373-S377 WeakPolarHBondContact O-CB 3.45Å; H373-S377 PolarHBondContact O-N 2.9Å; H373-S377 PolarHBondContact O-OG 2.98Å; H373-L396 PolarHBondContact CE1-O 2.84Å; H373-L396 PolarHBondContact NE2-O 2.88Å; H373-K402 PolarHBondContact NE2-O 2.97Å; H373-A404 PolarHBondContact NE2-N 3.33Å; H373-M407 HydrophobicContact CB-SD 4.41Å
374	E	96.3	Very high	96.1	Very high	35 Å²	35	45.2 Å²	45.2	16%	0.164	21%	0.213	C	C	.	.	H	α-helix	trans	-59.3	-56.4	174.4	-79.8	-58.8	133.6	0	0	111.2	S344 T370 A376 S377 K378	S344-E374 WeakPolarHBondContact CB-OE2 3.34Å; S344-E374 PolarHBondContact OG-OE2 3.37Å; T370-E374 PolarHBondContact O-N 3.35Å; E374-A376 PolarHBondContact O-N 2.97Å; E374-S377 PolarHBondContact O-N 3.03Å; E374-S377 PolarHBondContact O-OG 3.06Å; E374-S377 VanDerWaalsContact O-OG 3.05Å; E374-K378 WeakPolarHBondContact O-CG 3.27Å; E374-K378 PolarHBondContact O-N 3.16Å
375	A	97.8	Very high	96.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-45.9	178.8	0	0	0	0	0	112.8	C343 P371 K378 N379 R380 V383 L387	C343-A375 HydrophobicContact CB-CB 4.24Å; P371-A375 WeakPolarHBondContact O-CB 3.44Å; P371-A375 PolarHBondContact O-N 2.91Å; A375-K378 PolarHBondContact O-N 3.34Å; A375-N379 PolarHBondContact O-N 3.4Å; A375-R380 HydrophobicContact CB-CB 4.13Å; A375-R380 PolarHBondContact O-N 2.79Å; A375-V383 HydrophobicContact CB-CB 4.46Å; A375-V383 HydrophobicContact CB-CG1 3.86Å; A375-L387 HydrophobicContact CB-CD1 4.01Å
376	A	97.4	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-45.1	-178.3	0	0	0	0	0	112.2	L372 E374 K378 N379 A404 A408 P409 L417	L372-A376 WeakPolarHBondContact O-CB 3.28Å; L372-A376 PolarHBondContact O-N 2.93Å; E374-A376 PolarHBondContact O-N 2.97Å; A376-K378 PolarHBondContact O-N 2.93Å; A376-N379 PolarHBondContact O-N 2.91Å; A376-N379 VanDerWaalsContact O-N 3.09Å; A376-A404 HydrophobicContact CB-CB 4.31Å; A376-A404 WeakPolarHBondContact CB-O 3.29Å; A376-A408 HydrophobicContact CB-CB 4.47Å; A376-P409 WeakPolarHBondContact O-CD 3.3Å; A376-L417 HydrophobicContact CB-CD1 4.06Å
377	S	96.9	Very high	96.5	Very high	33 Å²	33	36.3 Å²	36.3	23%	0.231	17%	0.168	C	C	.	.	H	α-helix	trans	-65.3	-24.8	-179.8	75.9	0	0	0	0	113.8	H373 E374	H373-S377 VanDerWaalsContact O-CB 3.3Å; H373-S377 WeakPolarHBondContact O-CB 3.45Å; H373-S377 PolarHBondContact O-N 2.9Å; H373-S377 PolarHBondContact O-OG 2.98Å; E374-S377 PolarHBondContact O-N 3.03Å; E374-S377 PolarHBondContact O-OG 3.06Å; E374-S377 VanDerWaalsContact O-OG 3.05Å
378	K	96.3	Very high	96.7	Very high	108 Å²	108	30.2 Å²	30.2	47%	0.47	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	10.2	176.2	-52.5	-56.8	-179.5	-174.8	0	113.6	E374 A375 A376 R380	E374-K378 WeakPolarHBondContact O-CG 3.27Å; E374-K378 PolarHBondContact O-N 3.16Å; A375-K378 PolarHBondContact O-N 3.34Å; A376-K378 PolarHBondContact O-N 2.93Å; K378-R380 HydrophobicContact CB-CG 4.01Å; K378-R380 WeakPolarHBondContact O-CD 3.44Å; K378-R380 PolarHBondContact O-N 3.4Å
379	N	95.9	Very high	96.7	Very high	68 Å²	68	26.7 Å²	26.7	36%	0.364	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	40.4	-179.9	-160.4	46	0	0	0	114.2	A375 A376 V381 P409 T410 L413	A375-N379 PolarHBondContact O-N 3.4Å; A376-N379 PolarHBondContact O-N 2.91Å; A376-N379 VanDerWaalsContact O-N 3.09Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 2.91Å; N379-V381 VanDerWaalsContact O-N 3.13Å; N379-P409 HydrophobicContact CB-CG 3.86Å; N379-T410 PolarHBondContact OD1-OG1 3.09Å; N379-L413 WeakPolarHBondContact OD1-CD2 3.49Å
380	R	96.7	Very high	96.5	Very high	86 Å²	86	29.2 Å²	29.2	33%	0.325	14%	0.143	S	C	.	.			trans	-86.3	70.7	179.6	-49.4	-52.5	-171.9	-172	1.6	111	C343 S344 Y345 A375 K378 E382 V383 C384	C343-R380 WeakPolarHBondContact O-CG 3.38Å; S344-R380 PolarHBondContact O-NE 3.09Å; S344-R380 PolarHBondContact O-NH2 2.84Å; S344-R380 VanDerWaalsContact O-NH2 3.15Å; Y345-R380 PolarHBondContact O-NH2 3.47Å; A375-R380 HydrophobicContact CB-CB 4.13Å; A375-R380 PolarHBondContact O-N 2.79Å; K378-R380 HydrophobicContact CB-CG 4.01Å; K378-R380 WeakPolarHBondContact O-CD 3.44Å; K378-R380 PolarHBondContact O-N 3.4Å; R380-E382 VanDerWaalsContact C-N 3.34Å; R380-E382 PolarHBondContact O-N 2.81Å; R380-V383 HydrophobicContact CB-CB 3.96Å; R380-V383 HydrophobicContact CB-CG2 4.42Å; R380-V383 PolarHBondContact O-N 3.38Å; R380-V383 VanDerWaalsContact O-N 3.14Å; R380-C384 PolarHBondContact O-N 3.38Å; R380-C384 PolarHBondContact O-SG 3.26Å; R380-C384 VanDerWaalsContact O-SG 3.36Å
381	V	94.9	Very high	96.3	Very high	34 Å²	34	31.4 Å²	31.4	21%	0.206	17%	0.166	C	C	.	.	H	α-helix	trans	-52.3	-48	-168.7	-173.6	0	0	0	0	112.8	N379 V383 C384 S385 L413	N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 PolarHBondContact O-N 2.91Å; N379-V381 VanDerWaalsContact O-N 3.13Å; V381-V383 PolarHBondContact O-N 3Å; V381-C384 WeakPolarHBondContact O-CB 3.42Å; V381-C384 PolarHBondContact O-N 3.01Å; V381-S385 PolarHBondContact O-N 2.86Å; V381-S385 PolarHBondContact O-OG 2.8Å; V381-L413 HydrophobicContact CG1-CD1 4.44Å; V381-L413 HydrophobicContact CG2-CD1 4.4Å
382	E	95.3	Very high	96.3	Very high	129 Å²	129	31.5 Å²	31.5	60%	0.603	17%	0.166	S	C	*	.	H	α-helix	trans	-67.5	-37.5	-176.7	-61.1	68.9	-151.8	0	0	111.9	Y348 R380 L386	Y348-E382 HydrophobicContact CD2-CB 4.04Å; Y348-E382 HydrophobicContact CE2-CB 4.36Å; R380-E382 VanDerWaalsContact C-N 3.34Å; R380-E382 PolarHBondContact O-N 2.81Å; E382-L386 WeakPolarHBondContact O-CB 3.42Å; E382-L386 PolarHBondContact O-N 3.04Å
383	V	97.4	Very high	96.1	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.012	18%	0.177	C	C	.	.	H	α-helix	trans	-71.5	-39.2	176	171.2	0	0	0	0	110.8	C343 T351 A375 R380 V381 S385 L386 L387	C343-V383 HydrophobicContact CB-CG1 4.01Å; T351-V383 HydrophobicContact CG2-CG1 4.25Å; A375-V383 HydrophobicContact CB-CB 4.46Å; A375-V383 HydrophobicContact CB-CG1 3.86Å; R380-V383 HydrophobicContact CB-CB 3.96Å; R380-V383 HydrophobicContact CB-CG2 4.42Å; R380-V383 PolarHBondContact O-N 3.38Å; R380-V383 VanDerWaalsContact O-N 3.14Å; V381-V383 PolarHBondContact O-N 3Å; V383-S385 VanDerWaalsContact C-N 3.35Å; V383-S385 PolarHBondContact O-N 3.1Å; V383-L386 PolarHBondContact O-N 3.25Å; V383-L387 HydrophobicContact CG1-CD1 4Å; V383-L387 HydrophobicContact CG1-CG 4.31Å; V383-L387 WeakPolarHBondContact O-CB 3.18Å; V383-L387 VanDerWaalsContact O-CG 3.27Å; V383-L387 WeakPolarHBondContact O-CG 3.47Å; V383-L387 PolarHBondContact O-N 2.74Å
384	C	97.3	Very high	96.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-48.3	172.1	-72.1	0	0	0	0	111.2	L372 R380 V381 L386 L387 L388 L413 L417	L372-C384 HydrophobicContact CD1-CB 3.94Å; R380-C384 PolarHBondContact O-N 3.38Å; R380-C384 PolarHBondContact O-SG 3.26Å; R380-C384 VanDerWaalsContact O-SG 3.36Å; V381-C384 WeakPolarHBondContact O-CB 3.42Å; V381-C384 PolarHBondContact O-N 3.01Å; C384-L386 PolarHBondContact O-N 3.45Å; C384-L387 PolarHBondContact O-N 3.02Å; C384-L388 WeakPolarHBondContact O-CG 3.3Å; C384-L388 PolarHBondContact O-N 3.29Å; C384-L413 HydrophobicContact CB-CD1 4.37Å; C384-L417 HydrophobicContact CB-CD2 3.81Å
385	S	95.3	Very high	96	Very high	10 Å²	10	35.7 Å²	35.7	7%	0.07	19%	0.193	C	C	.	.	H	α-helix	trans	-63	-39.4	176.5	-66.6	0	0	0	0	112.9	V381 V383 L388 S389 R416 E420	V381-S385 PolarHBondContact O-N 2.86Å; V381-S385 PolarHBondContact O-OG 2.8Å; V383-S385 VanDerWaalsContact C-N 3.35Å; V383-S385 PolarHBondContact O-N 3.1Å; S385-L388 PolarHBondContact O-N 2.89Å; S385-S389 WeakPolarHBondContact O-CB 3.29Å; S385-S389 PolarHBondContact O-N 2.96Å; S385-S389 PolarHBondContact O-OG 3.1Å; S385-R416 PolarHBondContact OG-NE 2.93Å; S385-R416 VanDerWaalsContact OG-NE 3.16Å; S385-R416 PolarHBondContact OG-NH2 3.39Å; S385-E420 VanDerWaalsContact CA-OE2 3.31Å; S385-E420 WeakPolarHBondContact CA-OE2 3.49Å; S385-E420 VanDerWaalsContact CB-OE2 3.22Å; S385-E420 WeakPolarHBondContact CB-OE2 3.49Å; S385-E420 PolarHBondContact OG-OE1 2.89Å; S385-E420 PolarHBondContact OG-OE2 3.01Å
386	L	96.3	Very high	95.9	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-49.7	174.3	178.5	62.5	0	0	0	111.5	Y348 T351 E352 L355 E382 V383 C384 L388 S389 H390	Y348-L386 HydrophobicContact CD2-CB 4.43Å; Y348-L386 HydrophobicContact CD2-CD2 4.07Å; Y348-L386 HydrophobicContact CE1-CD2 4.45Å; Y348-L386 HydrophobicContact CE2-CB 3.85Å; Y348-L386 HydrophobicContact CE2-CD2 3.92Å; Y348-L386 HydrophobicContact CE2-CG 4.32Å; Y348-L386 HydrophobicContact CG-CD2 4.43Å; T351-L386 HydrophobicContact CG2-CD2 3.76Å; E352-L386 HydrophobicContact CB-CD2 3.91Å; E352-L386 HydrophobicContact CG-CD1 4.19Å; E352-L386 HydrophobicContact CG-CD2 4.43Å; L355-L386 HydrophobicContact CD1-CD2 4.38Å; L355-L386 HydrophobicContact CD1-CG 4.1Å; E382-L386 WeakPolarHBondContact O-CB 3.42Å; E382-L386 PolarHBondContact O-N 3.04Å; V383-L386 PolarHBondContact O-N 3.25Å; C384-L386 PolarHBondContact O-N 3.45Å; L386-L388 PolarHBondContact O-N 2.9Å; L386-S389 PolarHBondContact O-N 3.07Å; L386-S389 PolarHBondContact O-OG 3.17Å; L386-H390 PolarHBondContact O-CD2 3.16Å; L386-H390 PolarHBondContact O-N 2.97Å; L386-H390 VanDerWaalsContact O-N 3.13Å
387	L	97.2	Very high	95.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-46	177.6	-72	170.9	0	0	0	111.8	L339 C343 T351 L355 V361 P371 L372 A375 V383 C384 S389 H390 G391 A392	L339-L387 HydrophobicContact CD2-CD2 4.48Å; C343-L387 HydrophobicContact CB-CD1 4.41Å; T351-L387 HydrophobicContact CG2-CD2 4.29Å; L355-L387 HydrophobicContact CD1-CD2 4.31Å; V361-L387 HydrophobicContact CG2-CB 4.29Å; V361-L387 HydrophobicContact CG2-CD2 3.68Å; P371-L387 HydrophobicContact CB-CD1 4.29Å; P371-L387 HydrophobicContact CB-CD2 4.22Å; L372-L387 HydrophobicContact CB-CD1 4.07Å; L372-L387 HydrophobicContact CD1-CB 4.14Å; L372-L387 HydrophobicContact CD1-CD1 3.94Å; A375-L387 HydrophobicContact CB-CD1 4.01Å; V383-L387 HydrophobicContact CG1-CD1 4Å; V383-L387 HydrophobicContact CG1-CG 4.31Å; V383-L387 WeakPolarHBondContact O-CB 3.18Å; V383-L387 VanDerWaalsContact O-CG 3.27Å; V383-L387 WeakPolarHBondContact O-CG 3.47Å; V383-L387 PolarHBondContact O-N 2.74Å; C384-L387 PolarHBondContact O-N 3.02Å; L387-S389 VanDerWaalsContact C-N 3.32Å; L387-S389 PolarHBondContact O-N 3.18Å; L387-H390 CarbonylContact O-C 3.53Å; L387-H390 PolarHBondContact O-N 3.28Å; L387-H390 VanDerWaalsContact O-N 3.09Å; L387-G391 PolarHBondContact O-N 3.01Å; L387-A392 VanDerWaalsContact C-CB 3.45Å; L387-A392 HydrophobicContact CB-CB 3.84Å; L387-A392 WeakPolarHBondContact O-CB 3.15Å; L387-A392 PolarHBondContact O-N 3.12Å
388	L	96.3	Very high	95.8	Very high	2 Å²	2	41 Å²	41	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-40.1	175.9	-72.5	178.2	0	0	0	112.1	L372 C384 S385 L386 H390 G391 A392 P394 L417 E420 F421	L372-L388 HydrophobicContact CD2-CD2 3.8Å; L372-L388 HydrophobicContact CD2-CG 4.37Å; C384-L388 WeakPolarHBondContact O-CG 3.3Å; C384-L388 PolarHBondContact O-N 3.29Å; S385-L388 PolarHBondContact O-N 2.89Å; L386-L388 PolarHBondContact O-N 2.9Å; L388-H390 PolarHBondContact O-N 3.5Å; L388-G391 PolarHBondContact O-N 3.16Å; L388-A392 HydrophobicContact CD2-CB 4.38Å; L388-A392 WeakPolarHBondContact CD2-O 3.17Å; L388-P394 HydrophobicContact CD2-CB 4.45Å; L388-P394 HydrophobicContact CD2-CG 4.12Å; L388-L417 HydrophobicContact CD1-CD2 3.84Å; L388-L417 HydrophobicContact CG-CD2 4.48Å; L388-E420 HydrophobicContact CD1-CB 3.72Å; L388-F421 HydrophobicContact CD2-CB 4.05Å; L388-F421 HydrophobicContact CD2-CD2 4.3Å
389	S	93.6	Very high	95.6	Very high	21 Å²	21	38.6 Å²	38.6	15%	0.147	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-23.7	176.1	72.3	0	0	0	0	113.8	S385 L386 L387 H424 Q453	S385-S389 WeakPolarHBondContact O-CB 3.29Å; S385-S389 PolarHBondContact O-N 2.96Å; S385-S389 PolarHBondContact O-OG 3.1Å; L386-S389 PolarHBondContact O-N 3.07Å; L386-S389 PolarHBondContact O-OG 3.17Å; L387-S389 VanDerWaalsContact C-N 3.32Å; L387-S389 PolarHBondContact O-N 3.18Å; S389-H424 VanDerWaalsContact CA-CE1 3.47Å; S389-H424 WeakPolarHBondContact CA-CE1 3.35Å; S389-H424 VanDerWaalsContact CB-CE1 3.46Å; S389-H424 WeakPolarHBondContact CB-CE1 3.26Å; S389-Q453 PolarHBondContact OG-NE2 3.3Å; S389-Q453 VanDerWaalsContact OG-NE2 3.11Å
390	H	94.2	Very high	95.5	Very high	83 Å²	83	41.1 Å²	41.1	38%	0.384	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	9.8	171.6	-80.4	-97.8	0	0	0	114.1	L355 V361 L386 L387 L388	L355-H390 HydrophobicContact CD1-CB 4.13Å; L355-H390 HydrophobicContact CD2-CB 4.27Å; V361-H390 HydrophobicContact CG2-CB 4.21Å; L386-H390 PolarHBondContact O-CD2 3.16Å; L386-H390 PolarHBondContact O-N 2.97Å; L386-H390 VanDerWaalsContact O-N 3.13Å; L387-H390 CarbonylContact O-C 3.53Å; L387-H390 PolarHBondContact O-N 3.28Å; L387-H390 VanDerWaalsContact O-N 3.09Å; L388-H390 PolarHBondContact O-N 3.5Å
391	G	93.4	Very high	95.4	Very high	46 Å²	46	41.5 Å²	41.5	47%	0.474	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	24	174.8	0	0	0	0	0	115.3	N362 L387 L388	N362-G391 PolarHBondContact ND2-O 2.9Å; L387-G391 PolarHBondContact O-N 3.01Å; L388-G391 PolarHBondContact O-N 3.16Å
392	A	96.8	Very high	95.5	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	25%	0.253	C	S	.	.			trans	-60.4	136.7	167.5	0	0	0	0	0	111.1	V361 N362 L372 L387 L388	V361-A392 HydrophobicContact CG2-CB 3.76Å; N362-A392 WeakPolarHBondContact OD1-CA 3.43Å; L372-A392 HydrophobicContact CB-CB 4.26Å; L372-A392 HydrophobicContact CD2-CB 3.73Å; L372-A392 HydrophobicContact CG-CB 4.49Å; L387-A392 VanDerWaalsContact C-CB 3.45Å; L387-A392 HydrophobicContact CB-CB 3.84Å; L387-A392 WeakPolarHBondContact O-CB 3.15Å; L387-A392 PolarHBondContact O-N 3.12Å; L388-A392 HydrophobicContact CD2-CB 4.38Å; L388-A392 WeakPolarHBondContact CD2-O 3.17Å
393	D	95.6	Very high	95.6	Very high	42 Å²	42	39.7 Å²	39.7	23%	0.225	23%	0.228	C	C	.	.			trans	-102	108.9	176.5	-175.7	-12.9	0	0	0	109.4	N362 T395 L396 F421	N362-D393 PolarHBondContact OD1-N 3.4Å; D393-T395 PolarHBondContact O-N 3.18Å; D393-T395 WeakPolarHBondContact OD1-CA 3.26Å; D393-T395 VanDerWaalsContact OD1-CB 3.29Å; D393-T395 WeakPolarHBondContact OD1-CB 3.23Å; D393-T395 PolarHBondContact OD1-N 3.21Å; D393-T395 PolarHBondContact OD1-OG1 2.69Å; D393-T395 PolarHBondContact OD2-OG1 2.95Å; D393-L396 HydrophobicContact CB-CD1 3.93Å; D393-L396 HydrophobicContact CB-CG 3.87Å; D393-F421 HydrophobicContact CB-CE2 4.36Å
394	P	96.7	Very high	95.5	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-6.2	-179.7	35	-36.7	0	0	0	112.8	L372 L388 S403 A404 V405 F421	L372-P394 HydrophobicContact CD2-CB 3.79Å; L388-P394 HydrophobicContact CD2-CB 4.45Å; L388-P394 HydrophobicContact CD2-CG 4.12Å; P394-S403 VanDerWaalsContact O-CB 3.3Å; P394-S403 WeakPolarHBondContact O-CB 3.21Å; P394-A404 HydrophobicContact CB-CB 4.31Å; P394-A404 PolarHBondContact O-N 2.87Å; P394-V405 HydrophobicContact CB-CG2 3.86Å; P394-V405 HydrophobicContact CG-CG2 4.46Å; P394-F421 VanDerWaalsContact CD-CG 3.41Å; P394-F421 HydrophobicContact CG-CB 3.68Å; P394-F421 HydrophobicContact CG-CD1 3.76Å; P394-F421 HydrophobicContact CG-CD2 3.92Å; P394-F421 HydrophobicContact CG-CE1 4.34Å; P394-F421 HydrophobicContact CG-CE2 4.48Å; P394-F421 HydrophobicContact CG-CG 3.51Å
395	T	94.9	Very high	95.5	Very high	81 Å²	81	40.8 Å²	40.8	50%	0.497	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-12.7	-178.8	75.4	0	0	0	0	113.7	D393 L397 F421	D393-T395 PolarHBondContact O-N 3.18Å; D393-T395 WeakPolarHBondContact OD1-CA 3.26Å; D393-T395 VanDerWaalsContact OD1-CB 3.29Å; D393-T395 WeakPolarHBondContact OD1-CB 3.23Å; D393-T395 PolarHBondContact OD1-N 3.21Å; D393-T395 PolarHBondContact OD1-OG1 2.69Å; D393-T395 PolarHBondContact OD2-OG1 2.95Å; T395-L397 PolarHBondContact O-N 3.39Å; T395-F421 HydrophobicContact CG2-CD1 4.38Å; T395-F421 HydrophobicContact CG2-CE1 3.8Å; T395-F421 HydrophobicContact CG2-CZ 4.43Å
396	L	96.5	Very high	95.6	Very high	51 Å²	51	44.5 Å²	44.5	27%	0.267	25%	0.254	S	S	.	.			trans	-56.8	137	170.2	-65.7	173.7	0	0	0	110.1	N362 M364 T370 H373 D393 S403	N362-L396 HydrophobicContact CB-CD1 4Å; M364-L396 HydrophobicContact CE-CB 4.16Å; M364-L396 HydrophobicContact CE-CD1 4.36Å; T370-L396 HydrophobicContact CG2-CD1 4.18Å; H373-L396 PolarHBondContact CE1-O 2.84Å; H373-L396 PolarHBondContact NE2-O 2.88Å; D393-L396 HydrophobicContact CB-CD1 3.93Å; D393-L396 HydrophobicContact CB-CG 3.87Å; L396-S403 WeakPolarHBondContact O-CA 3.33Å
397	L	96.5	Very high	95.5	Very high	88 Å²	88	46.6 Å²	46.6	46%	0.461	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-101.8	136.6	-178.2	-57.3	-178.7	0	0	0	110.8	T395 K402	T395-L397 PolarHBondContact O-N 3.39Å; L397-K402 WeakPolarHBondContact CA-O 3.34Å
398	N	94.1	Very high	95.4	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.027	27%	0.265	C	S	.	.			trans	-79.7	-179.1	169.2	70.5	12.4	0	0	0	112.4	Q368 F369 H400 S401 K402 M407	Q368-N398 WeakPolarHBondContact O-CA 3.31Å; F369-N398 HydrophobicContact CD2-CB 3.82Å; F369-N398 HydrophobicContact CE2-CB 3.96Å; F369-N398 WeakPolarHBondContact CE2-ND2 3.43Å; F369-N398 HydrophobicContact CG-CB 4.44Å; F369-N398 VanDerWaalsContact CZ-ND2 3.27Å; F369-N398 WeakPolarHBondContact CZ-ND2 3.34Å; N398-H400 PolarHBondContact O-N 2.84Å; N398-H400 WeakPolarHBondContact OD1-CA 3.45Å; N398-H400 WeakPolarHBondContact OD1-CB 3.49Å; N398-H400 PolarHBondContact OD1-N 3.48Å; N398-S401 PolarHBondContact O-N 2.91Å; N398-S401 PolarHBondContact OD1-N 3.16Å; N398-K402 PolarHBondContact N-O 2.97Å; N398-K402 PolarHBondContact OD1-N 2.95Å; N398-K402 VanDerWaalsContact OD1-N 3.15Å; N398-K402 PolarHBondContact OD1-O 3.25Å; N398-M407 PolarHBondContact ND2-SD 3.03Å
399	C	93.5	Very high	95.4	Very high	57 Å²	57	50.6 Å²	50.6	39%	0.385	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.3	179.8	73.1	0	0	0	0	115.2	W367	W367-C399 VanDerWaalsContact O-CB 3.27Å; W367-C399 WeakPolarHBondContact O-CB 3.45Å; W367-C399 PolarHBondContact O-N 3.03Å; W367-C399 PolarHBondContact O-SG 3.38Å
400	H	92.9	Very high	95.4	Very high	121 Å²	121	51.5 Å²	51.5	56%	0.56	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	10.5	174.4	-53.5	95.1	0	0	0	112.5	F369 N398 K402	F369-H400 AromaticContact CE2-ND1 3.92Å; N398-H400 PolarHBondContact O-N 2.84Å; N398-H400 WeakPolarHBondContact OD1-CA 3.45Å; N398-H400 WeakPolarHBondContact OD1-CB 3.49Å; N398-H400 PolarHBondContact OD1-N 3.48Å; H400-K402 HydrophobicContact CB-CG 4.48Å; H400-K402 PolarHBondContact O-N 3.25Å
401	S	94.9	Very high	95.4	Very high	95 Å²	95	51.8 Å²	51.8	66%	0.664	30%	0.304	S	S	*	.	S	Bend	trans	56.6	30.7	-173.8	-55.1	0	0	0	0	113.7	N398	N398-S401 PolarHBondContact O-N 2.91Å; N398-S401 PolarHBondContact OD1-N 3.16Å
402	K	96.5	Very high	95.5	Very high	112 Å²	112	55.6 Å²	55.6	49%	0.487	31%	0.31	S	S	.	.			trans	-107.6	138.4	174.9	-67.5	-173.1	179.7	-177.5	0	110.2	H373 L397 N398 H400 D406 M407	H373-K402 PolarHBondContact NE2-O 2.97Å; L397-K402 WeakPolarHBondContact CA-O 3.34Å; N398-K402 PolarHBondContact N-O 2.97Å; N398-K402 PolarHBondContact OD1-N 2.95Å; N398-K402 VanDerWaalsContact OD1-N 3.15Å; N398-K402 PolarHBondContact OD1-O 3.25Å; H400-K402 HydrophobicContact CB-CG 4.48Å; H400-K402 PolarHBondContact O-N 3.25Å; K402-D406 HydrophobicContact CB-CB 4.16Å; K402-D406 HydrophobicContact CG-CB 4.47Å; K402-M407 HydrophobicContact CB-CG 4.05Å; K402-M407 HydrophobicContact CD-CG 4.32Å
403	S	97.5	Very high	95.4	Very high	12 Å²	12	55.7 Å²	55.7	8%	0.084	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-85.1	168.2	170.7	74.1	0	0	0	0	111.7	P394 L396 V405 D406 M407	P394-S403 VanDerWaalsContact O-CB 3.3Å; P394-S403 WeakPolarHBondContact O-CB 3.21Å; L396-S403 WeakPolarHBondContact O-CA 3.33Å; S403-V405 PolarHBondContact O-N 2.95Å; S403-V405 PolarHBondContact OG-N 3.23Å; S403-D406 VanDerWaalsContact CB-OD2 3.28Å; S403-D406 WeakPolarHBondContact CB-OD2 3.49Å; S403-D406 PolarHBondContact N-OD2 3.18Å; S403-D406 PolarHBondContact O-N 3.23Å; S403-D406 VanDerWaalsContact O-N 3.11Å; S403-D406 PolarHBondContact OG-N 3.45Å; S403-D406 VanDerWaalsContact OG-N 3.13Å; S403-D406 PolarHBondContact OG-OD2 3.07Å; S403-M407 WeakPolarHBondContact O-CG 3.47Å; S403-M407 PolarHBondContact O-N 2.89Å; S403-M407 VanDerWaalsContact O-N 3.14Å
404	A	96.5	Very high	95.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.1	-31.4	173.8	0	0	0	0	0	111.9	L372 H373 A376 P394 M407 A408	L372-A404 HydrophobicContact CB-CB 4.49Å; L372-A404 HydrophobicContact CD2-CB 4.23Å; L372-A404 HydrophobicContact CG-CB 3.91Å; H373-A404 PolarHBondContact NE2-N 3.33Å; A376-A404 HydrophobicContact CB-CB 4.31Å; A376-A404 WeakPolarHBondContact CB-O 3.29Å; P394-A404 HydrophobicContact CB-CB 4.31Å; P394-A404 PolarHBondContact O-N 2.87Å; A404-M407 PolarHBondContact O-N 3.49Å; A404-A408 PolarHBondContact O-N 2.55Å
405	V	96.8	Very high	95.3	Very high	26 Å²	26	64.2 Å²	64.2	16%	0.158	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-39.7	173.7	-167.8	0	0	0	0	111.2	P394 S403 M407 A408 K414 L417	P394-V405 HydrophobicContact CB-CG2 3.86Å; P394-V405 HydrophobicContact CG-CG2 4.46Å; S403-V405 PolarHBondContact O-N 2.95Å; S403-V405 PolarHBondContact OG-N 3.23Å; V405-M407 VanDerWaalsContact C-N 3.28Å; V405-M407 PolarHBondContact O-N 3.07Å; V405-A408 PolarHBondContact O-N 3.4Å; V405-K414 HydrophobicContact CG1-CB 3.94Å; V405-K414 HydrophobicContact CG1-CG 4.16Å; V405-K414 WeakPolarHBondContact O-CD 3.45Å; V405-K414 WeakPolarHBondContact O-CE 3.35Å; V405-K414 WeakPolarHBondContact O-CG 3.5Å; V405-K414 PolarHBondContact O-NZ 3.04Å; V405-L417 HydrophobicContact CG2-CB 4.26Å
406	D	96.1	Very high	95.3	Very high	89 Å²	89	65.6 Å²	65.6	48%	0.476	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-35.8	177.9	-62.7	-54.8	0	0	0	112	K402 S403 K414	K402-D406 HydrophobicContact CB-CB 4.16Å; K402-D406 HydrophobicContact CG-CB 4.47Å; S403-D406 VanDerWaalsContact CB-OD2 3.28Å; S403-D406 WeakPolarHBondContact CB-OD2 3.49Å; S403-D406 PolarHBondContact N-OD2 3.18Å; S403-D406 PolarHBondContact O-N 3.23Å; S403-D406 VanDerWaalsContact O-N 3.11Å; S403-D406 PolarHBondContact OG-N 3.45Å; S403-D406 VanDerWaalsContact OG-N 3.13Å; S403-D406 PolarHBondContact OG-OD2 3.07Å; D406-K414 PolarHBondContact O-NZ 3.3Å
407	M	94.9	Very high	95.3	Very high	45 Å²	45	63.2 Å²	63.2	22%	0.222	33%	0.331	C	S	.	.	H	α-helix	trans	-79.4	-17.2	-177.9	-68.4	-164.7	62.3	0	0	115	F369 H373 N398 K402 S403 A404 V405	F369-M407 HydrophobicContact CD1-CE 4.47Å; F369-M407 HydrophobicContact CE1-CE 3.43Å; F369-M407 VanDerWaalsContact CE1-CE 3.43Å; F369-M407 HydrophobicContact CE1-SD 3.81Å; F369-M407 HydrophobicContact CZ-CE 3.88Å; F369-M407 HydrophobicContact CZ-SD 4.09Å; H373-M407 HydrophobicContact CB-SD 4.41Å; N398-M407 PolarHBondContact ND2-SD 3.03Å; K402-M407 HydrophobicContact CB-CG 4.05Å; K402-M407 HydrophobicContact CD-CG 4.32Å; S403-M407 WeakPolarHBondContact O-CG 3.47Å; S403-M407 PolarHBondContact O-N 2.89Å; S403-M407 VanDerWaalsContact O-N 3.14Å; A404-M407 PolarHBondContact O-N 3.49Å; V405-M407 VanDerWaalsContact C-N 3.28Å; V405-M407 PolarHBondContact O-N 3.07Å
408	A	96.1	Very high	95.2	Very high	3 Å²	3	61.6 Å²	61.6	3%	0.025	33%	0.325	C	S	.	.			trans	-61.8	131.1	175.4	0	0	0	0	0	111.2	A376 A404 V405 L413 K414 L417	A376-A408 HydrophobicContact CB-CB 4.47Å; A404-A408 PolarHBondContact O-N 2.55Å; V405-A408 PolarHBondContact O-N 3.4Å; A408-L413 HydrophobicContact CB-CB 4.16Å; A408-L413 HydrophobicContact CB-CD2 3.82Å; A408-L413 HydrophobicContact CB-CG 3.83Å; A408-K414 HydrophobicContact CB-CG 3.82Å; A408-K414 WeakPolarHBondContact O-CE 3.26Å; A408-L417 HydrophobicContact CB-CD1 4.06Å
409	P	94.9	Very high	95.2	Very high	83 Å²	83	65.6 Å²	65.6	54%	0.539	34%	0.34	S	S	.	.	S	Bend	trans	-78	-22.9	-173.6	28.5	-34.3	0	0	0	114.1	A376 N379	A376-P409 WeakPolarHBondContact O-CD 3.3Å; N379-P409 HydrophobicContact CB-CG 3.86Å
410	T	94.3	Very high	95.3	Very high	41 Å²	41	63.4 Å²	63.4	25%	0.252	32%	0.324	S	S	.	.	S	Bend	trans	-113.4	140.7	-173.7	51.8	0	0	0	0	111.3	N379 E412 L413 K414	N379-T410 PolarHBondContact OD1-OG1 3.09Å; T410-E412 VanDerWaalsContact C-N 3.25Å; T410-E412 WeakPolarHBondContact CB-OE2 3.03Å; T410-E412 PolarHBondContact O-N 3.26Å; T410-L413 PolarHBondContact O-N 2.97Å; T410-L413 VanDerWaalsContact OG1-CB 3.24Å; T410-L413 WeakPolarHBondContact OG1-CB 3.07Å; T410-K414 PolarHBondContact O-N 3.22Å
411	P	94.6	Very high	95.4	Very high	88 Å²	88	60.1 Å²	60.1	57%	0.571	31%	0.309	S	S	*	.	H	α-helix	trans	-62.5	-32.8	177.9	24.6	-31.7	0	0	0	112.5	L413 K414 E415	P411-L413 VanDerWaalsContact C-N 3.34Å; P411-L413 PolarHBondContact O-N 3.18Å; P411-K414 WeakPolarHBondContact O-CB 3.12Å; P411-K414 PolarHBondContact O-N 3Å; P411-K414 VanDerWaalsContact O-N 3.14Å; P411-E415 PolarHBondContact O-N 3.19Å
412	E	94.4	Very high	95.3	Very high	126 Å²	126	59.3 Å²	59.3	59%	0.589	29%	0.293	S	S	*	.	H	α-helix	trans	-61.9	-41.3	177.3	-59.5	72.9	-159.6	0	0	111.3	T410 R416	T410-E412 VanDerWaalsContact C-N 3.25Å; T410-E412 WeakPolarHBondContact CB-OE2 3.03Å; T410-E412 PolarHBondContact O-N 3.26Å; E412-R416 VanDerWaalsContact O-CB 3.27Å; E412-R416 WeakPolarHBondContact O-CB 3.18Å; E412-R416 PolarHBondContact O-N 3.01Å
413	L	95	Very high	95.2	Very high	3 Å²	3	54 Å²	54	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-34.5	175.4	-177.9	58.4	0	0	0	111.6	N379 V381 C384 A408 T410 P411 R416 L417	N379-L413 WeakPolarHBondContact OD1-CD2 3.49Å; V381-L413 HydrophobicContact CG1-CD1 4.44Å; V381-L413 HydrophobicContact CG2-CD1 4.4Å; C384-L413 HydrophobicContact CB-CD1 4.37Å; A408-L413 HydrophobicContact CB-CB 4.16Å; A408-L413 HydrophobicContact CB-CD2 3.82Å; A408-L413 HydrophobicContact CB-CG 3.83Å; T410-L413 PolarHBondContact O-N 2.97Å; T410-L413 VanDerWaalsContact OG1-CB 3.24Å; T410-L413 WeakPolarHBondContact OG1-CB 3.07Å; P411-L413 VanDerWaalsContact C-N 3.34Å; P411-L413 PolarHBondContact O-N 3.18Å; L413-R416 PolarHBondContact O-N 3.14Å; L413-L417 HydrophobicContact CD1-CD1 4.36Å; L413-L417 HydrophobicContact CD1-CD2 4.44Å; L413-L417 HydrophobicContact CD1-CG 3.99Å; L413-L417 HydrophobicContact CG-CD1 4.1Å; L413-L417 HydrophobicContact CG-CG 4.23Å; L413-L417 WeakPolarHBondContact O-CB 3.2Å; L413-L417 VanDerWaalsContact O-CG 3.22Å; L413-L417 WeakPolarHBondContact O-CG 3.22Å; L413-L417 PolarHBondContact O-N 2.94Å
414	K	96.2	Very high	95.1	Very high	74 Å²	74	54.3 Å²	54.3	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-46.3	175.2	-65.7	-169.7	-179.8	-151.1	0	112.1	V405 D406 A408 T410 P411 T418	V405-K414 HydrophobicContact CG1-CB 3.94Å; V405-K414 HydrophobicContact CG1-CG 4.16Å; V405-K414 WeakPolarHBondContact O-CD 3.45Å; V405-K414 WeakPolarHBondContact O-CE 3.35Å; V405-K414 WeakPolarHBondContact O-CG 3.5Å; V405-K414 PolarHBondContact O-NZ 3.04Å; D406-K414 PolarHBondContact O-NZ 3.3Å; A408-K414 HydrophobicContact CB-CG 3.82Å; A408-K414 WeakPolarHBondContact O-CE 3.26Å; T410-K414 PolarHBondContact O-N 3.22Å; P411-K414 WeakPolarHBondContact O-CB 3.12Å; P411-K414 PolarHBondContact O-N 3Å; P411-K414 VanDerWaalsContact O-N 3.14Å; K414-T418 WeakPolarHBondContact O-CB 3.22Å; K414-T418 PolarHBondContact O-N 3.28Å; K414-T418 PolarHBondContact O-OG1 2.87Å
415	E	94.4	Very high	95	Very high	148 Å²	148	56 Å²	56	69%	0.692	28%	0.282	S	S	*	.	H	α-helix	trans	-61.8	-48.5	175.4	-174.6	173.3	-171.6	0	0	110.4	P411 L417 T418 Y419	P411-E415 PolarHBondContact O-N 3.19Å; E415-L417 PolarHBondContact O-N 2.88Å; E415-T418 PolarHBondContact O-N 3.2Å; E415-Y419 VanDerWaalsContact O-CB 3.3Å; E415-Y419 WeakPolarHBondContact O-CB 3.45Å; E415-Y419 PolarHBondContact O-N 2.98Å
416	R	94.8	Very high	95	Very high	110 Å²	110	54.9 Å²	54.9	42%	0.415	28%	0.275	S	S	.	.	H	α-helix	trans	-59.3	-48.9	179	-172.8	174.4	-173.8	136	11.7	113.2	S385 E412 L413 T418 Y419 E420	S385-R416 PolarHBondContact OG-NE 2.93Å; S385-R416 VanDerWaalsContact OG-NE 3.16Å; S385-R416 PolarHBondContact OG-NH2 3.39Å; E412-R416 VanDerWaalsContact O-CB 3.27Å; E412-R416 WeakPolarHBondContact O-CB 3.18Å; E412-R416 PolarHBondContact O-N 3.01Å; L413-R416 PolarHBondContact O-N 3.14Å; R416-T418 VanDerWaalsContact C-N 3.26Å; R416-T418 PolarHBondContact O-N 3.09Å; R416-Y419 PolarHBondContact O-N 3.29Å; R416-E420 HydrophobicContact CG-CG 4.24Å; R416-E420 IonicContact CZ-OE1 3.69Å; R416-E420 IonicContact NE-OE1 3.88Å; R416-E420 PolarHBondContact NE-OE1 3.16Å; R416-E420 IonicContact NE-OE2 2.72Å; R416-E420 IonicContact NH2-OE1 2.63Å; R416-E420 PolarHBondContact NH2-OE1 3.29Å; R416-E420 WeakPolarHBondContact O-CB 3.17Å; R416-E420 PolarHBondContact O-N 3.48Å
417	L	95.6	Very high	94.9	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-56.6	-43	177.1	-74.7	171.9	0	0	0	111.2	L372 A376 C384 L388 V405 A408 L413 E415 F421	L372-L417 HydrophobicContact CD1-CD2 4Å; A376-L417 HydrophobicContact CB-CD1 4.06Å; C384-L417 HydrophobicContact CB-CD2 3.81Å; L388-L417 HydrophobicContact CD1-CD2 3.84Å; L388-L417 HydrophobicContact CG-CD2 4.48Å; V405-L417 HydrophobicContact CG2-CB 4.26Å; A408-L417 HydrophobicContact CB-CD1 4.06Å; L413-L417 HydrophobicContact CD1-CD1 4.36Å; L413-L417 HydrophobicContact CD1-CD2 4.44Å; L413-L417 HydrophobicContact CD1-CG 3.99Å; L413-L417 HydrophobicContact CG-CD1 4.1Å; L413-L417 HydrophobicContact CG-CG 4.23Å; L413-L417 WeakPolarHBondContact O-CB 3.2Å; L413-L417 VanDerWaalsContact O-CG 3.22Å; L413-L417 WeakPolarHBondContact O-CG 3.22Å; L413-L417 PolarHBondContact O-N 2.94Å; E415-L417 PolarHBondContact O-N 2.88Å; L417-F421 WeakPolarHBondContact O-CB 3.47Å; L417-F421 PolarHBondContact O-N 3.09Å; L417-F421 VanDerWaalsContact O-N 3.12Å
418	T	94.3	Very high	94.9	Very high	54 Å²	54	52.3 Å²	52.3	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-42.7	179.7	-54.6	0	0	0	0	111.9	K414 E415 R416 K422	K414-T418 WeakPolarHBondContact O-CB 3.22Å; K414-T418 PolarHBondContact O-N 3.28Å; K414-T418 PolarHBondContact O-OG1 2.87Å; E415-T418 PolarHBondContact O-N 3.2Å; R416-T418 VanDerWaalsContact C-N 3.26Å; R416-T418 PolarHBondContact O-N 3.09Å; T418-K422 HydrophobicContact CG2-CD 4.4Å; T418-K422 WeakPolarHBondContact O-CB 3.41Å; T418-K422 VanDerWaalsContact O-CG 3.28Å; T418-K422 WeakPolarHBondContact O-CG 3.34Å; T418-K422 PolarHBondContact O-N 2.76Å; T418-K422 VanDerWaalsContact O-N 3.16Å
419	Y	94.3	Very high	94.8	Very high	90 Å²	90	52.2 Å²	52.2	35%	0.353	26%	0.259	S	S	.	.	H	α-helix	trans	-66.2	-52.4	-179.9	178.6	-100.7	0	0	0	111.8	E415 R416 F421 K422 G423 E445 I446 F449	E415-Y419 VanDerWaalsContact O-CB 3.3Å; E415-Y419 WeakPolarHBondContact O-CB 3.45Å; E415-Y419 PolarHBondContact O-N 2.98Å; R416-Y419 PolarHBondContact O-N 3.29Å; Y419-F421 PolarHBondContact O-N 2.83Å; Y419-K422 PolarHBondContact O-N 3.43Å; Y419-G423 PolarHBondContact O-N 3.1Å; Y419-E445 WeakPolarHBondContact CE2-O 3.47Å; Y419-I446 HydrophobicContact CD2-CD1 3.61Å; Y419-I446 HydrophobicContact CE2-CD1 3.75Å; Y419-I446 HydrophobicContact CG-CD1 4.48Å; Y419-F449 HydrophobicContact CD1-CD2 4.24Å; Y419-F449 HydrophobicContact CD1-CE2 4.29Å; Y419-F449 AromaticContact CE1-CD2 3.57Å; Y419-F449 HydrophobicContact CE1-CD2 3.57Å; Y419-F449 AromaticContact CE1-CE2 3.95Å; Y419-F449 HydrophobicContact CE1-CE2 3.95Å; Y419-F449 AromaticContact CZ-CD2 3.94Å
420	E	95.3	Very high	94.9	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-65.3	-39.9	-179.6	-72.4	-177.6	173.6	0	0	111.6	S385 L388 R416 G423 H424 F449	S385-E420 VanDerWaalsContact CA-OE2 3.31Å; S385-E420 WeakPolarHBondContact CA-OE2 3.49Å; S385-E420 VanDerWaalsContact CB-OE2 3.22Å; S385-E420 WeakPolarHBondContact CB-OE2 3.49Å; S385-E420 PolarHBondContact OG-OE1 2.89Å; S385-E420 PolarHBondContact OG-OE2 3.01Å; L388-E420 HydrophobicContact CD1-CB 3.72Å; R416-E420 HydrophobicContact CG-CG 4.24Å; R416-E420 IonicContact CZ-OE1 3.69Å; R416-E420 IonicContact NE-OE1 3.88Å; R416-E420 PolarHBondContact NE-OE1 3.16Å; R416-E420 IonicContact NE-OE2 2.72Å; R416-E420 IonicContact NH2-OE1 2.63Å; R416-E420 PolarHBondContact NH2-OE1 3.29Å; R416-E420 WeakPolarHBondContact O-CB 3.17Å; R416-E420 PolarHBondContact O-N 3.48Å; E420-G423 WeakPolarHBondContact O-CA 3.36Å; E420-G423 PolarHBondContact O-N 2.97Å; E420-H424 PolarHBondContact O-CD2 3.29Å; E420-H424 PolarHBondContact O-N 3.48Å; E420-F449 HydrophobicContact CB-CE2 4.45Å; E420-F449 HydrophobicContact CG-CE2 4.15Å
421	F	95.3	Very high	94.9	Very high	53 Å²	53	51 Å²	51	23%	0.232	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-44.7	176.1	177.4	-117.2	0	0	0	113	L388 D393 P394 T395 L417 Y419 G423 S425	L388-F421 HydrophobicContact CD2-CB 4.05Å; L388-F421 HydrophobicContact CD2-CD2 4.3Å; D393-F421 HydrophobicContact CB-CE2 4.36Å; P394-F421 VanDerWaalsContact CD-CG 3.41Å; P394-F421 HydrophobicContact CG-CB 3.68Å; P394-F421 HydrophobicContact CG-CD1 3.76Å; P394-F421 HydrophobicContact CG-CD2 3.92Å; P394-F421 HydrophobicContact CG-CE1 4.34Å; P394-F421 HydrophobicContact CG-CE2 4.48Å; P394-F421 HydrophobicContact CG-CG 3.51Å; T395-F421 HydrophobicContact CG2-CD1 4.38Å; T395-F421 HydrophobicContact CG2-CE1 3.8Å; T395-F421 HydrophobicContact CG2-CZ 4.43Å; L417-F421 WeakPolarHBondContact O-CB 3.47Å; L417-F421 PolarHBondContact O-N 3.09Å; L417-F421 VanDerWaalsContact O-N 3.12Å; Y419-F421 PolarHBondContact O-N 2.83Å; F421-G423 VanDerWaalsContact C-N 3.3Å; F421-G423 PolarHBondContact O-N 3.27Å; F421-S425 VanDerWaalsContact O-CB 3.23Å; F421-S425 WeakPolarHBondContact O-CB 3.29Å; F421-S425 PolarHBondContact O-N 2.95Å; F421-S425 PolarHBondContact O-OG 3.33Å
422	K	94.1	Very high	94.9	Very high	77 Å²	77	49.9 Å²	49.9	34%	0.335	23%	0.226	S	C	.	.	H	α-helix	trans	-59.7	-42.5	172	-75	170.8	174.3	177.1	0	111.1	T418 Y419 S425 L426 E445 I446	T418-K422 HydrophobicContact CG2-CD 4.4Å; T418-K422 WeakPolarHBondContact O-CB 3.41Å; T418-K422 VanDerWaalsContact O-CG 3.28Å; T418-K422 WeakPolarHBondContact O-CG 3.34Å; T418-K422 PolarHBondContact O-N 2.76Å; T418-K422 VanDerWaalsContact O-N 3.16Å; Y419-K422 PolarHBondContact O-N 3.43Å; K422-S425 PolarHBondContact O-N 3.38Å; K422-L426 PolarHBondContact O-N 3.04Å; K422-E445 IonicContact NZ-OE1 3.21Å; K422-E445 PolarHBondContact NZ-OE1 3.15Å; K422-I446 HydrophobicContact CB-CD1 3.71Å; K422-I446 HydrophobicContact CB-CG1 3.96Å; K422-I446 HydrophobicContact CB-CG2 4.36Å; K422-I446 HydrophobicContact CD-CD1 3.84Å; K422-I446 HydrophobicContact CD-CG1 4.09Å; K422-I446 HydrophobicContact CG-CD1 4.49Å
423	G	94.8	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-59.9	176.7	0	0	0	0	0	112.9	Y419 E420 F421 S425 L426 L427 F449	Y419-G423 PolarHBondContact O-N 3.1Å; E420-G423 WeakPolarHBondContact O-CA 3.36Å; E420-G423 PolarHBondContact O-N 2.97Å; F421-G423 VanDerWaalsContact C-N 3.3Å; F421-G423 PolarHBondContact O-N 3.27Å; G423-S425 VanDerWaalsContact C-N 3.28Å; G423-S425 PolarHBondContact O-N 2.66Å; G423-L426 WeakPolarHBondContact O-CB 3.35Å; G423-L426 PolarHBondContact O-N 3.46Å; G423-L427 WeakPolarHBondContact O-CG 3.46Å; G423-L427 PolarHBondContact O-N 3.47Å; G423-F449 VanDerWaalsContact C-CD1 3.45Å; G423-F449 VanDerWaalsContact C-CE1 3.47Å; G423-F449 VanDerWaalsContact CA-CG 3.46Å
424	H	95.1	Very high	94.9	Very high	20 Å²	20	46.2 Å²	46.2	9%	0.093	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-37.1	177.3	-73.4	-70.5	0	0	0	112.3	S389 E420 L426 L427 Q428 F449 H451	S389-H424 VanDerWaalsContact CA-CE1 3.47Å; S389-H424 WeakPolarHBondContact CA-CE1 3.35Å; S389-H424 VanDerWaalsContact CB-CE1 3.46Å; S389-H424 WeakPolarHBondContact CB-CE1 3.26Å; E420-H424 PolarHBondContact O-CD2 3.29Å; E420-H424 PolarHBondContact O-N 3.48Å; H424-L426 PolarHBondContact O-N 3.21Å; H424-L427 PolarHBondContact O-N 3.47Å; H424-Q428 WeakPolarHBondContact O-CB 3.39Å; H424-Q428 PolarHBondContact O-N 3.15Å; H424-F449 AromaticContact CD2-CZ 3.83Å; H424-F449 AromaticContact NE2-CZ 3.73Å; H424-H451 AromaticContact CE1-CD2 3.59Å; H424-H451 AromaticContact CE1-CE1 3.97Å; H424-H451 AromaticContact CE1-NE2 3.51Å; H424-H451 AromaticContact ND1-CD2 3.63Å; H424-H451 AromaticContact ND1-NE2 3.64Å
425	S	94.1	Very high	94.7	Very high	36 Å²	36	44.6 Å²	44.6	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-60.9	-41.8	172.9	-63.2	0	0	0	0	112.7	F421 K422 G423 A429	F421-S425 VanDerWaalsContact O-CB 3.23Å; F421-S425 WeakPolarHBondContact O-CB 3.29Å; F421-S425 PolarHBondContact O-N 2.95Å; F421-S425 PolarHBondContact O-OG 3.33Å; K422-S425 PolarHBondContact O-N 3.38Å; G423-S425 VanDerWaalsContact C-N 3.28Å; G423-S425 PolarHBondContact O-N 2.66Å; S425-A429 VanDerWaalsContact O-CB 3.25Å; S425-A429 WeakPolarHBondContact O-CB 3.36Å; S425-A429 PolarHBondContact O-N 3.41Å
426	L	95.5	Very high	94.7	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-67.8	-41.1	175.5	-180	64.6	0	0	0	111.6	K422 G423 H424 A429 A430 V438 T441 L442 I446 A458	K422-L426 PolarHBondContact O-N 3.04Å; G423-L426 WeakPolarHBondContact O-CB 3.35Å; G423-L426 PolarHBondContact O-N 3.46Å; H424-L426 PolarHBondContact O-N 3.21Å; L426-A429 PolarHBondContact O-N 3.11Å; L426-A430 VanDerWaalsContact O-CB 3.31Å; L426-A430 WeakPolarHBondContact O-CB 3.48Å; L426-A430 PolarHBondContact O-N 2.98Å; L426-V438 HydrophobicContact CD1-CG1 4.12Å; L426-V438 HydrophobicContact CD1-CG2 4.49Å; L426-T441 WeakPolarHBondContact CD1-OG1 3.14Å; L426-L442 HydrophobicContact CD1-CB 4.18Å; L426-L442 HydrophobicContact CD1-CD1 4.28Å; L426-L442 HydrophobicContact CD2-CD1 4.02Å; L426-I446 HydrophobicContact CB-CG2 4.18Å; L426-I446 HydrophobicContact CD2-CG2 3.83Å; L426-A458 HydrophobicContact CD2-CB 3.94Å; L426-A458 HydrophobicContact CG-CB 3.84Å
427	L	95.6	Very high	94.6	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-45.5	176.2	-64.6	-174.2	0	0	0	111.6	G423 H424 A430 R431 F449 H451 A458	G423-L427 WeakPolarHBondContact O-CG 3.46Å; G423-L427 PolarHBondContact O-N 3.47Å; H424-L427 PolarHBondContact O-N 3.47Å; L427-A430 PolarHBondContact O-N 3.37Å; L427-R431 WeakPolarHBondContact O-CB 3.36Å; L427-R431 PolarHBondContact O-N 3.04Å; L427-F449 HydrophobicContact CD1-CD1 3.85Å; L427-F449 HydrophobicContact CD1-CE1 3.68Å; L427-F449 HydrophobicContact CD2-CD1 4.37Å; L427-F449 HydrophobicContact CG-CD1 3.96Å; L427-F449 HydrophobicContact CG-CE1 4.19Å; L427-H451 HydrophobicContact CD1-CB 3.71Å; L427-A458 HydrophobicContact CD2-CB 4.2Å
428	Q	93.7	Very high	94.5	Very high	77 Å²	77	40 Å²	40	36%	0.36	20%	0.198	S	C	.	.	H	α-helix	trans	-68.5	-42.7	179.1	-175.4	60.3	16.2	0	0	111.7	H424 A430 R431 E432	H424-Q428 WeakPolarHBondContact O-CB 3.39Å; H424-Q428 PolarHBondContact O-N 3.15Å; Q428-A430 VanDerWaalsContact C-N 3.28Å; Q428-A430 PolarHBondContact O-N 2.99Å; Q428-R431 WeakPolarHBondContact O-CB 3.47Å; Q428-R431 PolarHBondContact O-N 3.16Å; Q428-R431 VanDerWaalsContact O-N 3.17Å; Q428-E432 WeakPolarHBondContact CG-OE1 3.11Å; Q428-E432 PolarHBondContact NE2-OE1 3.47Å; Q428-E432 WeakPolarHBondContact O-CG 3.42Å; Q428-E432 PolarHBondContact O-N 3.2Å
429	A	94.9	Very high	94.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-37.4	174.6	0	0	0	0	0	112.7	S425 L426 A433 D434 K437 V438	S425-A429 VanDerWaalsContact O-CB 3.25Å; S425-A429 WeakPolarHBondContact O-CB 3.36Å; S425-A429 PolarHBondContact O-N 3.41Å; L426-A429 PolarHBondContact O-N 3.11Å; A429-A433 PolarHBondContact O-N 3.25Å; A429-D434 PolarHBondContact O-N 3.45Å; A429-K437 HydrophobicContact CB-CB 3.5Å; A429-K437 VanDerWaalsContact CB-CB 3.5Å; A429-K437 HydrophobicContact CB-CD 4.47Å; A429-V438 HydrophobicContact CB-CG2 3.7Å
430	A	95.9	Very high	94.2	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-42.2	174	0	0	0	0	0	112.2	L426 L427 Q428 E432 A433 A458 C461 A462 V473	L426-A430 VanDerWaalsContact O-CB 3.31Å; L426-A430 WeakPolarHBondContact O-CB 3.48Å; L426-A430 PolarHBondContact O-N 2.98Å; L427-A430 PolarHBondContact O-N 3.37Å; Q428-A430 VanDerWaalsContact C-N 3.28Å; Q428-A430 PolarHBondContact O-N 2.99Å; A430-E432 PolarHBondContact O-N 3.12Å; A430-A433 PolarHBondContact O-N 3.47Å; A430-A458 HydrophobicContact CB-CB 4.2Å; A430-A458 VanDerWaalsContact CB-O 3.3Å; A430-A458 WeakPolarHBondContact CB-O 3.34Å; A430-C461 HydrophobicContact CB-CB 3.9Å; A430-A462 HydrophobicContact CB-CB 4.16Å; A430-A462 WeakPolarHBondContact O-CA 3.42Å; A430-V473 HydrophobicContact CB-CG1 4.46Å
431	R	94.9	Very high	93.9	Very high	99 Å²	99	49.9 Å²	49.9	37%	0.374	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-40.9	176.9	-171.4	-180	-70.5	142.5	-10.1	112.4	L427 Q428 A433 C461 S465	L427-R431 WeakPolarHBondContact O-CB 3.36Å; L427-R431 PolarHBondContact O-N 3.04Å; Q428-R431 WeakPolarHBondContact O-CB 3.47Å; Q428-R431 PolarHBondContact O-N 3.16Å; Q428-R431 VanDerWaalsContact O-N 3.17Å; R431-A433 PolarHBondContact O-N 2.9Å; R431-C461 HydrophobicContact CB-CB 4.22Å; R431-S465 VanDerWaalsContact O-CB 3.29Å; R431-S465 WeakPolarHBondContact O-CB 3.18Å; R431-S465 PolarHBondContact O-OG 2.8Å
432	E	94.8	Very high	93.5	Very high	65 Å²	65	48.9 Å²	48.9	30%	0.304	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.5	174	-68.3	171.7	-169.7	0	0	113.6	Q428 A430 D434 K437 H467	Q428-E432 WeakPolarHBondContact CG-OE1 3.11Å; Q428-E432 PolarHBondContact NE2-OE1 3.47Å; Q428-E432 WeakPolarHBondContact O-CG 3.42Å; Q428-E432 PolarHBondContact O-N 3.2Å; A430-E432 PolarHBondContact O-N 3.12Å; E432-D434 HydrophobicContact CB-CB 4.37Å; E432-D434 PolarHBondContact O-N 2.92Å; E432-K437 IonicContact OE1-NZ 3.56Å; E432-K437 IonicContact OE2-NZ 3.13Å; E432-K437 PolarHBondContact OE2-NZ 3.16Å; E432-H467 VanDerWaalsContact C-CD2 3.48Å; E432-H467 PolarHBondContact O-CD2 3.39Å; E432-H467 VanDerWaalsContact O-CD2 3.23Å
433	A	94.8	Very high	93.2	Very high	2 Å²	2	47 Å²	47	2%	0.017	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	32.8	-167.6	0	0	0	0	0	114.7	A429 A430 R431 M435 H467 K469 V473	A429-A433 PolarHBondContact O-N 3.25Å; A430-A433 PolarHBondContact O-N 3.47Å; R431-A433 PolarHBondContact O-N 2.9Å; A433-M435 PolarHBondContact O-N 3.4Å; A433-M435 VanDerWaalsContact O-N 3.13Å; A433-H467 HydrophobicContact CB-CB 3.83Å; A433-K469 HydrophobicContact CB-CB 3.97Å; A433-V473 HydrophobicContact CB-CG2 4.15Å
434	D	94.7	Very high	92.8	Very high	50 Å²	50	54.2 Å²	54.2	27%	0.267	28%	0.275	S	S	.	.			trans	-79.9	94.8	179.4	-173.8	-25.1	0	0	0	110.9	A429 E432 A436 K437 V438	A429-D434 PolarHBondContact O-N 3.45Å; E432-D434 HydrophobicContact CB-CB 4.37Å; E432-D434 PolarHBondContact O-N 2.92Å; D434-A436 PolarHBondContact O-N 3.17Å; D434-A436 VanDerWaalsContact O-N 3.14Å; D434-A436 WeakPolarHBondContact OD1-CA 3.48Å; D434-A436 WeakPolarHBondContact OD1-CB 3.42Å; D434-A436 PolarHBondContact OD1-N 3.22Å; D434-K437 HydrophobicContact CB-CB 4.07Å; D434-K437 HydrophobicContact CB-CD 4.03Å; D434-K437 HydrophobicContact CB-CG 4.23Å; D434-K437 PolarHBondContact O-N 2.81Å; D434-K437 PolarHBondContact OD1-N 3.16Å; D434-K437 WeakPolarHBondContact OD2-CD 3.33Å; D434-K437 WeakPolarHBondContact OD2-CE 3.3Å; D434-K437 VanDerWaalsContact OD2-CG 3.24Å; D434-K437 WeakPolarHBondContact OD2-CG 3.37Å; D434-K437 IonicContact OD2-NZ 3.34Å; D434-V438 WeakPolarHBondContact O-CB 3.33Å; D434-V438 VanDerWaalsContact O-CG2 3.3Å; D434-V438 WeakPolarHBondContact O-CG2 3.42Å; D434-V438 PolarHBondContact O-N 3.28Å
435	M	92.8	Very high	92.4	Very high	39 Å²	39	58.7 Å²	58.7	19%	0.192	30%	0.295	C	S	.	.	H	α-helix	trans	-56.4	-24.8	176.8	-76.3	-68.6	-75.1	0	0	114.7	A433 K439 Q472 V473 L476	A433-M435 PolarHBondContact O-N 3.4Å; A433-M435 VanDerWaalsContact O-N 3.13Å; M435-K439 WeakPolarHBondContact O-CB 3.46Å; M435-K439 WeakPolarHBondContact O-CD 3.24Å; M435-K439 WeakPolarHBondContact O-CG 3.35Å; M435-K439 PolarHBondContact O-N 3.02Å; M435-Q472 HydrophobicContact CE-CB 4.1Å; M435-Q472 HydrophobicContact CG-CB 4.37Å; M435-Q472 HydrophobicContact SD-CB 3.97Å; M435-V473 HydrophobicContact CG-CG2 3.86Å; M435-V473 HydrophobicContact SD-CB 4.2Å; M435-V473 HydrophobicContact SD-CG2 3.43Å; M435-V473 WeakPolarHBondContact SD-CG2 3.43Å; M435-L476 HydrophobicContact CE-CB 4.5Å; M435-L476 HydrophobicContact CE-CD2 3.95Å; M435-L476 HydrophobicContact SD-CD2 4.17Å
436	A	93.2	Very high	92.4	Very high	69 Å²	69	57 Å²	57	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-80.5	-47.9	178.1	0	0	0	0	0	110.8	D434 K439 K440	D434-A436 PolarHBondContact O-N 3.17Å; D434-A436 VanDerWaalsContact O-N 3.14Å; D434-A436 WeakPolarHBondContact OD1-CA 3.48Å; D434-A436 WeakPolarHBondContact OD1-CB 3.42Å; D434-A436 PolarHBondContact OD1-N 3.22Å; A436-K439 PolarHBondContact O-N 2.94Å; A436-K440 PolarHBondContact O-N 3.28Å
437	K	92.4	Very high	92.2	Very high	93 Å²	93	57.9 Å²	57.9	40%	0.404	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-41.5	174.3	-70	175.9	-166.3	175.5	0	112	A429 E432 D434 K440 T441	A429-K437 HydrophobicContact CB-CB 3.5Å; A429-K437 VanDerWaalsContact CB-CB 3.5Å; A429-K437 HydrophobicContact CB-CD 4.47Å; E432-K437 IonicContact OE1-NZ 3.56Å; E432-K437 IonicContact OE2-NZ 3.13Å; E432-K437 PolarHBondContact OE2-NZ 3.16Å; D434-K437 HydrophobicContact CB-CB 4.07Å; D434-K437 HydrophobicContact CB-CD 4.03Å; D434-K437 HydrophobicContact CB-CG 4.23Å; D434-K437 PolarHBondContact O-N 2.81Å; D434-K437 PolarHBondContact OD1-N 3.16Å; D434-K437 WeakPolarHBondContact OD2-CD 3.33Å; D434-K437 WeakPolarHBondContact OD2-CE 3.3Å; D434-K437 VanDerWaalsContact OD2-CG 3.24Å; D434-K437 WeakPolarHBondContact OD2-CG 3.37Å; D434-K437 IonicContact OD2-NZ 3.34Å; K437-K440 PolarHBondContact O-N 2.61Å; K437-T441 PolarHBondContact O-N 3.1Å; K437-T441 PolarHBondContact O-OG1 3.14Å
438	V	93.2	Very high	92	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-51.5	174.8	171.1	0	0	0	0	109.9	L426 A429 D434 K440 T441 L442 V473 L476	L426-V438 HydrophobicContact CD1-CG1 4.12Å; L426-V438 HydrophobicContact CD1-CG2 4.49Å; A429-V438 HydrophobicContact CB-CG2 3.7Å; D434-V438 WeakPolarHBondContact O-CB 3.33Å; D434-V438 VanDerWaalsContact O-CG2 3.3Å; D434-V438 WeakPolarHBondContact O-CG2 3.42Å; D434-V438 PolarHBondContact O-N 3.28Å; V438-K440 VanDerWaalsContact C-N 3.25Å; V438-K440 PolarHBondContact O-N 3.18Å; V438-T441 PolarHBondContact O-N 2.74Å; V438-T441 PolarHBondContact O-OG1 3.43Å; V438-L442 HydrophobicContact CG1-CB 4.42Å; V438-L442 HydrophobicContact CG1-CD2 4.16Å; V438-L442 WeakPolarHBondContact O-CB 3.44Å; V438-L442 PolarHBondContact O-N 3.13Å; V438-V473 HydrophobicContact CG2-CG1 4.06Å; V438-L476 HydrophobicContact CG1-CD2 3.95Å
439	K	92.3	Very high	92.1	Very high	143 Å²	143	56.9 Å²	56.9	62%	0.622	30%	0.297	S	S	*	.	H	α-helix	trans	-59.7	-32	177.6	-76.9	174.6	-178.5	-179.5	0	113.9	M435 A436 L476	M435-K439 WeakPolarHBondContact O-CB 3.46Å; M435-K439 WeakPolarHBondContact O-CD 3.24Å; M435-K439 WeakPolarHBondContact O-CG 3.35Å; M435-K439 PolarHBondContact O-N 3.02Å; A436-K439 PolarHBondContact O-N 2.94Å; K439-L476 HydrophobicContact CG-CD2 3.95Å
440	K	91.4	Very high	92	Very high	190 Å²	190	60.6 Å²	60.6	83%	0.826	31%	0.313	S	S	*	.	H	α-helix	trans	-73.8	-32.5	178	-174.2	-177.8	176.4	-172.3	0	113.2	A436 K437 V438	A436-K440 PolarHBondContact O-N 3.28Å; K437-K440 PolarHBondContact O-N 2.61Å; V438-K440 VanDerWaalsContact C-N 3.25Å; V438-K440 PolarHBondContact O-N 3.18Å
441	T	88.3	Confident	91.8	Very high	30 Å²	30	61.9 Å²	61.9	18%	0.184	32%	0.319	C	S	.	.	H	α-helix	trans	-102.2	-20.4	-172.9	51.5	0	0	0	0	113.9	L426 K437 V438 A443	L426-T441 WeakPolarHBondContact CD1-OG1 3.14Å; K437-T441 PolarHBondContact O-N 3.1Å; K437-T441 PolarHBondContact O-OG1 3.14Å; V438-T441 PolarHBondContact O-N 2.74Å; V438-T441 PolarHBondContact O-OG1 3.43Å; T441-A443 PolarHBondContact O-N 3.38Å; T441-A443 VanDerWaalsContact O-N 3.09Å
442	L	87.2	Confident	91.4	Very high	32 Å²	32	60 Å²	60	17%	0.168	32%	0.319	C	S	.	.			trans	-74	98.5	-174.5	-177.4	59.9	0	0	0	112.6	L426 V438 I447 L476 L477 K480	L426-L442 HydrophobicContact CD1-CB 4.18Å; L426-L442 HydrophobicContact CD1-CD1 4.28Å; L426-L442 HydrophobicContact CD2-CD1 4.02Å; V438-L442 HydrophobicContact CG1-CB 4.42Å; V438-L442 HydrophobicContact CG1-CD2 4.16Å; V438-L442 WeakPolarHBondContact O-CB 3.44Å; V438-L442 PolarHBondContact O-N 3.13Å; L442-I447 HydrophobicContact CD1-CB 4.05Å; L442-I447 HydrophobicContact CD1-CD1 3.89Å; L442-I447 HydrophobicContact CD1-CG1 3.78Å; L442-L476 HydrophobicContact CD2-CD2 4.36Å; L442-L476 HydrophobicContact CD2-CG 4.05Å; L442-L477 HydrophobicContact CD1-CD2 3.88Å; L442-L477 HydrophobicContact CD2-CD2 4.24Å; L442-K480 HydrophobicContact CD2-CB 4.17Å; L442-K480 HydrophobicContact CD2-CG 3.89Å
443	A	88.1	Confident	90.9	Very high	38 Å²	38	60.1 Å²	60.1	31%	0.314	32%	0.32	S	S	.	.			trans	-113.6	157.3	167.3	0	0	0	0	0	111	T441 E445 I446 I447	T441-A443 PolarHBondContact O-N 3.38Å; T441-A443 VanDerWaalsContact O-N 3.09Å; A443-E445 VanDerWaalsContact C-N 3.25Å; A443-E445 HydrophobicContact CB-CG 4.07Å; A443-E445 PolarHBondContact O-N 3.13Å; A443-I446 HydrophobicContact CB-CG1 4.22Å; A443-I446 PolarHBondContact O-N 3.38Å; A443-I447 PolarHBondContact O-N 2.98Å
444	L	85.5	Confident	90.7	Very high	151 Å²	151	61.4 Å²	61.4	79%	0.791	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.6	178.8	-84.3	160	0	0	0	112.7	I446 I447	L444-I446 VanDerWaalsContact C-N 3.3Å; L444-I446 PolarHBondContact O-N 2.79Å; L444-I447 WeakPolarHBondContact O-CG2 3.37Å
445	E	87.2	Confident	90.6	Very high	114 Å²	114	62.1 Å²	62.1	53%	0.533	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.9	175.1	71.1	-165.1	-166.7	0	0	113	Y419 K422 A443	Y419-E445 WeakPolarHBondContact CE2-O 3.47Å; K422-E445 IonicContact NZ-OE1 3.21Å; K422-E445 PolarHBondContact NZ-OE1 3.15Å; A443-E445 VanDerWaalsContact C-N 3.25Å; A443-E445 HydrophobicContact CB-CG 4.07Å; A443-E445 PolarHBondContact O-N 3.13Å
446	I	93.3	Very high	90.7	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-20.7	-173.9	-52.6	-58.2	0	0	0	112.5	Y419 K422 L426 A443 L444 G448 F449	Y419-I446 HydrophobicContact CD2-CD1 3.61Å; Y419-I446 HydrophobicContact CE2-CD1 3.75Å; Y419-I446 HydrophobicContact CG-CD1 4.48Å; K422-I446 HydrophobicContact CB-CD1 3.71Å; K422-I446 HydrophobicContact CB-CG1 3.96Å; K422-I446 HydrophobicContact CB-CG2 4.36Å; K422-I446 HydrophobicContact CD-CD1 3.84Å; K422-I446 HydrophobicContact CD-CG1 4.09Å; K422-I446 HydrophobicContact CG-CD1 4.49Å; L426-I446 HydrophobicContact CB-CG2 4.18Å; L426-I446 HydrophobicContact CD2-CG2 3.83Å; A443-I446 HydrophobicContact CB-CG1 4.22Å; A443-I446 PolarHBondContact O-N 3.38Å; L444-I446 VanDerWaalsContact C-N 3.3Å; L444-I446 PolarHBondContact O-N 2.79Å; I446-G448 PolarHBondContact O-N 2.93Å; I446-G448 VanDerWaalsContact O-N 3.16Å; I446-F449 HydrophobicContact CG2-CB 4.29Å; I446-F449 WeakPolarHBondContact O-CB 3.45Å; I446-F449 PolarHBondContact O-N 3.05Å
447	I	92.7	Very high	90.8	Very high	18 Å²	18	59.7 Å²	59.7	9%	0.092	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.9	-173.4	-159.7	171.3	0	0	0	113.8	L442 A443 L444 F449 L477 K480 A482	L442-I447 HydrophobicContact CD1-CB 4.05Å; L442-I447 HydrophobicContact CD1-CD1 3.89Å; L442-I447 HydrophobicContact CD1-CG1 3.78Å; A443-I447 PolarHBondContact O-N 2.98Å; L444-I447 WeakPolarHBondContact O-CG2 3.37Å; I447-F449 VanDerWaalsContact C-N 3.34Å; I447-L477 WeakPolarHBondContact CD1-O 3.42Å; I447-K480 VanDerWaalsContact CD1-C 3.42Å; I447-K480 HydrophobicContact CD1-CB 3.56Å; I447-K480 VanDerWaalsContact CD1-O 3.26Å; I447-K480 WeakPolarHBondContact CD1-O 3.33Å; I447-A482 HydrophobicContact CD1-CB 4Å; I447-A482 HydrophobicContact CG1-CB 4.02Å
448	G	90.9	Very high	91	Very high	51 Å²	51	55.4 Å²	55.4	53%	0.526	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	4.3	174.3	0	0	0	0	0	114.6	I446 K450	I446-G448 PolarHBondContact O-N 2.93Å; I446-G448 VanDerWaalsContact O-N 3.16Å; G448-K450 PolarHBondContact O-N 3.48Å
449	F	94.8	Very high	91.1	Very high	8 Å²	8	55.5 Å²	55.5	4%	0.035	29%	0.292	C	S	.	.			trans	-59.1	135.5	179.3	-177.8	-98.7	0	0	0	111.2	Y419 E420 G423 H424 L427 I446 I447	Y419-F449 HydrophobicContact CD1-CD2 4.24Å; Y419-F449 HydrophobicContact CD1-CE2 4.29Å; Y419-F449 AromaticContact CE1-CD2 3.57Å; Y419-F449 HydrophobicContact CE1-CD2 3.57Å; Y419-F449 AromaticContact CE1-CE2 3.95Å; Y419-F449 HydrophobicContact CE1-CE2 3.95Å; Y419-F449 AromaticContact CZ-CD2 3.94Å; E420-F449 HydrophobicContact CB-CE2 4.45Å; E420-F449 HydrophobicContact CG-CE2 4.15Å; G423-F449 VanDerWaalsContact C-CD1 3.45Å; G423-F449 VanDerWaalsContact C-CE1 3.47Å; G423-F449 VanDerWaalsContact CA-CG 3.46Å; H424-F449 AromaticContact CD2-CZ 3.83Å; H424-F449 AromaticContact NE2-CZ 3.73Å; L427-F449 HydrophobicContact CD1-CD1 3.85Å; L427-F449 HydrophobicContact CD1-CE1 3.68Å; L427-F449 HydrophobicContact CD2-CD1 4.37Å; L427-F449 HydrophobicContact CG-CD1 3.96Å; L427-F449 HydrophobicContact CG-CE1 4.19Å; I446-F449 HydrophobicContact CG2-CB 4.29Å; I446-F449 WeakPolarHBondContact O-CB 3.45Å; I446-F449 PolarHBondContact O-N 3.05Å; I447-F449 VanDerWaalsContact C-N 3.34Å
450	K	93.8	Very high	91.4	Very high	79 Å²	79	48.8 Å²	48.8	34%	0.343	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-118.1	133.6	178.1	-67	177.2	-179.9	-174.2	0	108.7	G448 E456 T457 E486	G448-K450 PolarHBondContact O-N 3.48Å; K450-E456 WeakPolarHBondContact CA-O 3.32Å; K450-T457 HydrophobicContact CG-CG2 3.95Å; K450-E486 VanDerWaalsContact CE-OE1 3.24Å; K450-E486 WeakPolarHBondContact CE-OE1 3.43Å; K450-E486 IonicContact NZ-OE1 2.66Å; K450-E486 PolarHBondContact NZ-OE1 2.91Å
451	H	92.4	Very high	91.6	Very high	28 Å²	28	39.8 Å²	39.8	13%	0.13	22%	0.224	C	C	.	.			trans	-59.4	125.1	172.5	-161.9	-73.8	0	0	0	110	H424 L427 Q453 S454 N455 E456	H424-H451 AromaticContact CE1-CD2 3.59Å; H424-H451 AromaticContact CE1-CE1 3.97Å; H424-H451 AromaticContact CE1-NE2 3.51Å; H424-H451 AromaticContact ND1-CD2 3.63Å; H424-H451 AromaticContact ND1-NE2 3.64Å; L427-H451 HydrophobicContact CD1-CB 3.71Å; H451-Q453 PolarHBondContact CE1-OE1 2.81Å; H451-Q453 PolarHBondContact ND1-OE1 3.4Å; H451-Q453 PolarHBondContact O-N 3.33Å; H451-Q453 VanDerWaalsContact O-N 3.07Å; H451-S454 WeakPolarHBondContact CB-OG 3.42Å; H451-S454 PolarHBondContact O-N 2.95Å; H451-N455 VanDerWaalsContact O-CA 3.27Å; H451-N455 WeakPolarHBondContact O-CA 3.36Å; H451-N455 PolarHBondContact O-N 2.98Å; H451-E456 PolarHBondContact N-O 2.88Å
452	P	86.6	Confident	92	Very high	59 Å²	59	38.4 Å²	38.4	38%	0.383	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.4	-170.4	-28.3	35.7	0	0	0	115
453	Q	83.9	Confident	92.4	Very high	67 Å²	67	36.9 Å²	36.9	31%	0.313	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-29.9	-176.5	-57.9	85.3	-12.7	0	0	115.2	S389 H451 K489	S389-Q453 PolarHBondContact OG-NE2 3.3Å; S389-Q453 VanDerWaalsContact OG-NE2 3.11Å; H451-Q453 PolarHBondContact CE1-OE1 2.81Å; H451-Q453 PolarHBondContact ND1-OE1 3.4Å; H451-Q453 PolarHBondContact O-N 3.33Å; H451-Q453 VanDerWaalsContact O-N 3.07Å; Q453-K489 VanDerWaalsContact O-CD 3.29Å; Q453-K489 WeakPolarHBondContact O-CD 3.27Å
454	S	89.5	Confident	92.8	Very high	29 Å²	29	35.6 Å²	35.6	20%	0.203	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-10.6	-177.6	68.8	0	0	0	0	114	H451 E456 K489	H451-S454 WeakPolarHBondContact CB-OG 3.42Å; H451-S454 PolarHBondContact O-N 2.95Å; S454-E456 PolarHBondContact O-N 3.18Å; S454-E456 VanDerWaalsContact O-N 3.09Å; S454-E456 WeakPolarHBondContact OG-CG 3.4Å; S454-E456 PolarHBondContact OG-N 3.32Å; S454-E456 PolarHBondContact OG-OE2 3.49Å; S454-K489 VanDerWaalsContact O-CB 3.29Å; S454-K489 WeakPolarHBondContact O-CB 3.28Å; S454-K489 PolarHBondContact O-N 3.25Å
455	N	93.2	Very high	93.3	Very high	65 Å²	65	28.5 Å²	28.5	35%	0.348	16%	0.16	S	C	.	.			trans	53.5	16.1	-170	-70.4	-24.1	0	0	0	114.9	H451	H451-N455 VanDerWaalsContact O-CA 3.27Å; H451-N455 WeakPolarHBondContact O-CA 3.36Å; H451-N455 PolarHBondContact O-N 2.98Å
456	E	94.2	Very high	93.5	Very high	49 Å²	49	27.6 Å²	27.6	23%	0.229	16%	0.164	C	C	.	.			trans	-68.2	137.5	175.5	-69.8	174.3	113.1	0	0	111.2	K450 H451 S454 H460 N488	K450-E456 WeakPolarHBondContact CA-O 3.32Å; H451-E456 PolarHBondContact N-O 2.88Å; S454-E456 PolarHBondContact O-N 3.18Å; S454-E456 VanDerWaalsContact O-N 3.09Å; S454-E456 WeakPolarHBondContact OG-CG 3.4Å; S454-E456 PolarHBondContact OG-N 3.32Å; S454-E456 PolarHBondContact OG-OE2 3.49Å; E456-H460 HydrophobicContact CB-CB 4.14Å; E456-H460 HydrophobicContact CG-CB 4.29Å; E456-N488 HydrophobicContact CG-CB 4.26Å
457	T	96.3	Very high	93.5	Very high	9 Å²	9	31.7 Å²	31.7	6%	0.055	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-96.8	168.9	170.6	62.7	0	0	0	0	111.2	K450 L459 H460 C461 E486	K450-T457 HydrophobicContact CG-CG2 3.95Å; T457-L459 PolarHBondContact O-N 3.46Å; T457-L459 VanDerWaalsContact O-N 3.09Å; T457-L459 PolarHBondContact OG1-N 3.49Å; T457-H460 PolarHBondContact N-ND1 2.97Å; T457-H460 WeakPolarHBondContact O-CB 3.42Å; T457-H460 PolarHBondContact O-N 2.84Å; T457-H460 PolarHBondContact OG1-ND1 3.23Å; T457-C461 PolarHBondContact O-N 3.39Å; T457-C461 VanDerWaalsContact O-N 3.09Å; T457-E486 HydrophobicContact CG2-CB 4.41Å; T457-E486 HydrophobicContact CG2-CG 3.79Å
458	A	96.1	Very high	93.1	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-31	173.6	0	0	0	0	0	112.4	L426 L427 A430 C461 A462 L477	L426-A458 HydrophobicContact CD2-CB 3.94Å; L426-A458 HydrophobicContact CG-CB 3.84Å; L427-A458 HydrophobicContact CD2-CB 4.2Å; A430-A458 HydrophobicContact CB-CB 4.2Å; A430-A458 VanDerWaalsContact CB-O 3.3Å; A430-A458 WeakPolarHBondContact CB-O 3.34Å; A458-C461 PolarHBondContact O-N 2.88Å; A458-A462 VanDerWaalsContact O-CB 3.31Å; A458-A462 WeakPolarHBondContact O-CB 3.46Å; A458-A462 PolarHBondContact O-N 2.92Å; A458-L477 HydrophobicContact CB-CD1 4.01Å; A458-L477 HydrophobicContact CB-CD2 4.08Å; A458-L477 WeakPolarHBondContact O-CD1 3.42Å
459	L	96.6	Very high	93.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-69	-41	176.2	-172.8	60.7	0	0	0	112.1	T457 A462 V463 T474 L477 L478 A482 P494	T457-L459 PolarHBondContact O-N 3.46Å; T457-L459 VanDerWaalsContact O-N 3.09Å; T457-L459 PolarHBondContact OG1-N 3.49Å; L459-A462 PolarHBondContact O-N 2.87Å; L459-V463 HydrophobicContact CD1-CG2 4.11Å; L459-V463 HydrophobicContact CG-CG2 4.41Å; L459-V463 VanDerWaalsContact O-CB 3.28Å; L459-V463 WeakPolarHBondContact O-CB 3.29Å; L459-V463 WeakPolarHBondContact O-CG2 3.08Å; L459-V463 PolarHBondContact O-N 3.01Å; L459-T474 HydrophobicContact CD1-CG2 3.85Å; L459-L477 HydrophobicContact CD1-CB 4.42Å; L459-L478 HydrophobicContact CD1-CD2 4.24Å; L459-L478 HydrophobicContact CD1-CG 4.14Å; L459-L478 HydrophobicContact CD2-CD2 3.77Å; L459-A482 HydrophobicContact CB-CB 4.35Å; L459-A482 HydrophobicContact CD2-CB 4.29Å; L459-P494 HydrophobicContact CB-CG 4.47Å; L459-P494 HydrophobicContact CD2-CB 4.34Å; L459-P494 HydrophobicContact CD2-CG 3.82Å; L459-P494 HydrophobicContact CG-CB 4.15Å; L459-P494 HydrophobicContact CG-CG 3.88Å
460	H	97.3	Very high	93.2	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-48.3	172.5	-69	85.7	0	0	0	110.8	E456 T457 A462 V463 A464 E486 M492 P494	E456-H460 HydrophobicContact CB-CB 4.14Å; E456-H460 HydrophobicContact CG-CB 4.29Å; T457-H460 PolarHBondContact N-ND1 2.97Å; T457-H460 WeakPolarHBondContact O-CB 3.42Å; T457-H460 PolarHBondContact O-N 2.84Å; T457-H460 PolarHBondContact OG1-ND1 3.23Å; H460-A462 PolarHBondContact O-N 3.11Å; H460-V463 PolarHBondContact O-N 3.4Å; H460-A464 VanDerWaalsContact O-CB 3.24Å; H460-A464 WeakPolarHBondContact O-CB 3.36Å; H460-A464 PolarHBondContact O-N 2.69Å; H460-E486 PolarHBondContact CE1-O 3.47Å; H460-M492 PolarHBondContact NE2-O 3.47Å; H460-P494 WeakPolarHBondContact NE2-CD 3.48Å
461	C	96.3	Very high	93.2	Very high	2 Å²	2	40 Å²	40	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-42.9	178.2	-67.1	0	0	0	0	113.1	A430 R431 T457 A458 S465	A430-C461 HydrophobicContact CB-CB 3.9Å; R431-C461 HydrophobicContact CB-CB 4.22Å; T457-C461 PolarHBondContact O-N 3.39Å; T457-C461 VanDerWaalsContact O-N 3.09Å; A458-C461 PolarHBondContact O-N 2.88Å; C461-S465 PolarHBondContact O-N 3Å; C461-S465 VanDerWaalsContact O-N 3.09Å
462	A	96.4	Very high	93.4	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-44.1	178.1	0	0	0	0	0	112.1	A430 A458 L459 H460 S465 R470 V473 L477	A430-A462 HydrophobicContact CB-CB 4.16Å; A430-A462 WeakPolarHBondContact O-CA 3.42Å; A458-A462 VanDerWaalsContact O-CB 3.31Å; A458-A462 WeakPolarHBondContact O-CB 3.46Å; A458-A462 PolarHBondContact O-N 2.92Å; L459-A462 PolarHBondContact O-N 2.87Å; H460-A462 PolarHBondContact O-N 3.11Å; A462-S465 VanDerWaalsContact O-CB 3.29Å; A462-S465 WeakPolarHBondContact O-CB 3.32Å; A462-S465 PolarHBondContact O-N 3.06Å; A462-R470 WeakPolarHBondContact O-CB 3.29Å; A462-V473 HydrophobicContact CB-CB 4.32Å; A462-V473 HydrophobicContact CB-CG1 3.67Å; A462-L477 HydrophobicContact CB-CD1 3.79Å
463	V	96.3	Very high	93.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.6	-36.5	179.8	167.8	0	0	0	0	111.5	L459 H460 S465 T474 P494 V497 A498 H503 I506 L510	L459-V463 HydrophobicContact CD1-CG2 4.11Å; L459-V463 HydrophobicContact CG-CG2 4.41Å; L459-V463 VanDerWaalsContact O-CB 3.28Å; L459-V463 WeakPolarHBondContact O-CB 3.29Å; L459-V463 WeakPolarHBondContact O-CG2 3.08Å; L459-V463 PolarHBondContact O-N 3.01Å; H460-V463 PolarHBondContact O-N 3.4Å; V463-S465 VanDerWaalsContact C-N 3.32Å; V463-T474 HydrophobicContact CG2-CG2 3.97Å; V463-P494 VanDerWaalsContact CG1-O 3.31Å; V463-P494 WeakPolarHBondContact CG1-O 3.39Å; V463-P494 HydrophobicContact CG2-CB 4.15Å; V463-V497 HydrophobicContact CG1-CB 4.37Å; V463-V497 HydrophobicContact CG1-CG1 4.42Å; V463-A498 HydrophobicContact CG1-CB 3.64Å; V463-H503 PolarHBondContact O-CE1 3.2Å; V463-H503 PolarHBondContact O-ND1 3.31Å; V463-I506 HydrophobicContact CB-CG2 4.24Å; V463-I506 HydrophobicContact CG1-CG2 3.82Å; V463-I506 HydrophobicContact CG2-CG2 3.75Å; V463-L510 HydrophobicContact CG2-CD1 4.46Å
464	A	95.6	Very high	94.4	Very high	12 Å²	12	38 Å²	38	10%	0.099	20%	0.2	C	C	.	.	H	α-helix	trans	-70	-25.4	174.1	0	0	0	0	0	113.5	H460 V497 R501	H460-A464 VanDerWaalsContact O-CB 3.24Å; H460-A464 WeakPolarHBondContact O-CB 3.36Å; H460-A464 PolarHBondContact O-N 2.69Å; A464-V497 HydrophobicContact CB-CG1 3.78Å; A464-R501 PolarHBondContact O-NH1 3.42Å
465	S	95.4	Very high	94.7	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.007	20%	0.202	C	C	.	.			trans	-55.5	131	-169.2	-174.9	0	0	0	0	112.8	R431 C461 A462 V463 H467 R470 H503	R431-S465 VanDerWaalsContact O-CB 3.29Å; R431-S465 WeakPolarHBondContact O-CB 3.18Å; R431-S465 PolarHBondContact O-OG 2.8Å; C461-S465 PolarHBondContact O-N 3Å; C461-S465 VanDerWaalsContact O-N 3.09Å; A462-S465 VanDerWaalsContact O-CB 3.29Å; A462-S465 WeakPolarHBondContact O-CB 3.32Å; A462-S465 PolarHBondContact O-N 3.06Å; V463-S465 VanDerWaalsContact C-N 3.32Å; S465-H467 PolarHBondContact O-N 2.75Å; S465-H467 PolarHBondContact OG-CD2 3.27Å; S465-H467 PolarHBondContact OG-N 3.01Å; S465-R470 WeakPolarHBondContact O-CD 3.45Å; S465-H503 PolarHBondContact O-CE1 2.88Å
466	P	92.7	Very high	94.8	Very high	95 Å²	95	37.6 Å²	37.6	62%	0.617	19%	0.193	S	C	*	.			trans	-71.8	-16.3	176	31.3	-35.8	0	0	0	112.5
467	H	92.3	Very high	94.8	Very high	87 Å²	87	35.3 Å²	35.3	40%	0.403	18%	0.183	S	C	.	.	S	Bend	trans	-76.5	142.8	-171.9	-60.1	-66.6	0	0	0	112.4	E432 A433 S465 K469 R470	E432-H467 VanDerWaalsContact C-CD2 3.48Å; E432-H467 PolarHBondContact O-CD2 3.39Å; E432-H467 VanDerWaalsContact O-CD2 3.23Å; A433-H467 HydrophobicContact CB-CB 3.83Å; S465-H467 PolarHBondContact O-N 2.75Å; S465-H467 PolarHBondContact OG-CD2 3.27Å; S465-H467 PolarHBondContact OG-N 3.01Å; H467-K469 PolarHBondContact O-N 3.01Å; H467-K469 VanDerWaalsContact O-N 3.11Å; H467-R470 WeakPolarHBondContact O-CB 3.41Å; H467-R470 VanDerWaalsContact O-CG 3.27Å; H467-R470 WeakPolarHBondContact O-CG 3.35Å; H467-R470 PolarHBondContact O-N 3.2Å
468	P	84.9	Confident	94.8	Very high	113 Å²	113	35.7 Å²	35.7	73%	0.734	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.2	-173.7	25.7	-35.3	0	0	0	114.2	R470	P468-R470 PolarHBondContact O-N 3.14Å
469	K	92.6	Very high	94.7	Very high	119 Å²	119	44.2 Å²	44.2	52%	0.517	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-4.9	175.8	-68.4	-179.4	-177.4	171.8	0	113.6	A433 H467 K471 Q472 V473	A433-K469 HydrophobicContact CB-CB 3.97Å; H467-K469 PolarHBondContact O-N 3.01Å; H467-K469 VanDerWaalsContact O-N 3.11Å; K469-K471 PolarHBondContact O-N 2.8Å; K469-K471 VanDerWaalsContact O-N 3.1Å; K469-Q472 WeakPolarHBondContact O-CB 3.12Å; K469-Q472 PolarHBondContact O-N 2.9Å; K469-V473 PolarHBondContact O-N 3.3Å
470	R	94.9	Very high	94.5	Very high	43 Å²	43	49.9 Å²	49.9	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-47.2	-39.7	178.6	61.5	171.3	-176.7	-93.2	-1.4	114.2	A462 S465 H467 P468 V473 T474 D505 I506	A462-R470 WeakPolarHBondContact O-CB 3.29Å; S465-R470 WeakPolarHBondContact O-CD 3.45Å; H467-R470 WeakPolarHBondContact O-CB 3.41Å; H467-R470 VanDerWaalsContact O-CG 3.27Å; H467-R470 WeakPolarHBondContact O-CG 3.35Å; H467-R470 PolarHBondContact O-N 3.2Å; P468-R470 PolarHBondContact O-N 3.14Å; R470-V473 PolarHBondContact O-N 3.5Å; R470-T474 VanDerWaalsContact O-CB 3.27Å; R470-T474 WeakPolarHBondContact O-CB 3.49Å; R470-T474 PolarHBondContact O-N 2.85Å; R470-T474 PolarHBondContact O-OG1 2.9Å; R470-D505 IonicContact CZ-OD1 3.68Å; R470-D505 IonicContact CZ-OD2 3.6Å; R470-D505 IonicContact NE-OD1 2.77Å; R470-D505 PolarHBondContact NE-OD1 3.47Å; R470-D505 IonicContact NE-OD2 3.85Å; R470-D505 PolarHBondContact NE-OD2 3.32Å; R470-D505 IonicContact NH2-OD1 3.29Å; R470-D505 PolarHBondContact NH2-OD1 2.9Å; R470-D505 IonicContact NH2-OD2 2.76Å; R470-D505 PolarHBondContact NH2-OD2 2.91Å; R470-I506 HydrophobicContact CG-CD1 4.06Å; R470-I506 HydrophobicContact CG-CG1 4.29Å
471	K	94.9	Very high	94.3	Very high	57 Å²	57	52.5 Å²	52.5	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-42.6	-179.4	-173.7	162.3	-178.8	147.3	0	111.9	K469 T474 E475 D505 I506 E508 V509	K469-K471 PolarHBondContact O-N 2.8Å; K469-K471 VanDerWaalsContact O-N 3.1Å; K471-T474 PolarHBondContact O-N 3.12Å; K471-E475 WeakPolarHBondContact O-CB 3.47Å; K471-E475 WeakPolarHBondContact O-CG 3.18Å; K471-E475 PolarHBondContact O-N 3.47Å; K471-D505 HydrophobicContact CD-CB 4.15Å; K471-D505 WeakPolarHBondContact CD-O 3.33Å; K471-D505 WeakPolarHBondContact CE-O 3.4Å; K471-D505 PolarHBondContact NZ-O 2.86Å; K471-I506 HydrophobicContact CB-CD1 3.93Å; K471-I506 HydrophobicContact CG-CD1 4.39Å; K471-E508 IonicContact NZ-OE2 2.68Å; K471-E508 PolarHBondContact NZ-OE2 2.98Å; K471-E508 VanDerWaalsContact NZ-OE2 3.16Å; K471-V509 HydrophobicContact CD-CG2 4.25Å; K471-V509 HydrophobicContact CG-CG2 4.05Å
472	Q	95.1	Very high	94.2	Very high	112 Å²	112	53 Å²	53	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-66.5	-39.6	177.9	-59.2	175.8	-1.5	0	0	111.8	M435 K469 L476	M435-Q472 HydrophobicContact CE-CB 4.1Å; M435-Q472 HydrophobicContact CG-CB 4.37Å; M435-Q472 HydrophobicContact SD-CB 3.97Å; K469-Q472 WeakPolarHBondContact O-CB 3.12Å; K469-Q472 PolarHBondContact O-N 2.9Å; Q472-L476 WeakPolarHBondContact O-CB 3.44Å; Q472-L476 PolarHBondContact O-N 3.38Å
473	V	96.1	Very high	94.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.5	-45.8	175.8	177.2	0	0	0	0	111	A430 A433 M435 V438 A462 K469 R470 E475 L476 L477	A430-V473 HydrophobicContact CB-CG1 4.46Å; A433-V473 HydrophobicContact CB-CG2 4.15Å; M435-V473 HydrophobicContact CG-CG2 3.86Å; M435-V473 HydrophobicContact SD-CB 4.2Å; M435-V473 HydrophobicContact SD-CG2 3.43Å; M435-V473 WeakPolarHBondContact SD-CG2 3.43Å; V438-V473 HydrophobicContact CG2-CG1 4.06Å; A462-V473 HydrophobicContact CB-CB 4.32Å; A462-V473 HydrophobicContact CB-CG1 3.67Å; K469-V473 PolarHBondContact O-N 3.3Å; R470-V473 PolarHBondContact O-N 3.5Å; V473-E475 PolarHBondContact O-N 2.75Å; V473-L476 PolarHBondContact O-N 3.22Å; V473-L476 VanDerWaalsContact O-N 3.16Å; V473-L477 HydrophobicContact CG1-CD1 3.92Å; V473-L477 HydrophobicContact CG1-CG 4.32Å; V473-L477 WeakPolarHBondContact O-CG 3.44Å; V473-L477 PolarHBondContact O-N 2.9Å
474	T	96.3	Very high	94.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-48.4	178.1	-60.4	0	0	0	0	111.1	L459 V463 R470 K471 L476 L477 L478 I506 V509	L459-T474 HydrophobicContact CD1-CG2 3.85Å; V463-T474 HydrophobicContact CG2-CG2 3.97Å; R470-T474 VanDerWaalsContact O-CB 3.27Å; R470-T474 WeakPolarHBondContact O-CB 3.49Å; R470-T474 PolarHBondContact O-N 2.85Å; R470-T474 PolarHBondContact O-OG1 2.9Å; K471-T474 PolarHBondContact O-N 3.12Å; T474-L476 PolarHBondContact O-N 3.41Å; T474-L477 PolarHBondContact O-N 2.89Å; T474-L478 HydrophobicContact CG2-CD1 4.01Å; T474-L478 WeakPolarHBondContact O-CG 3.12Å; T474-L478 PolarHBondContact O-N 3.29Å; T474-I506 HydrophobicContact CG2-CD1 4.36Å; T474-I506 HydrophobicContact CG2-CG2 4.35Å; T474-V509 HydrophobicContact CG2-CG1 4.18Å
475	E	95.4	Very high	94.1	Very high	54 Å²	54	59 Å²	59	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-41.3	174.1	-76.2	-172.6	-152.3	0	0	112.7	K471 V473 L478 R479 V509	K471-E475 WeakPolarHBondContact O-CB 3.47Å; K471-E475 WeakPolarHBondContact O-CG 3.18Å; K471-E475 PolarHBondContact O-N 3.47Å; V473-E475 PolarHBondContact O-N 2.75Å; E475-L478 PolarHBondContact O-N 2.86Å; E475-R479 VanDerWaalsContact O-CB 3.3Å; E475-R479 WeakPolarHBondContact O-CB 3.24Å; E475-R479 WeakPolarHBondContact O-CD 3.4Å; E475-R479 WeakPolarHBondContact O-CG 3.32Å; E475-R479 PolarHBondContact O-N 2.96Å; E475-R479 IonicContact OE2-CZ 2.72Å; E475-R479 IonicContact OE2-NE 2.8Å; E475-R479 IonicContact OE2-NH2 3.25Å; E475-R479 PolarHBondContact OE2-NH2 3.2Å; E475-V509 HydrophobicContact CG-CG1 3.73Å; E475-V509 HydrophobicContact CG-CG2 4.23Å
476	L	95.1	Very high	94.1	Very high	31 Å²	31	61 Å²	61	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-42.6	178.1	176.7	60.5	0	0	0	111.9	M435 V438 K439 L442 Q472 V473 T474 K480	M435-L476 HydrophobicContact CE-CB 4.5Å; M435-L476 HydrophobicContact CE-CD2 3.95Å; M435-L476 HydrophobicContact SD-CD2 4.17Å; V438-L476 HydrophobicContact CG1-CD2 3.95Å; K439-L476 HydrophobicContact CG-CD2 3.95Å; L442-L476 HydrophobicContact CD2-CD2 4.36Å; L442-L476 HydrophobicContact CD2-CG 4.05Å; Q472-L476 WeakPolarHBondContact O-CB 3.44Å; Q472-L476 PolarHBondContact O-N 3.38Å; V473-L476 PolarHBondContact O-N 3.22Å; V473-L476 VanDerWaalsContact O-N 3.16Å; T474-L476 PolarHBondContact O-N 3.41Å; L476-K480 HydrophobicContact CD1-CG 4.29Å; L476-K480 WeakPolarHBondContact O-CB 3.27Å; L476-K480 VanDerWaalsContact O-CG 3.31Å; L476-K480 WeakPolarHBondContact O-CG 3.47Å; L476-K480 PolarHBondContact O-N 2.9Å; L476-K480 VanDerWaalsContact O-N 3.16Å
477	L	95.4	Very high	94.2	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-46.7	177.7	-69.6	171.9	0	0	0	111.4	L442 I447 A458 L459 A462 V473 T474 K480 G481 A482	L442-L477 HydrophobicContact CD1-CD2 3.88Å; L442-L477 HydrophobicContact CD2-CD2 4.24Å; I447-L477 WeakPolarHBondContact CD1-O 3.42Å; A458-L477 HydrophobicContact CB-CD1 4.01Å; A458-L477 HydrophobicContact CB-CD2 4.08Å; A458-L477 WeakPolarHBondContact O-CD1 3.42Å; L459-L477 HydrophobicContact CD1-CB 4.42Å; A462-L477 HydrophobicContact CB-CD1 3.79Å; V473-L477 HydrophobicContact CG1-CD1 3.92Å; V473-L477 HydrophobicContact CG1-CG 4.32Å; V473-L477 WeakPolarHBondContact O-CG 3.44Å; V473-L477 PolarHBondContact O-N 2.9Å; T474-L477 PolarHBondContact O-N 2.89Å; L477-K480 CarbonylContact O-C 3.54Å; L477-K480 PolarHBondContact O-N 3.14Å; L477-K480 VanDerWaalsContact O-N 3.12Å; L477-G481 PolarHBondContact O-N 3.42Å; L477-A482 HydrophobicContact CB-CB 4Å; L477-A482 VanDerWaalsContact O-CB 3.3Å; L477-A482 WeakPolarHBondContact O-CB 3.43Å; L477-A482 PolarHBondContact O-N 2.95Å
478	L	95.3	Very high	94.3	Very high	17 Å²	17	56 Å²	56	9%	0.089	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-46.4	177.1	-69.7	169.7	0	0	0	111.7	L459 T474 E475 K480 G481 I484 V509 L510 H513	L459-L478 HydrophobicContact CD1-CD2 4.24Å; L459-L478 HydrophobicContact CD1-CG 4.14Å; L459-L478 HydrophobicContact CD2-CD2 3.77Å; T474-L478 HydrophobicContact CG2-CD1 4.01Å; T474-L478 WeakPolarHBondContact O-CG 3.12Å; T474-L478 PolarHBondContact O-N 3.29Å; E475-L478 PolarHBondContact O-N 2.86Å; L478-K480 PolarHBondContact O-N 1.99Å; L478-K480 VanDerWaalsContact O-N 3.13Å; L478-G481 PolarHBondContact O-N 3.37Å; L478-I484 HydrophobicContact CD1-CD1 4.49Å; L478-I484 HydrophobicContact CD2-CB 3.85Å; L478-I484 HydrophobicContact CD2-CD1 3.94Å; L478-I484 HydrophobicContact CD2-CG1 3.97Å; L478-V509 HydrophobicContact CD1-CG1 3.82Å; L478-L510 HydrophobicContact CD1-CD2 4.31Å; L478-H513 HydrophobicContact CD1-CB 4.18Å
479	R	93.6	Very high	94.7	Very high	182 Å²	182	56.8 Å²	56.8	69%	0.687	27%	0.271	S	S	*	.	H	α-helix	trans	-61	-20.4	175.1	-70.5	172.2	-162.8	-153.5	11.4	113.7	E475	E475-R479 VanDerWaalsContact O-CB 3.3Å; E475-R479 WeakPolarHBondContact O-CB 3.24Å; E475-R479 WeakPolarHBondContact O-CD 3.4Å; E475-R479 WeakPolarHBondContact O-CG 3.32Å; E475-R479 PolarHBondContact O-N 2.96Å; E475-R479 IonicContact OE2-CZ 2.72Å; E475-R479 IonicContact OE2-NE 2.8Å; E475-R479 IonicContact OE2-NH2 3.25Å; E475-R479 PolarHBondContact OE2-NH2 3.2Å
480	K	93.1	Very high	94.7	Very high	121 Å²	121	54.7 Å²	54.7	53%	0.526	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	2.6	177.4	-73.3	-71.5	-171.4	177.6	0	113.7	L442 I447 L476 L477 L478	L442-K480 HydrophobicContact CD2-CB 4.17Å; L442-K480 HydrophobicContact CD2-CG 3.89Å; I447-K480 VanDerWaalsContact CD1-C 3.42Å; I447-K480 HydrophobicContact CD1-CB 3.56Å; I447-K480 VanDerWaalsContact CD1-O 3.26Å; I447-K480 WeakPolarHBondContact CD1-O 3.33Å; L476-K480 HydrophobicContact CD1-CG 4.29Å; L476-K480 WeakPolarHBondContact O-CB 3.27Å; L476-K480 VanDerWaalsContact O-CG 3.31Å; L476-K480 WeakPolarHBondContact O-CG 3.47Å; L476-K480 PolarHBondContact O-N 2.9Å; L476-K480 VanDerWaalsContact O-N 3.16Å; L477-K480 CarbonylContact O-C 3.54Å; L477-K480 PolarHBondContact O-N 3.14Å; L477-K480 VanDerWaalsContact O-N 3.12Å; L478-K480 PolarHBondContact O-N 1.99Å; L478-K480 VanDerWaalsContact O-N 3.13Å
481	G	91.7	Very high	94.6	Very high	57 Å²	57	58 Å²	58	59%	0.588	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	19.1	173.1	0	0	0	0	0	115.6	L477 L478 N483	L477-G481 PolarHBondContact O-N 3.42Å; L478-G481 PolarHBondContact O-N 3.37Å; G481-N483 PolarHBondContact O-N 3.44Å
482	A	94.9	Very high	94.7	Very high	11 Å²	11	56.1 Å²	56.1	9%	0.091	27%	0.274	C	S	.	.			trans	-62.9	129.1	173.8	0	0	0	0	0	110.9	I447 L459 L477 I484	I447-A482 HydrophobicContact CD1-CB 4Å; I447-A482 HydrophobicContact CG1-CB 4.02Å; L459-A482 HydrophobicContact CB-CB 4.35Å; L459-A482 HydrophobicContact CD2-CB 4.29Å; L477-A482 HydrophobicContact CB-CB 4Å; L477-A482 VanDerWaalsContact O-CB 3.3Å; L477-A482 WeakPolarHBondContact O-CB 3.43Å; L477-A482 PolarHBondContact O-N 2.95Å; A482-I484 PolarHBondContact O-N 3.01Å; A482-I484 VanDerWaalsContact O-N 3.11Å
483	N	94.2	Very high	94.7	Very high	82 Å²	82	50.9 Å²	50.9	44%	0.439	25%	0.249	S	C	.	.			trans	-67.1	112.1	179.7	179.1	9.8	0	0	0	111	G481 N485 E486	G481-N483 PolarHBondContact O-N 3.44Å; N483-N485 VanDerWaalsContact C-N 3.28Å; N483-N485 PolarHBondContact O-N 3.39Å; N483-N485 PolarHBondContact OD1-N 2.83Å; N483-E486 HydrophobicContact CB-CB 4.06Å; N483-E486 PolarHBondContact ND2-OE2 2.65Å; N483-E486 WeakPolarHBondContact O-CB 3.28Å; N483-E486 PolarHBondContact O-N 3.12Å
484	I	95.8	Very high	94.8	Very high	17 Å²	17	50.9 Å²	50.9	9%	0.087	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.7	-177	-166.8	165.8	0	0	0	114.5	L478 A482 P494 L510 H513 A515	L478-I484 HydrophobicContact CD1-CD1 4.49Å; L478-I484 HydrophobicContact CD2-CB 3.85Å; L478-I484 HydrophobicContact CD2-CD1 3.94Å; L478-I484 HydrophobicContact CD2-CG1 3.97Å; A482-I484 PolarHBondContact O-N 3.01Å; A482-I484 VanDerWaalsContact O-N 3.11Å; I484-P494 WeakPolarHBondContact O-CD 3.33Å; I484-L510 HydrophobicContact CD1-CB 4.28Å; I484-L510 HydrophobicContact CD1-CD2 3.9Å; I484-L510 WeakPolarHBondContact CD1-O 3.06Å; I484-L510 HydrophobicContact CG1-CD2 3.79Å; I484-H513 HydrophobicContact CD1-CB 3.58Å; I484-A515 HydrophobicContact CD1-CB 3.94Å; I484-A515 HydrophobicContact CG1-CB 4.1Å
485	N	95.4	Very high	94.9	Very high	39 Å²	39	50.9 Å²	50.9	21%	0.209	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	15.1	-178.9	-66.6	-58.4	0	0	0	112.1	N483 G514 K516	N483-N485 VanDerWaalsContact C-N 3.28Å; N483-N485 PolarHBondContact O-N 3.39Å; N483-N485 PolarHBondContact OD1-N 2.83Å; N485-G514 PolarHBondContact ND2-O 3.04Å; N485-K516 HydrophobicContact CB-CD 4.49Å; N485-K516 WeakPolarHBondContact OD1-CB 3.21Å; N485-K516 PolarHBondContact OD1-N 2.97Å
486	E	95.8	Very high	95	Very high	45 Å²	45	48.3 Å²	48.3	21%	0.21	24%	0.237	C	C	.	.			trans	-60.8	148.5	173.1	-161.6	57.5	-122.7	0	0	110.3	K450 T457 H460 N483 T493 P494	K450-E486 VanDerWaalsContact CE-OE1 3.24Å; K450-E486 WeakPolarHBondContact CE-OE1 3.43Å; K450-E486 IonicContact NZ-OE1 2.66Å; K450-E486 PolarHBondContact NZ-OE1 2.91Å; T457-E486 HydrophobicContact CG2-CB 4.41Å; T457-E486 HydrophobicContact CG2-CG 3.79Å; H460-E486 PolarHBondContact CE1-O 3.47Å; N483-E486 HydrophobicContact CB-CB 4.06Å; N483-E486 PolarHBondContact ND2-OE2 2.65Å; N483-E486 WeakPolarHBondContact O-CB 3.28Å; N483-E486 PolarHBondContact O-N 3.12Å; E486-T493 WeakPolarHBondContact O-CA 3.38Å; E486-P494 WeakPolarHBondContact O-CD 3.14Å
487	K	94.6	Very high	95	Very high	67 Å²	67	47.4 Å²	47.4	29%	0.291	23%	0.233	S	C	.	.			trans	-116.1	133.4	-176.3	-74.5	-170.9	167.4	-151.5	0	111.6	F491 M492 T493 A520	K487-F491 HydrophobicContact CD-CB 4.05Å; K487-F491 HydrophobicContact CD-CD1 3.79Å; K487-F491 HydrophobicContact CD-CG 4.29Å; K487-F491 VanDerWaalsContact CD-O 3.28Å; K487-F491 WeakPolarHBondContact CD-O 3.11Å; K487-F491 VanDerWaalsContact CE-O 3.3Å; K487-F491 WeakPolarHBondContact CE-O 3.44Å; K487-F491 WeakPolarHBondContact CG-O 3.41Å; K487-F491 PolarHBondContact NZ-O 2.91Å; K487-M492 WeakPolarHBondContact CA-O 3.32Å; K487-T493 HydrophobicContact CG-CG2 3.96Å; K487-A520 PolarHBondContact NZ-O 3.34Å
488	N	94.6	Very high	95.1	Very high	10 Å²	10	47.4 Å²	47.4	5%	0.053	23%	0.233	C	C	.	.			trans	-75.7	-174.1	170	81.2	-12	0	0	0	111.3	E456 D490 F491 M492	E456-N488 HydrophobicContact CG-CB 4.26Å; N488-D490 PolarHBondContact O-N 2.86Å; N488-D490 WeakPolarHBondContact OD1-CA 3.47Å; N488-D490 PolarHBondContact OD1-N 3Å; N488-F491 WeakPolarHBondContact O-CA 3.49Å; N488-F491 PolarHBondContact O-N 3.31Å; N488-F491 PolarHBondContact OD1-N 2.9Å; N488-M492 PolarHBondContact N-O 2.9Å; N488-M492 WeakPolarHBondContact OD1-CB 3.45Å; N488-M492 PolarHBondContact OD1-N 3.32Å; N488-M492 PolarHBondContact OD1-O 3.32Å
489	K	93.7	Very high	95.1	Very high	129 Å²	129	46.6 Å²	46.6	56%	0.561	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-33	-179.8	-179.8	173.3	176.3	-178.3	0	113.4	Q453 S454 F491	Q453-K489 VanDerWaalsContact O-CD 3.29Å; Q453-K489 WeakPolarHBondContact O-CD 3.27Å; S454-K489 VanDerWaalsContact O-CB 3.29Å; S454-K489 WeakPolarHBondContact O-CB 3.28Å; S454-K489 PolarHBondContact O-N 3.25Å; K489-F491 PolarHBondContact O-N 2.61Å
490	D	92.1	Very high	95.2	Very high	74 Å²	74	41 Å²	41	40%	0.396	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	13.5	177.9	-47.6	-56.7	0	0	0	112.5	N488 M492 T522	N488-D490 PolarHBondContact O-N 2.86Å; N488-D490 WeakPolarHBondContact OD1-CA 3.47Å; N488-D490 PolarHBondContact OD1-N 3Å; D490-M492 HydrophobicContact CB-CE 4.17Å; D490-M492 HydrophobicContact CB-CG 4.19Å; D490-M492 PolarHBondContact O-N 2.57Å; D490-T522 VanDerWaalsContact C-CG2 3.48Å; D490-T522 WeakPolarHBondContact O-CG2 3.23Å; D490-T522 PolarHBondContact O-N 2.99Å; D490-T522 PolarHBondContact O-OG1 3.29Å
491	F	93.4	Very high	95.3	Very high	112 Å²	112	41.4 Å²	41.4	49%	0.491	21%	0.209	S	C	.	.			trans	58.4	12	-176.1	-75.5	-113.2	0	0	0	114.7	K487 N488 K489 T522	K487-F491 HydrophobicContact CD-CB 4.05Å; K487-F491 HydrophobicContact CD-CD1 3.79Å; K487-F491 HydrophobicContact CD-CG 4.29Å; K487-F491 VanDerWaalsContact CD-O 3.28Å; K487-F491 WeakPolarHBondContact CD-O 3.11Å; K487-F491 VanDerWaalsContact CE-O 3.3Å; K487-F491 WeakPolarHBondContact CE-O 3.44Å; K487-F491 WeakPolarHBondContact CG-O 3.41Å; K487-F491 PolarHBondContact NZ-O 2.91Å; N488-F491 WeakPolarHBondContact O-CA 3.49Å; N488-F491 PolarHBondContact O-N 3.31Å; N488-F491 PolarHBondContact OD1-N 2.9Å; K489-F491 PolarHBondContact O-N 2.61Å; F491-T522 HydrophobicContact CB-CG2 4.08Å; F491-T522 HydrophobicContact CD2-CG2 3.62Å; F491-T522 HydrophobicContact CE2-CG2 4.49Å; F491-T522 HydrophobicContact CG-CG2 4.19Å
492	M	96.1	Very high	95.5	Very high	19 Å²	19	40.3 Å²	40.3	9%	0.094	19%	0.194	C	C	.	.			trans	-71.1	137.9	173.8	-65.2	-165.8	-67.6	0	0	109.9	H460 K487 N488 D490 H496 D521	H460-M492 PolarHBondContact NE2-O 3.47Å; K487-M492 WeakPolarHBondContact CA-O 3.32Å; N488-M492 PolarHBondContact N-O 2.9Å; N488-M492 WeakPolarHBondContact OD1-CB 3.45Å; N488-M492 PolarHBondContact OD1-N 3.32Å; N488-M492 PolarHBondContact OD1-O 3.32Å; D490-M492 HydrophobicContact CB-CE 4.17Å; D490-M492 HydrophobicContact CB-CG 4.19Å; D490-M492 PolarHBondContact O-N 2.57Å; M492-H496 HydrophobicContact CB-CB 3.95Å; M492-H496 HydrophobicContact CG-CB 4.2Å; M492-H496 HydrophobicContact SD-CB 4.39Å; M492-D521 HydrophobicContact CG-CB 3.96Å
493	T	97.1	Very high	95.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	19%	0.194	C	C	.	.			trans	-90.7	165.8	168.1	66.9	0	0	0	0	110.1	E486 K487 L495 H496 V497 A519	E486-T493 WeakPolarHBondContact O-CA 3.38Å; K487-T493 HydrophobicContact CG-CG2 3.96Å; T493-L495 PolarHBondContact O-N 3.15Å; T493-L495 PolarHBondContact OG1-N 3.09Å; T493-H496 PolarHBondContact N-ND1 3.13Å; T493-H496 WeakPolarHBondContact O-CB 3.31Å; T493-H496 PolarHBondContact O-N 3.27Å; T493-H496 PolarHBondContact OG1-ND1 3.32Å; T493-V497 PolarHBondContact O-N 3.22Å; T493-A519 HydrophobicContact CG2-CB 4.16Å
494	P	97.1	Very high	95.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-51.8	-30.2	171.9	-27.6	34.7	0	0	0	113.7	L459 H460 V463 I484 E486 V497 A498 L510	L459-P494 HydrophobicContact CB-CG 4.47Å; L459-P494 HydrophobicContact CD2-CB 4.34Å; L459-P494 HydrophobicContact CD2-CG 3.82Å; L459-P494 HydrophobicContact CG-CB 4.15Å; L459-P494 HydrophobicContact CG-CG 3.88Å; H460-P494 WeakPolarHBondContact NE2-CD 3.48Å; V463-P494 VanDerWaalsContact CG1-O 3.31Å; V463-P494 WeakPolarHBondContact CG1-O 3.39Å; V463-P494 HydrophobicContact CG2-CB 4.15Å; I484-P494 WeakPolarHBondContact O-CD 3.33Å; E486-P494 WeakPolarHBondContact O-CD 3.14Å; P494-V497 PolarHBondContact O-N 3.18Å; P494-A498 WeakPolarHBondContact O-CB 3.43Å; P494-A498 PolarHBondContact O-N 3.38Å; P494-L510 HydrophobicContact CB-CD1 4.3Å; P494-L510 HydrophobicContact CB-CD2 4.27Å
495	L	97.4	Very high	95.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-36.1	176.1	-163.1	73.2	0	0	0	113.1	T493 A499 L507 L510 A515 V517 A527 L543	T493-L495 PolarHBondContact O-N 3.15Å; T493-L495 PolarHBondContact OG1-N 3.09Å; L495-A499 VanDerWaalsContact O-CB 3.27Å; L495-A499 WeakPolarHBondContact O-CB 3.18Å; L495-A499 PolarHBondContact O-N 3.09Å; L495-L507 HydrophobicContact CD1-CD2 3.73Å; L495-L507 HydrophobicContact CD1-CG 4.48Å; L495-L507 HydrophobicContact CG-CD2 4.3Å; L495-L510 HydrophobicContact CB-CD1 4.4Å; L495-L510 HydrophobicContact CD1-CB 3.83Å; L495-L510 HydrophobicContact CD1-CD1 3.93Å; L495-A515 HydrophobicContact CB-CB 4.44Å; L495-A515 HydrophobicContact CD1-CB 4.04Å; L495-A515 HydrophobicContact CD2-CB 4.16Å; L495-A515 HydrophobicContact CG-CB 4.46Å; L495-V517 HydrophobicContact CD2-CB 4.44Å; L495-V517 HydrophobicContact CD2-CG2 4.45Å; L495-A527 HydrophobicContact CD2-CB 4.15Å; L495-A527 HydrophobicContact CG-CB 4.13Å; L495-L543 HydrophobicContact CD2-CD2 4.42Å
496	H	97.6	Very high	95.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-45.8	174.6	-66.8	73.2	0	0	0	110.5	M492 T493 A498 A499 E500 A519 Q525 A527	M492-H496 HydrophobicContact CB-CB 3.95Å; M492-H496 HydrophobicContact CG-CB 4.2Å; M492-H496 HydrophobicContact SD-CB 4.39Å; T493-H496 PolarHBondContact N-ND1 3.13Å; T493-H496 WeakPolarHBondContact O-CB 3.31Å; T493-H496 PolarHBondContact O-N 3.27Å; T493-H496 PolarHBondContact OG1-ND1 3.32Å; H496-A498 VanDerWaalsContact C-N 3.33Å; H496-A498 PolarHBondContact O-N 2.84Å; H496-A499 PolarHBondContact O-N 3.14Å; H496-A499 VanDerWaalsContact O-N 3.14Å; H496-E500 WeakPolarHBondContact O-CB 3.37Å; H496-E500 PolarHBondContact O-N 3.02Å; H496-A519 PolarHBondContact CE1-O 3.34Å; H496-A519 PolarHBondContact NE2-O 2.99Å; H496-A519 VanDerWaalsContact NE2-O 3.09Å; H496-Q525 PolarHBondContact NE2-O 3.07Å; H496-A527 PolarHBondContact NE2-N 3.44Å
497	V	96.3	Very high	95.3	Very high	11 Å²	11	36.1 Å²	36.1	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-37.9	179.7	-177.7	0	0	0	0	111.6	V463 A464 T493 P494 R501	V463-V497 HydrophobicContact CG1-CB 4.37Å; V463-V497 HydrophobicContact CG1-CG1 4.42Å; A464-V497 HydrophobicContact CB-CG1 3.78Å; T493-V497 PolarHBondContact O-N 3.22Å; P494-V497 PolarHBondContact O-N 3.18Å; V497-R501 PolarHBondContact O-N 3.18Å
498	A	96.6	Very high	95.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.4	-41	172.6	0	0	0	0	0	112.3	V463 P494 H496 A502 H503 I506 L507 L510	V463-A498 HydrophobicContact CG1-CB 3.64Å; P494-A498 WeakPolarHBondContact O-CB 3.43Å; P494-A498 PolarHBondContact O-N 3.38Å; H496-A498 VanDerWaalsContact C-N 3.33Å; H496-A498 PolarHBondContact O-N 2.84Å; A498-A502 PolarHBondContact O-N 2.92Å; A498-H503 HydrophobicContact CB-CB 4.47Å; A498-H503 PolarHBondContact O-N 3.33Å; A498-I506 HydrophobicContact CB-CB 4.47Å; A498-I506 HydrophobicContact CB-CG2 4.05Å; A498-L507 HydrophobicContact CB-CD1 4.37Å; A498-L507 HydrophobicContact CB-CG 4Å; A498-L510 HydrophobicContact CB-CD1 4.01Å
499	A	96.6	Very high	95.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.3	-44.2	-177.8	0	0	0	0	0	112.8	L495 H496 R501 A502 L507 A527 A531 H536 T539 L543	L495-A499 VanDerWaalsContact O-CB 3.27Å; L495-A499 WeakPolarHBondContact O-CB 3.18Å; L495-A499 PolarHBondContact O-N 3.09Å; H496-A499 PolarHBondContact O-N 3.14Å; H496-A499 VanDerWaalsContact O-N 3.14Å; A499-R501 VanDerWaalsContact C-N 3.26Å; A499-R501 PolarHBondContact O-N 3.07Å; A499-A502 PolarHBondContact O-N 3.27Å; A499-L507 HydrophobicContact CB-CD2 4.48Å; A499-A527 HydrophobicContact CB-CB 3.99Å; A499-A527 WeakPolarHBondContact CB-O 3.32Å; A499-A531 HydrophobicContact CB-CB 4.29Å; A499-H536 PolarHBondContact O-CD2 3.34Å; A499-H536 VanDerWaalsContact O-CD2 3.3Å; A499-T539 HydrophobicContact CB-CG2 4.16Å; A499-L543 HydrophobicContact CB-CD1 4.1Å
500	E	95.7	Very high	95.4	Very high	65 Å²	65	31.4 Å²	31.4	30%	0.304	15%	0.152	S	C	.	.	H	α-helix	trans	-61.9	-32.3	177.2	-170.8	174	-108.6	0	0	112.5	H496 R530 H536	H496-E500 WeakPolarHBondContact O-CB 3.37Å; H496-E500 PolarHBondContact O-N 3.02Å; E500-R530 HydrophobicContact CB-CB 4.37Å; E500-R530 IonicContact OE1-CZ 3.61Å; E500-R530 IonicContact OE1-NH1 3.59Å; E500-R530 PolarHBondContact OE1-NH1 3.01Å; E500-H536 PolarHBondContact O-CD2 3.18Å; E500-H536 PolarHBondContact O-NE2 2.92Å
501	R	94.5	Very high	95.4	Very high	130 Å²	130	30.7 Å²	30.7	49%	0.491	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	8.1	179.9	-62.2	-173.6	179.1	-147.2	-9.8	114.8	A464 V497 A499 H503	A464-R501 PolarHBondContact O-NH1 3.42Å; V497-R501 PolarHBondContact O-N 3.18Å; A499-R501 VanDerWaalsContact C-N 3.26Å; A499-R501 PolarHBondContact O-N 3.07Å; R501-H503 PolarHBondContact O-CD2 3.22Å; R501-H503 PolarHBondContact O-N 3.43Å; R501-H503 VanDerWaalsContact O-N 3.16Å
502	A	95.3	Very high	95.4	Very high	33 Å²	33	34 Å²	34	27%	0.273	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	29	-175.5	0	0	0	0	0	115.2	A498 A499 N504 H536	A498-A502 PolarHBondContact O-N 2.92Å; A499-A502 PolarHBondContact O-N 3.27Å; A502-N504 PolarHBondContact O-N 3.26Å; A502-N504 PolarHBondContact O-ND2 3.06Å; A502-H536 HydrophobicContact CB-CB 4.33Å
503	H	95.4	Very high	95.3	Very high	23 Å²	23	36.8 Å²	36.8	11%	0.106	17%	0.173	C	C	.	.			trans	-77.5	64.9	-179.4	-70.5	-179.7	0	0	0	111.2	V463 S465 A498 R501 D505 I506 L507	V463-H503 PolarHBondContact O-CE1 3.2Å; V463-H503 PolarHBondContact O-ND1 3.31Å; S465-H503 PolarHBondContact O-CE1 2.88Å; A498-H503 HydrophobicContact CB-CB 4.47Å; A498-H503 PolarHBondContact O-N 3.33Å; R501-H503 PolarHBondContact O-CD2 3.22Å; R501-H503 PolarHBondContact O-N 3.43Å; R501-H503 VanDerWaalsContact O-N 3.16Å; H503-D505 PolarHBondContact O-N 3.04Å; H503-I506 HydrophobicContact CB-CB 4.1Å; H503-I506 HydrophobicContact CB-CG1 4.08Å; H503-I506 WeakPolarHBondContact O-CA 3.28Å; H503-I506 VanDerWaalsContact O-CB 3.32Å; H503-I506 WeakPolarHBondContact O-CB 3.36Å; H503-I506 PolarHBondContact O-N 3.48Å; H503-L507 PolarHBondContact O-N 2.91Å; H503-L507 VanDerWaalsContact O-N 3.07Å
504	N	94.4	Very high	95	Very high	43 Å²	43	39 Å²	39	23%	0.23	20%	0.196	C	C	.	.	H	α-helix	trans	-56.7	-35.4	-174.6	-65.6	-54.7	0	0	0	113.1	A502 I506 L507 E508 T539 L542	A502-N504 PolarHBondContact O-N 3.26Å; A502-N504 PolarHBondContact O-ND2 3.06Å; N504-I506 PolarHBondContact O-N 2.91Å; N504-L507 PolarHBondContact O-N 3.32Å; N504-E508 PolarHBondContact O-N 3Å; N504-T539 PolarHBondContact ND2-OG1 2.86Å; N504-T539 WeakPolarHBondContact OD1-CA 3.4Å; N504-T539 WeakPolarHBondContact OD1-CB 3.38Å; N504-T539 PolarHBondContact OD1-OG1 3.36Å; N504-L542 HydrophobicContact CB-CD2 4.2Å
505	D	91.8	Very high	95	Very high	41 Å²	41	39.4 Å²	39.4	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-22.1	176.3	69.5	-60.1	0	0	0	113.6	R470 K471 H503	R470-D505 IonicContact CZ-OD1 3.68Å; R470-D505 IonicContact CZ-OD2 3.6Å; R470-D505 IonicContact NE-OD1 2.77Å; R470-D505 PolarHBondContact NE-OD1 3.47Å; R470-D505 IonicContact NE-OD2 3.85Å; R470-D505 PolarHBondContact NE-OD2 3.32Å; R470-D505 IonicContact NH2-OD1 3.29Å; R470-D505 PolarHBondContact NH2-OD1 2.9Å; R470-D505 IonicContact NH2-OD2 2.76Å; R470-D505 PolarHBondContact NH2-OD2 2.91Å; K471-D505 HydrophobicContact CD-CB 4.15Å; K471-D505 WeakPolarHBondContact CD-O 3.33Å; K471-D505 WeakPolarHBondContact CE-O 3.4Å; K471-D505 PolarHBondContact NZ-O 2.86Å; H503-D505 PolarHBondContact O-N 3.04Å
506	I	96	Very high	94.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-91.7	-38	175.3	-62.4	-60	0	0	0	111.4	V463 R470 K471 T474 A498 H503 N504 E508 V509 L510	V463-I506 HydrophobicContact CB-CG2 4.24Å; V463-I506 HydrophobicContact CG1-CG2 3.82Å; V463-I506 HydrophobicContact CG2-CG2 3.75Å; R470-I506 HydrophobicContact CG-CD1 4.06Å; R470-I506 HydrophobicContact CG-CG1 4.29Å; K471-I506 HydrophobicContact CB-CD1 3.93Å; K471-I506 HydrophobicContact CG-CD1 4.39Å; T474-I506 HydrophobicContact CG2-CD1 4.36Å; T474-I506 HydrophobicContact CG2-CG2 4.35Å; A498-I506 HydrophobicContact CB-CB 4.47Å; A498-I506 HydrophobicContact CB-CG2 4.05Å; H503-I506 HydrophobicContact CB-CB 4.1Å; H503-I506 HydrophobicContact CB-CG1 4.08Å; H503-I506 WeakPolarHBondContact O-CA 3.28Å; H503-I506 VanDerWaalsContact O-CB 3.32Å; H503-I506 WeakPolarHBondContact O-CB 3.36Å; H503-I506 PolarHBondContact O-N 3.48Å; N504-I506 PolarHBondContact O-N 2.91Å; I506-E508 VanDerWaalsContact C-N 3.27Å; I506-E508 PolarHBondContact O-N 3.21Å; I506-V509 PolarHBondContact O-N 2.72Å; I506-L510 HydrophobicContact CG2-CD1 3.75Å; I506-L510 HydrophobicContact CG2-CG 3.97Å; I506-L510 WeakPolarHBondContact O-CG 3.42Å; I506-L510 PolarHBondContact O-N 2.93Å
507	L	95.1	Very high	94.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-54.4	-43.1	174.2	-82.3	135.8	0	0	0	111.8	L495 A498 A499 H503 N504 V509 L510 Q511 T539 L542 L543 Y546	L495-L507 HydrophobicContact CD1-CD2 3.73Å; L495-L507 HydrophobicContact CD1-CG 4.48Å; L495-L507 HydrophobicContact CG-CD2 4.3Å; A498-L507 HydrophobicContact CB-CD1 4.37Å; A498-L507 HydrophobicContact CB-CG 4Å; A499-L507 HydrophobicContact CB-CD2 4.48Å; H503-L507 PolarHBondContact O-N 2.91Å; H503-L507 VanDerWaalsContact O-N 3.07Å; N504-L507 PolarHBondContact O-N 3.32Å; L507-V509 PolarHBondContact O-N 2.81Å; L507-L510 PolarHBondContact O-N 2.88Å; L507-Q511 WeakPolarHBondContact O-CB 3.3Å; L507-Q511 PolarHBondContact O-N 3.46Å; L507-T539 HydrophobicContact CD1-CG2 3.64Å; L507-L542 HydrophobicContact CB-CD2 3.83Å; L507-L543 HydrophobicContact CD2-CD2 3.59Å; L507-L543 HydrophobicContact CD2-CG 4.02Å; L507-Y546 HydrophobicContact CB-CE2 4.37Å
508	E	92.4	Very high	94.6	Very high	98 Å²	98	49.2 Å²	49.2	46%	0.458	25%	0.245	S	C	.	.	H	α-helix	trans	-55.9	-47	171.7	-69.5	171.4	177	0	0	113.1	K471 N504 I506 K512 Y546	K471-E508 IonicContact NZ-OE2 2.68Å; K471-E508 PolarHBondContact NZ-OE2 2.98Å; K471-E508 VanDerWaalsContact NZ-OE2 3.16Å; N504-E508 PolarHBondContact O-N 3Å; I506-E508 VanDerWaalsContact C-N 3.27Å; I506-E508 PolarHBondContact O-N 3.21Å; E508-K512 WeakPolarHBondContact O-CB 3.36Å; E508-K512 PolarHBondContact O-N 3Å; E508-Y546 WeakPolarHBondContact CA-OH 3.48Å; E508-Y546 WeakPolarHBondContact CG-OH 3.49Å
509	V	95.3	Very high	94.4	Very high	8 Å²	8	50 Å²	50	5%	0.048	25%	0.252	C	S	.	.	H	α-helix	trans	-67.4	-41.9	-178.6	172.7	0	0	0	0	110.4	K471 T474 E475 L478 I506 L507 K512 H513	K471-V509 HydrophobicContact CD-CG2 4.25Å; K471-V509 HydrophobicContact CG-CG2 4.05Å; T474-V509 HydrophobicContact CG2-CG1 4.18Å; E475-V509 HydrophobicContact CG-CG1 3.73Å; E475-V509 HydrophobicContact CG-CG2 4.23Å; L478-V509 HydrophobicContact CD1-CG1 3.82Å; I506-V509 PolarHBondContact O-N 2.72Å; L507-V509 PolarHBondContact O-N 2.81Å; V509-K512 PolarHBondContact O-N 3.03Å; V509-H513 PolarHBondContact O-N 2.93Å; V509-H513 PolarHBondContact O-ND1 3.09Å
510	L	96.1	Very high	94.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-44.6	178.6	-68.8	174.1	0	0	0	111	V463 L478 I484 P494 L495 A498 I506 L507 K512 H513 G514 A515	V463-L510 HydrophobicContact CG2-CD1 4.46Å; L478-L510 HydrophobicContact CD1-CD2 4.31Å; I484-L510 HydrophobicContact CD1-CB 4.28Å; I484-L510 HydrophobicContact CD1-CD2 3.9Å; I484-L510 WeakPolarHBondContact CD1-O 3.06Å; I484-L510 HydrophobicContact CG1-CD2 3.79Å; P494-L510 HydrophobicContact CB-CD1 4.3Å; P494-L510 HydrophobicContact CB-CD2 4.27Å; L495-L510 HydrophobicContact CB-CD1 4.4Å; L495-L510 HydrophobicContact CD1-CB 3.83Å; L495-L510 HydrophobicContact CD1-CD1 3.93Å; A498-L510 HydrophobicContact CB-CD1 4.01Å; I506-L510 HydrophobicContact CG2-CD1 3.75Å; I506-L510 HydrophobicContact CG2-CG 3.97Å; I506-L510 WeakPolarHBondContact O-CG 3.42Å; I506-L510 PolarHBondContact O-N 2.93Å; L507-L510 PolarHBondContact O-N 2.88Å; L510-K512 PolarHBondContact O-N 3.11Å; L510-H513 CarbonylContact O-C 3.46Å; L510-H513 PolarHBondContact O-N 3.15Å; L510-H513 VanDerWaalsContact O-N 3.15Å; L510-G514 PolarHBondContact O-N 3.27Å; L510-A515 HydrophobicContact CB-CB 3.97Å; L510-A515 WeakPolarHBondContact O-CB 3.49Å; L510-A515 PolarHBondContact O-N 3.45Å; L510-A515 VanDerWaalsContact O-N 3.11Å
511	Q	93.4	Very high	94.1	Very high	59 Å²	59	49.2 Å²	49.2	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-45.2	175.7	-177.4	64.6	5.2	0	0	111.7	L507 H513 G514 V517 Y546	L507-Q511 WeakPolarHBondContact O-CB 3.3Å; L507-Q511 PolarHBondContact O-N 3.46Å; Q511-H513 PolarHBondContact O-N 3Å; Q511-H513 VanDerWaalsContact O-N 3.12Å; Q511-G514 PolarHBondContact O-N 3.12Å; Q511-V517 VanDerWaalsContact OE1-CG2 3.23Å; Q511-Y546 HydrophobicContact CB-CD2 3.66Å; Q511-Y546 HydrophobicContact CB-CE1 4.45Å; Q511-Y546 HydrophobicContact CB-CE2 3.53Å; Q511-Y546 HydrophobicContact CB-CG 4.17Å; Q511-Y546 HydrophobicContact CG-CD1 3.83Å; Q511-Y546 HydrophobicContact CG-CD2 3.66Å; Q511-Y546 HydrophobicContact CG-CE1 4.08Å; Q511-Y546 HydrophobicContact CG-CE2 3.9Å; Q511-Y546 HydrophobicContact CG-CG 3.62Å
512	K	93.3	Very high	94	Very high	183 Å²	183	45.8 Å²	45.8	80%	0.796	25%	0.249	S	C	*	.	H	α-helix	trans	-58.6	-25.1	177.4	-176.9	173.7	179.4	177.4	0	113.7	E508 V509 L510	E508-K512 WeakPolarHBondContact O-CB 3.36Å; E508-K512 PolarHBondContact O-N 3Å; V509-K512 PolarHBondContact O-N 3.03Å; L510-K512 PolarHBondContact O-N 3.11Å
513	H	93.7	Very high	93.8	Very high	76 Å²	76	47.1 Å²	47.1	35%	0.352	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	14.3	178.1	-65.7	85.3	0	0	0	113.3	L478 I484 V509 L510 Q511	L478-H513 HydrophobicContact CD1-CB 4.18Å; I484-H513 HydrophobicContact CD1-CB 3.58Å; V509-H513 PolarHBondContact O-N 2.93Å; V509-H513 PolarHBondContact O-ND1 3.09Å; L510-H513 CarbonylContact O-C 3.46Å; L510-H513 PolarHBondContact O-N 3.15Å; L510-H513 VanDerWaalsContact O-N 3.15Å; Q511-H513 PolarHBondContact O-N 3Å; Q511-H513 VanDerWaalsContact O-N 3.12Å
514	G	91.6	Very high	93.4	Very high	48 Å²	48	46.6 Å²	46.6	50%	0.495	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	37.5	171.3	0	0	0	0	0	115.4	N485 L510 Q511	N485-G514 PolarHBondContact ND2-O 3.04Å; L510-G514 PolarHBondContact O-N 3.27Å; Q511-G514 PolarHBondContact O-N 3.12Å
515	A	95.6	Very high	93.4	Very high	9 Å²	9	45 Å²	45	7%	0.074	24%	0.243	C	C	.	.			trans	-63	138.4	170.6	0	0	0	0	0	111.8	I484 L495 L510 V517	I484-A515 HydrophobicContact CD1-CB 3.94Å; I484-A515 HydrophobicContact CG1-CB 4.1Å; L495-A515 HydrophobicContact CB-CB 4.44Å; L495-A515 HydrophobicContact CD1-CB 4.04Å; L495-A515 HydrophobicContact CD2-CB 4.16Å; L495-A515 HydrophobicContact CG-CB 4.46Å; L510-A515 HydrophobicContact CB-CB 3.97Å; L510-A515 WeakPolarHBondContact O-CB 3.49Å; L510-A515 PolarHBondContact O-N 3.45Å; L510-A515 VanDerWaalsContact O-N 3.11Å; A515-V517 PolarHBondContact O-N 2.99Å
516	K	94.6	Very high	93.6	Very high	138 Å²	138	43.1 Å²	43.1	60%	0.6	23%	0.233	S	C	*	.			trans	-78.9	98.9	176.8	-70.9	178.3	-179.2	-174.8	0	110.1	N485 N518 A519	N485-K516 HydrophobicContact CB-CD 4.49Å; N485-K516 WeakPolarHBondContact OD1-CB 3.21Å; N485-K516 PolarHBondContact OD1-N 2.97Å; K516-N518 PolarHBondContact O-N 2.87Å; K516-A519 HydrophobicContact CB-CB 4Å; K516-A519 VanDerWaalsContact O-CB 3.32Å; K516-A519 WeakPolarHBondContact O-CB 3.24Å; K516-A519 PolarHBondContact O-N 2.82Å; K516-A519 VanDerWaalsContact O-N 3.16Å
517	V	94.2	Very high	93.7	Very high	14 Å²	14	43.1 Å²	43.1	9%	0.085	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-44.7	-175.8	-172	0	0	0	0	112.9	L495 Q511 A515 A519 L543 A548	L495-V517 HydrophobicContact CD2-CB 4.44Å; L495-V517 HydrophobicContact CD2-CG2 4.45Å; Q511-V517 VanDerWaalsContact OE1-CG2 3.23Å; A515-V517 PolarHBondContact O-N 2.99Å; V517-A519 VanDerWaalsContact C-N 3.33Å; V517-A519 PolarHBondContact O-N 3.28Å; V517-L543 HydrophobicContact CG1-CD2 4.13Å; V517-A548 HydrophobicContact CG1-CB 3.6Å
518	N	94.2	Very high	93.7	Very high	65 Å²	65	43.1 Å²	43.1	35%	0.348	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	24.9	179.6	-62	-37.9	0	0	0	113.4	K516 G547 A548 D549 I552	K516-N518 PolarHBondContact O-N 2.87Å; N518-G547 PolarHBondContact ND2-O 3.38Å; N518-A548 VanDerWaalsContact OD1-CA 3.3Å; N518-A548 WeakPolarHBondContact OD1-CA 3.43Å; N518-D549 PolarHBondContact OD1-N 3.48Å; N518-I552 HydrophobicContact CB-CD1 3.81Å
519	A	94.1	Very high	93.8	Very high	17 Å²	17	38.5 Å²	38.5	14%	0.14	21%	0.211	C	C	.	.			trans	-65.6	141.6	166.2	0	0	0	0	0	109.6	T493 H496 K516 V517 T526	T493-A519 HydrophobicContact CG2-CB 4.16Å; H496-A519 PolarHBondContact CE1-O 3.34Å; H496-A519 PolarHBondContact NE2-O 2.99Å; H496-A519 VanDerWaalsContact NE2-O 3.09Å; K516-A519 HydrophobicContact CB-CB 4Å; K516-A519 VanDerWaalsContact O-CB 3.32Å; K516-A519 WeakPolarHBondContact O-CB 3.24Å; K516-A519 PolarHBondContact O-N 2.82Å; K516-A519 VanDerWaalsContact O-N 3.16Å; V517-A519 VanDerWaalsContact C-N 3.33Å; V517-A519 PolarHBondContact O-N 3.28Å; A519-T526 WeakPolarHBondContact O-CA 3.4Å
520	A	92.3	Very high	93.8	Very high	36 Å²	36	39.8 Å²	39.8	30%	0.298	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-108	146.7	178.8	0	0	0	0	0	112.5	K487 Q525	K487-A520 PolarHBondContact NZ-O 3.34Å; A520-Q525 CarbonylContact C-O 3.58Å; A520-Q525 WeakPolarHBondContact CA-O 3.47Å
521	D	93.4	Very high	93.8	Very high	12 Å²	12	39.8 Å²	39.8	6%	0.064	22%	0.215	C	C	.	.			trans	-87.7	-166	175.9	72.3	9.7	0	0	0	113.5	M492 L523 G524 Q525 R530	M492-D521 HydrophobicContact CG-CB 3.96Å; D521-L523 PolarHBondContact O-N 3.28Å; D521-L523 WeakPolarHBondContact OD1-CA 3.47Å; D521-L523 PolarHBondContact OD1-N 3.36Å; D521-G524 PolarHBondContact O-N 3.37Å; D521-G524 VanDerWaalsContact O-N 3.16Å; D521-G524 PolarHBondContact OD1-N 3.06Å; D521-Q525 PolarHBondContact N-O 3.37Å; D521-Q525 WeakPolarHBondContact OD1-CB 3.49Å; D521-Q525 PolarHBondContact OD1-N 2.74Å; D521-R530 IonicContact OD2-CZ 2.55Å; D521-R530 VanDerWaalsContact OD2-CZ 3.26Å; D521-R530 IonicContact OD2-NE 3.88Å; D521-R530 PolarHBondContact OD2-NE 3.23Å; D521-R530 IonicContact OD2-NH2 2.76Å; D521-R530 PolarHBondContact OD2-NH2 2.8Å
522	T	91.9	Very high	93.9	Very high	59 Å²	59	37 Å²	37	36%	0.362	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-23	176.7	39.2	0	0	0	0	114.7	D490 F491 L555	D490-T522 VanDerWaalsContact C-CG2 3.48Å; D490-T522 WeakPolarHBondContact O-CG2 3.23Å; D490-T522 PolarHBondContact O-N 2.99Å; D490-T522 PolarHBondContact O-OG1 3.29Å; F491-T522 HydrophobicContact CB-CG2 4.08Å; F491-T522 HydrophobicContact CD2-CG2 3.62Å; F491-T522 HydrophobicContact CE2-CG2 4.49Å; F491-T522 HydrophobicContact CG-CG2 4.19Å; T522-L555 WeakPolarHBondContact O-CD1 3.47Å
523	L	90.6	Very high	93.9	Very high	60 Å²	60	32.9 Å²	32.9	31%	0.314	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	9.6	179.4	-54.8	-175.9	0	0	0	111.6	D521 Q525 L555 Q556	D521-L523 PolarHBondContact O-N 3.28Å; D521-L523 WeakPolarHBondContact OD1-CA 3.47Å; D521-L523 PolarHBondContact OD1-N 3.36Å; L523-Q525 HydrophobicContact CB-CG 4.05Å; L523-Q525 PolarHBondContact O-N 2.87Å; L523-L555 WeakPolarHBondContact O-CB 3.2Å; L523-L555 WeakPolarHBondContact O-CG 3.44Å; L523-L555 PolarHBondContact O-N 3.43Å; L523-Q556 PolarHBondContact O-OE1 2.95Å
524	G	88.4	Confident	93.8	Very high	13 Å²	13	31.4 Å²	31.4	13%	0.134	19%	0.189	C	C	.	.	S	Bend	trans	70.6	7.2	-174.9	0	0	0	0	0	113.4	D521	D521-G524 PolarHBondContact O-N 3.37Å; D521-G524 VanDerWaalsContact O-N 3.16Å; D521-G524 PolarHBondContact OD1-N 3.06Å
525	Q	94.1	Very high	93.9	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.047	18%	0.177	C	C	.	.			trans	-82.3	138.9	-176.7	-69.2	171.1	25.7	0	0	109.7	H496 A520 D521 L523 H529 M563	H496-Q525 PolarHBondContact NE2-O 3.07Å; A520-Q525 CarbonylContact C-O 3.58Å; A520-Q525 WeakPolarHBondContact CA-O 3.47Å; D521-Q525 PolarHBondContact N-O 3.37Å; D521-Q525 WeakPolarHBondContact OD1-CB 3.49Å; D521-Q525 PolarHBondContact OD1-N 2.74Å; L523-Q525 HydrophobicContact CB-CG 4.05Å; L523-Q525 PolarHBondContact O-N 2.87Å; Q525-H529 HydrophobicContact CB-CB 3.73Å; Q525-H529 HydrophobicContact CG-CB 4.04Å; Q525-M563 HydrophobicContact CG-CE 4.5Å; Q525-M563 HydrophobicContact CG-SD 4.25Å
526	T	96.4	Very high	93.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-89.7	171.9	172.8	65.4	0	0	0	0	111.2	A519 L528 H529 R530 I552	A519-T526 WeakPolarHBondContact O-CA 3.4Å; T526-L528 PolarHBondContact O-N 2.9Å; T526-L528 VanDerWaalsContact O-N 3.11Å; T526-L528 PolarHBondContact OG1-N 3.01Å; T526-H529 PolarHBondContact N-ND1 3.29Å; T526-H529 WeakPolarHBondContact O-CB 3.46Å; T526-H529 PolarHBondContact O-N 3.11Å; T526-H529 PolarHBondContact OG1-ND1 3.2Å; T526-R530 PolarHBondContact O-N 2.92Å; T526-R530 VanDerWaalsContact O-N 3.15Å; T526-I552 HydrophobicContact CG2-CB 4.49Å; T526-I552 HydrophobicContact CG2-CD1 4.05Å; T526-I552 HydrophobicContact CG2-CG2 3.97Å
527	A	96.4	Very high	93.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-53.6	-31	171.1	0	0	0	0	0	112.8	L495 H496 A499 R530 A531 L543	L495-A527 HydrophobicContact CD2-CB 4.15Å; L495-A527 HydrophobicContact CG-CB 4.13Å; H496-A527 PolarHBondContact NE2-N 3.44Å; A499-A527 HydrophobicContact CB-CB 3.99Å; A499-A527 WeakPolarHBondContact CB-O 3.32Å; A527-R530 PolarHBondContact O-N 3.47Å; A527-A531 WeakPolarHBondContact O-CB 3.39Å; A527-A531 PolarHBondContact O-N 3.18Å; A527-L543 HydrophobicContact CB-CD1 4.18Å; A527-L543 HydrophobicContact CB-CD2 4.08Å; A527-L543 WeakPolarHBondContact O-CD1 3.42Å
528	L	95.9	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.3	-38.6	176	-175.2	64	0	0	0	112.4	T526 A531 A532 C540 L543 L544 A548 P550 A560 L572	T526-L528 PolarHBondContact O-N 2.9Å; T526-L528 VanDerWaalsContact O-N 3.11Å; T526-L528 PolarHBondContact OG1-N 3.01Å; L528-A531 PolarHBondContact O-N 3.49Å; L528-A532 VanDerWaalsContact O-CB 3.24Å; L528-A532 WeakPolarHBondContact O-CB 3.34Å; L528-A532 PolarHBondContact O-N 3.24Å; L528-C540 HydrophobicContact CD1-CB 3.95Å; L528-L543 HydrophobicContact CB-CD1 4.41Å; L528-L543 HydrophobicContact CD1-CB 4.08Å; L528-L543 HydrophobicContact CD1-CD1 4.4Å; L528-L544 HydrophobicContact CD1-CG 4.47Å; L528-L544 HydrophobicContact CD2-CD2 4.03Å; L528-A548 HydrophobicContact CB-CB 4.13Å; L528-A548 HydrophobicContact CD2-CB 3.91Å; L528-A548 HydrophobicContact CG-CB 4.44Å; L528-P550 HydrophobicContact CD2-CB 4.3Å; L528-A560 HydrophobicContact CB-CB 4.42Å; L528-A560 HydrophobicContact CD2-CB 4.07Å; L528-A560 HydrophobicContact CG-CB 3.8Å; L528-L572 HydrophobicContact CD1-CD2 4.31Å; L528-L572 HydrophobicContact CD2-CD2 3.98Å; L528-L572 HydrophobicContact CG-CD2 4.48Å
529	H	95.3	Very high	93.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.7	-42.8	173.9	-68.8	76.7	0	0	0	111.3	Q525 T526 A532 L533 I552 F558 A560 M563	Q525-H529 HydrophobicContact CB-CB 3.73Å; Q525-H529 HydrophobicContact CG-CB 4.04Å; T526-H529 PolarHBondContact N-ND1 3.29Å; T526-H529 WeakPolarHBondContact O-CB 3.46Å; T526-H529 PolarHBondContact O-N 3.11Å; T526-H529 PolarHBondContact OG1-ND1 3.2Å; H529-A532 PolarHBondContact O-N 2.84Å; H529-L533 VanDerWaalsContact O-CB 3.3Å; H529-L533 WeakPolarHBondContact O-CB 3.36Å; H529-L533 PolarHBondContact O-N 2.81Å; H529-I552 PolarHBondContact CE1-O 3.44Å; H529-I552 PolarHBondContact NE2-O 2.75Å; H529-I552 VanDerWaalsContact NE2-O 3.15Å; H529-F558 PolarHBondContact NE2-O 2.9Å; H529-A560 PolarHBondContact CD2-N 2.91Å; H529-A560 PolarHBondContact NE2-N 3.05Å; H529-M563 HydrophobicContact CB-SD 4.27Å
530	R	95.3	Very high	93.7	Very high	35 Å²	35	29.7 Å²	29.7	13%	0.132	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-43.2	177	-67.4	-65.1	-175	151.3	-10.4	112.4	E500 D521 T526 A527 A534	E500-R530 HydrophobicContact CB-CB 4.37Å; E500-R530 IonicContact OE1-CZ 3.61Å; E500-R530 IonicContact OE1-NH1 3.59Å; E500-R530 PolarHBondContact OE1-NH1 3.01Å; D521-R530 IonicContact OD2-CZ 2.55Å; D521-R530 VanDerWaalsContact OD2-CZ 3.26Å; D521-R530 IonicContact OD2-NE 3.88Å; D521-R530 PolarHBondContact OD2-NE 3.23Å; D521-R530 IonicContact OD2-NH2 2.76Å; D521-R530 PolarHBondContact OD2-NH2 2.8Å; T526-R530 PolarHBondContact O-N 2.92Å; T526-R530 VanDerWaalsContact O-N 3.15Å; A527-R530 PolarHBondContact O-N 3.47Å; R530-A534 WeakPolarHBondContact O-CB 3.46Å; R530-A534 PolarHBondContact O-N 3.33Å
531	A	96.1	Very high	93.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-41.2	173.7	0	0	0	0	0	112.3	A499 A527 L528 G535 H536 T539 L543	A499-A531 HydrophobicContact CB-CB 4.29Å; A527-A531 WeakPolarHBondContact O-CB 3.39Å; A527-A531 PolarHBondContact O-N 3.18Å; L528-A531 PolarHBondContact O-N 3.49Å; A531-G535 PolarHBondContact O-N 2.86Å; A531-H536 PolarHBondContact O-N 3.15Å; A531-T539 HydrophobicContact CB-CG2 3.65Å; A531-L543 HydrophobicContact CB-CD1 3.88Å
532	A	94.4	Very high	93.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.8	-48.2	-179.8	0	0	0	0	0	112.3	L528 H529 A534 G535 A560 G564 V568	L528-A532 VanDerWaalsContact O-CB 3.24Å; L528-A532 WeakPolarHBondContact O-CB 3.34Å; L528-A532 PolarHBondContact O-N 3.24Å; H529-A532 PolarHBondContact O-N 2.84Å; A532-A534 VanDerWaalsContact C-N 3.25Å; A532-A534 PolarHBondContact O-N 2.84Å; A532-G535 WeakPolarHBondContact O-CA 3.37Å; A532-G535 PolarHBondContact O-N 2.74Å; A532-A560 HydrophobicContact CB-CB 4.28Å; A532-A560 WeakPolarHBondContact CB-O 3.34Å; A532-G564 WeakPolarHBondContact O-CA 3.32Å; A532-V568 HydrophobicContact CB-CG1 3.67Å
533	L	93.9	Very high	93.7	Very high	98 Å²	98	30.7 Å²	30.7	51%	0.513	16%	0.164	S	C	.	.	H	α-helix	trans	-56.9	-38.7	176.9	-177.9	65.3	0	0	0	112.4	H529 G535 M563	H529-L533 VanDerWaalsContact O-CB 3.3Å; H529-L533 WeakPolarHBondContact O-CB 3.36Å; H529-L533 PolarHBondContact O-N 2.81Å; L533-G535 VanDerWaalsContact C-N 3.28Å; L533-G535 PolarHBondContact O-N 3Å; L533-M563 WeakPolarHBondContact CA-O 3.45Å; L533-M563 HydrophobicContact CB-CE 4.19Å; L533-M563 HydrophobicContact CD1-CE 3.95Å; L533-M563 HydrophobicContact CD2-CE 3.87Å; L533-M563 HydrophobicContact CG-CE 4.22Å
534	A	92.1	Very high	93.6	Very high	44 Å²	44	29.9 Å²	29.9	36%	0.364	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.9	176.5	0	0	0	0	0	113.9	R530 A532 H536	R530-A534 WeakPolarHBondContact O-CB 3.46Å; R530-A534 PolarHBondContact O-N 3.33Å; A532-A534 VanDerWaalsContact C-N 3.25Å; A532-A534 PolarHBondContact O-N 2.84Å; A534-H536 VanDerWaalsContact CB-CD2 3.44Å; A534-H536 WeakPolarHBondContact CB-CD2 3.45Å; A534-H536 VanDerWaalsContact CB-NE2 3.32Å; A534-H536 WeakPolarHBondContact CB-NE2 3.27Å; A534-H536 PolarHBondContact O-CE1 3.06Å; A534-H536 PolarHBondContact O-N 3Å
535	G	93.1	Very high	93.6	Very high	22 Å²	22	33.3 Å²	33.3	23%	0.227	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	13.5	176.1	0	0	0	0	0	115.5	A531 A532 L533 I537	A531-G535 PolarHBondContact O-N 2.86Å; A532-G535 WeakPolarHBondContact O-CA 3.37Å; A532-G535 PolarHBondContact O-N 2.74Å; L533-G535 VanDerWaalsContact C-N 3.28Å; L533-G535 PolarHBondContact O-N 3Å; G535-I537 PolarHBondContact O-N 2.92Å
536	H	94.6	Very high	93.4	Very high	51 Å²	51	35 Å²	35	24%	0.236	19%	0.188	C	C	.	.			trans	-81	77	-169.9	-61.5	-40.1	0	0	0	112.7	A499 E500 A502 A531 A534 Q538 T539 C540	A499-H536 PolarHBondContact O-CD2 3.34Å; A499-H536 VanDerWaalsContact O-CD2 3.3Å; E500-H536 PolarHBondContact O-CD2 3.18Å; E500-H536 PolarHBondContact O-NE2 2.92Å; A502-H536 HydrophobicContact CB-CB 4.33Å; A531-H536 PolarHBondContact O-N 3.15Å; A534-H536 VanDerWaalsContact CB-CD2 3.44Å; A534-H536 WeakPolarHBondContact CB-CD2 3.45Å; A534-H536 VanDerWaalsContact CB-NE2 3.32Å; A534-H536 WeakPolarHBondContact CB-NE2 3.27Å; A534-H536 PolarHBondContact O-CE1 3.06Å; A534-H536 PolarHBondContact O-N 3Å; H536-Q538 PolarHBondContact O-N 2.74Å; H536-T539 WeakPolarHBondContact O-CB 3.46Å; H536-T539 PolarHBondContact O-N 2.83Å; H536-C540 PolarHBondContact O-N 2.83Å; H536-C540 PolarHBondContact O-SG 3.17Å
537	I	91.8	Very high	92.9	Very high	63 Å²	63	37.3 Å²	37.3	32%	0.323	21%	0.211	S	C	.	.	H	α-helix	trans	-48.6	-50.5	-177.4	-67.6	165.7	0	0	0	113	G535 T539 C540 K541 A567 V568 I571	G535-I537 PolarHBondContact O-N 2.92Å; I537-T539 VanDerWaalsContact C-N 3.31Å; I537-T539 PolarHBondContact O-N 2.76Å; I537-C540 WeakPolarHBondContact O-CB 3.34Å; I537-C540 PolarHBondContact O-N 2.65Å; I537-K541 PolarHBondContact O-N 3.45Å; I537-A567 HydrophobicContact CD1-CB 3.7Å; I537-A567 HydrophobicContact CG1-CB 4.37Å; I537-V568 HydrophobicContact CG1-CG2 3.81Å; I537-I571 HydrophobicContact CG2-CD1 3.57Å
538	Q	92.8	Very high	92.6	Very high	117 Å²	117	37.7 Å²	37.7	55%	0.547	21%	0.214	S	C	.	.	H	α-helix	trans	-67	-35.2	-177.4	-174.3	60.4	17.8	0	0	112	H536 K541 L542	H536-Q538 PolarHBondContact O-N 2.74Å; Q538-K541 PolarHBondContact O-N 2.88Å; Q538-L542 WeakPolarHBondContact O-CB 3.44Å; Q538-L542 PolarHBondContact O-N 2.91Å
539	T	95.3	Very high	92.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-67.9	-39.3	175	-57	0	0	0	0	111.4	A499 N504 L507 A531 H536 I537 L542 L543	A499-T539 HydrophobicContact CB-CG2 4.16Å; N504-T539 PolarHBondContact ND2-OG1 2.86Å; N504-T539 WeakPolarHBondContact OD1-CA 3.4Å; N504-T539 WeakPolarHBondContact OD1-CB 3.38Å; N504-T539 PolarHBondContact OD1-OG1 3.36Å; L507-T539 HydrophobicContact CD1-CG2 3.64Å; A531-T539 HydrophobicContact CB-CG2 3.65Å; H536-T539 WeakPolarHBondContact O-CB 3.46Å; H536-T539 PolarHBondContact O-N 2.83Å; I537-T539 VanDerWaalsContact C-N 3.31Å; I537-T539 PolarHBondContact O-N 2.76Å; T539-L542 PolarHBondContact O-N 3.07Å; T539-L543 HydrophobicContact CG2-CD1 3.98Å; T539-L543 HydrophobicContact CG2-CG 4.49Å; T539-L543 WeakPolarHBondContact O-CB 3.14Å; T539-L543 WeakPolarHBondContact O-CG 3.37Å; T539-L543 PolarHBondContact O-N 2.58Å
540	C	93.8	Very high	91.6	Very high	1 Å²	1	42 Å²	42	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-61	-48.3	173.8	-62.7	0	0	0	0	111.3	L528 H536 I537 L542 L543 L544	L528-C540 HydrophobicContact CD1-CB 3.95Å; H536-C540 PolarHBondContact O-N 2.83Å; H536-C540 PolarHBondContact O-SG 3.17Å; I537-C540 WeakPolarHBondContact O-CB 3.34Å; I537-C540 PolarHBondContact O-N 2.65Å; C540-L542 VanDerWaalsContact C-N 3.31Å; C540-L542 PolarHBondContact O-N 3.07Å; C540-L543 PolarHBondContact O-N 2.84Å; C540-L544 WeakPolarHBondContact O-CG 3.28Å; C540-L544 PolarHBondContact O-N 3.04Å
541	K	90.9	Very high	91	Very high	102 Å²	102	44 Å²	44	44%	0.443	26%	0.258	S	S	.	.	H	α-helix	trans	-57.5	-43.4	175	-70.1	-179.5	-179.2	-174.8	0	112.3	I537 Q538 L544 S545 I571	I537-K541 PolarHBondContact O-N 3.45Å; Q538-K541 PolarHBondContact O-N 2.88Å; K541-L544 PolarHBondContact O-N 3.49Å; K541-S545 PolarHBondContact O-N 3.39Å; K541-I571 HydrophobicContact CG-CD1 4.49Å; K541-I571 HydrophobicContact CG-CG2 4.25Å
542	L	93.1	Very high	90.2	Very high	26 Å²	26	46.2 Å²	46.2	14%	0.136	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-45.3	179.2	-164.9	66.9	0	0	0	111.4	N504 L507 Q538 T539 C540 S545 Y546	N504-L542 HydrophobicContact CB-CD2 4.2Å; L507-L542 HydrophobicContact CB-CD2 3.83Å; Q538-L542 WeakPolarHBondContact O-CB 3.44Å; Q538-L542 PolarHBondContact O-N 2.91Å; T539-L542 PolarHBondContact O-N 3.07Å; C540-L542 VanDerWaalsContact C-N 3.31Å; C540-L542 PolarHBondContact O-N 3.07Å; L542-S545 PolarHBondContact O-N 3.23Å; L542-S545 PolarHBondContact O-OG 2.96Å; L542-Y546 HydrophobicContact CD1-CE1 3.97Å; L542-Y546 HydrophobicContact CD1-CE2 4.41Å; L542-Y546 WeakPolarHBondContact CD1-OH 3.46Å; L542-Y546 HydrophobicContact CD2-CE2 4.17Å; L542-Y546 HydrophobicContact CG-CE1 4.16Å; L542-Y546 HydrophobicContact CG-CE2 3.77Å; L542-Y546 WeakPolarHBondContact CG-OH 3.38Å; L542-Y546 WeakPolarHBondContact O-CD1 3.42Å; L542-Y546 VanDerWaalsContact O-CG 3.24Å; L542-Y546 PolarHBondContact O-N 3.34Å; L542-Y546 VanDerWaalsContact O-N 3.16Å
543	L	93.8	Very high	89.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-41.9	176.7	-75	167.7	0	0	0	112.5	L495 A499 L507 V517 A527 L528 A531 T539 C540 S545 Y546 G547 A548	L495-L543 HydrophobicContact CD2-CD2 4.42Å; A499-L543 HydrophobicContact CB-CD1 4.1Å; L507-L543 HydrophobicContact CD2-CD2 3.59Å; L507-L543 HydrophobicContact CD2-CG 4.02Å; V517-L543 HydrophobicContact CG1-CD2 4.13Å; A527-L543 HydrophobicContact CB-CD1 4.18Å; A527-L543 HydrophobicContact CB-CD2 4.08Å; A527-L543 WeakPolarHBondContact O-CD1 3.42Å; L528-L543 HydrophobicContact CB-CD1 4.41Å; L528-L543 HydrophobicContact CD1-CB 4.08Å; L528-L543 HydrophobicContact CD1-CD1 4.4Å; A531-L543 HydrophobicContact CB-CD1 3.88Å; T539-L543 HydrophobicContact CG2-CD1 3.98Å; T539-L543 HydrophobicContact CG2-CG 4.49Å; T539-L543 WeakPolarHBondContact O-CB 3.14Å; T539-L543 WeakPolarHBondContact O-CG 3.37Å; T539-L543 PolarHBondContact O-N 2.58Å; C540-L543 PolarHBondContact O-N 2.84Å; L543-S545 VanDerWaalsContact C-N 3.33Å; L543-S545 PolarHBondContact O-N 3.48Å; L543-Y546 CarbonylContact O-C 3.37Å; L543-Y546 WeakPolarHBondContact O-CA 3.45Å; L543-Y546 WeakPolarHBondContact O-CB 3.3Å; L543-Y546 PolarHBondContact O-N 2.94Å; L543-G547 PolarHBondContact O-N 3.35Å; L543-A548 VanDerWaalsContact C-CB 3.47Å; L543-A548 HydrophobicContact CB-CB 3.97Å; L543-A548 WeakPolarHBondContact O-CB 2.98Å; L543-A548 PolarHBondContact O-N 2.92Å
544	L	88.6	Confident	89.2	Confident	43 Å²	43	45.2 Å²	45.2	23%	0.225	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-44.6	172.4	-69.4	168.8	0	0	0	111.3	L528 C540 K541 Y546 G547 P550 I571 L572	L528-L544 HydrophobicContact CD1-CG 4.47Å; L528-L544 HydrophobicContact CD2-CD2 4.03Å; C540-L544 WeakPolarHBondContact O-CG 3.28Å; C540-L544 PolarHBondContact O-N 3.04Å; K541-L544 PolarHBondContact O-N 3.49Å; L544-Y546 PolarHBondContact O-N 3.48Å; L544-Y546 VanDerWaalsContact O-N 3.12Å; L544-G547 PolarHBondContact O-N 3.49Å; L544-P550 HydrophobicContact CD2-CB 4.4Å; L544-P550 HydrophobicContact CD2-CG 4.45Å; L544-I571 HydrophobicContact CD1-CG2 4.04Å; L544-L572 HydrophobicContact CD1-CD2 3.82Å; L544-L572 HydrophobicContact CD2-CD2 3.86Å; L544-L572 HydrophobicContact CG-CD2 4.18Å
545	S	88.3	Confident	88.6	Confident	85 Å²	85	46.2 Å²	46.2	59%	0.594	27%	0.266	S	S	*	.	H	α-helix	trans	-63.1	-18	175.9	81	0	0	0	0	113.8	K541 L542 L543	K541-S545 PolarHBondContact O-N 3.39Å; L542-S545 PolarHBondContact O-N 3.23Å; L542-S545 PolarHBondContact O-OG 2.96Å; L543-S545 VanDerWaalsContact C-N 3.33Å; L543-S545 PolarHBondContact O-N 3.48Å
546	Y	90.1	Very high	87.7	Confident	47 Å²	47	49.7 Å²	49.7	18%	0.184	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	2.9	176.4	-62.5	-9.6	0	0	0	113.2	L507 E508 Q511 L542 L543 L544	L507-Y546 HydrophobicContact CB-CE2 4.37Å; E508-Y546 WeakPolarHBondContact CA-OH 3.48Å; E508-Y546 WeakPolarHBondContact CG-OH 3.49Å; Q511-Y546 HydrophobicContact CB-CD2 3.66Å; Q511-Y546 HydrophobicContact CB-CE1 4.45Å; Q511-Y546 HydrophobicContact CB-CE2 3.53Å; Q511-Y546 HydrophobicContact CB-CG 4.17Å; Q511-Y546 HydrophobicContact CG-CD1 3.83Å; Q511-Y546 HydrophobicContact CG-CD2 3.66Å; Q511-Y546 HydrophobicContact CG-CE1 4.08Å; Q511-Y546 HydrophobicContact CG-CE2 3.9Å; Q511-Y546 HydrophobicContact CG-CG 3.62Å; L542-Y546 HydrophobicContact CD1-CE1 3.97Å; L542-Y546 HydrophobicContact CD1-CE2 4.41Å; L542-Y546 WeakPolarHBondContact CD1-OH 3.46Å; L542-Y546 HydrophobicContact CD2-CE2 4.17Å; L542-Y546 HydrophobicContact CG-CE1 4.16Å; L542-Y546 HydrophobicContact CG-CE2 3.77Å; L542-Y546 WeakPolarHBondContact CG-OH 3.38Å; L542-Y546 WeakPolarHBondContact O-CD1 3.42Å; L542-Y546 VanDerWaalsContact O-CG 3.24Å; L542-Y546 PolarHBondContact O-N 3.34Å; L542-Y546 VanDerWaalsContact O-N 3.16Å; L543-Y546 CarbonylContact O-C 3.37Å; L543-Y546 WeakPolarHBondContact O-CA 3.45Å; L543-Y546 WeakPolarHBondContact O-CB 3.3Å; L543-Y546 PolarHBondContact O-N 2.94Å; L544-Y546 PolarHBondContact O-N 3.48Å; L544-Y546 VanDerWaalsContact O-N 3.12Å
547	G	85.4	Confident	86.7	Confident	48 Å²	48	48.5 Å²	48.5	50%	0.495	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	27.3	-178.7	0	0	0	0	0	114.1	N518 L543 L544 D549	N518-G547 PolarHBondContact ND2-O 3.38Å; L543-G547 PolarHBondContact O-N 3.35Å; L544-G547 PolarHBondContact O-N 3.49Å; G547-D549 PolarHBondContact O-N 3.17Å
548	A	90.7	Very high	86.2	Confident	8 Å²	8	50.6 Å²	50.6	7%	0.066	29%	0.285	C	S	.	.			trans	-64.5	130.6	168.5	0	0	0	0	0	110.4	V517 N518 L528 L543 P550	V517-A548 HydrophobicContact CG1-CB 3.6Å; N518-A548 VanDerWaalsContact OD1-CA 3.3Å; N518-A548 WeakPolarHBondContact OD1-CA 3.43Å; L528-A548 HydrophobicContact CB-CB 4.13Å; L528-A548 HydrophobicContact CD2-CB 3.91Å; L528-A548 HydrophobicContact CG-CB 4.44Å; L543-A548 VanDerWaalsContact C-CB 3.47Å; L543-A548 HydrophobicContact CB-CB 3.97Å; L543-A548 WeakPolarHBondContact O-CB 2.98Å; L543-A548 PolarHBondContact O-N 2.92Å; A548-P550 WeakPolarHBondContact O-CD 3.28Å
549	D	84.3	Confident	86	Confident	60 Å²	60	46.4 Å²	46.4	32%	0.321	27%	0.268	S	S	.	.			trans	-89.8	113.7	179.5	-179.3	-7.3	0	0	0	109.9	N518 G547 S551 I552	N518-D549 PolarHBondContact OD1-N 3.48Å; G547-D549 PolarHBondContact O-N 3.17Å; D549-S551 VanDerWaalsContact C-N 3.26Å; D549-S551 PolarHBondContact O-N 2.98Å; D549-S551 WeakPolarHBondContact OD1-CA 3.46Å; D549-S551 VanDerWaalsContact OD1-CB 3.3Å; D549-S551 WeakPolarHBondContact OD1-CB 3.18Å; D549-S551 PolarHBondContact OD1-N 3.35Å; D549-S551 PolarHBondContact OD1-OG 3.31Å; D549-S551 PolarHBondContact OD2-OG 3.28Å; D549-I552 HydrophobicContact CB-CD1 3.79Å; D549-I552 HydrophobicContact CB-CG1 3.92Å
550	P	85.9	Confident	85.6	Confident	32 Å²	32	46.3 Å²	46.3	21%	0.208	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-12.2	-179.7	33.5	-36.8	0	0	0	113.4	L528 L544 A548 L572	L528-P550 HydrophobicContact CD2-CB 4.3Å; L544-P550 HydrophobicContact CD2-CB 4.4Å; L544-P550 HydrophobicContact CD2-CG 4.45Å; A548-P550 WeakPolarHBondContact O-CD 3.28Å; P550-L572 HydrophobicContact CB-CD2 3.97Å
551	S	81.5	Confident	85.3	Confident	75 Å²	75	46.5 Å²	46.5	52%	0.524	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.4	-179.4	76.5	0	0	0	0	113.7	D549 V553	D549-S551 VanDerWaalsContact C-N 3.26Å; D549-S551 PolarHBondContact O-N 2.98Å; D549-S551 WeakPolarHBondContact OD1-CA 3.46Å; D549-S551 VanDerWaalsContact OD1-CB 3.3Å; D549-S551 WeakPolarHBondContact OD1-CB 3.18Å; D549-S551 PolarHBondContact OD1-N 3.35Å; D549-S551 PolarHBondContact OD1-OG 3.31Å; D549-S551 PolarHBondContact OD2-OG 3.28Å; S551-V553 PolarHBondContact O-N 3.24Å
552	I	80.1	Confident	85	Confident	47 Å²	47	47.1 Å²	47.1	24%	0.241	27%	0.273	C	S	.	.			trans	-60.4	134.4	172.7	-64.1	174.9	0	0	0	108.9	N518 T526 H529 D549	N518-I552 HydrophobicContact CB-CD1 3.81Å; T526-I552 HydrophobicContact CG2-CB 4.49Å; T526-I552 HydrophobicContact CG2-CD1 4.05Å; T526-I552 HydrophobicContact CG2-CG2 3.97Å; H529-I552 PolarHBondContact CE1-O 3.44Å; H529-I552 PolarHBondContact NE2-O 2.75Å; H529-I552 VanDerWaalsContact NE2-O 3.15Å; D549-I552 HydrophobicContact CB-CD1 3.79Å; D549-I552 HydrophobicContact CB-CG1 3.92Å
553	V	84.6	Confident	84.8	Confident	72 Å²	72	47.5 Å²	47.5	44%	0.436	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-106.2	142.6	173.6	-67.8	0	0	0	0	111	S551 F558 T559	S551-V553 PolarHBondContact O-N 3.24Å; V553-F558 WeakPolarHBondContact CA-O 3.4Å; V553-T559 HydrophobicContact CG1-CG2 3.69Å
554	S	82.6	Confident	84.4	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.035	28%	0.279	C	S	.	.			trans	-61	167.4	165.4	57.6	0	0	0	0	112.5	Q556 G557 F558	S554-Q556 PolarHBondContact O-N 3.31Å; S554-G557 WeakPolarHBondContact O-CA 3.04Å; S554-G557 PolarHBondContact O-N 2.93Å; S554-F558 PolarHBondContact N-O 3.48Å; S554-F558 PolarHBondContact OG-N 3.17Å; S554-F558 VanDerWaalsContact OG-N 3.14Å; S554-F558 PolarHBondContact OG-O 3.31Å
555	L	78.5	Confident	84.4	Confident	65 Å²	65	49.5 Å²	49.5	34%	0.34	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.2	173.2	-68.8	-178.9	0	0	0	112.9	T522 L523 L681	T522-L555 WeakPolarHBondContact O-CD1 3.47Å; L523-L555 WeakPolarHBondContact O-CB 3.2Å; L523-L555 WeakPolarHBondContact O-CG 3.44Å; L523-L555 PolarHBondContact O-N 3.43Å; L555-L681 HydrophobicContact CD2-CB 4.23Å; L555-L681 HydrophobicContact CD2-CD1 4.01Å; L555-L681 HydrophobicContact CD2-CD2 3.74Å; L555-L681 HydrophobicContact CD2-CG 4.19Å
556	Q	75.9	Confident	84.3	Confident	96 Å²	96	52.9 Å²	52.9	45%	0.449	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.9	172.1	-64.8	81.4	6.7	0	0	113	L523 S554 F558	L523-Q556 PolarHBondContact O-OE1 2.95Å; S554-Q556 PolarHBondContact O-N 3.31Å; Q556-F558 HydrophobicContact CB-CD2 3.6Å; Q556-F558 HydrophobicContact CB-CE2 3.79Å
557	G	73.5	Confident	83.9	Confident	26 Å²	26	52.6 Å²	52.6	27%	0.268	30%	0.302	S	S	.	.	S	Bend	trans	85.4	4.7	179.9	0	0	0	0	0	115.1	S554	S554-G557 WeakPolarHBondContact O-CA 3.04Å; S554-G557 PolarHBondContact O-N 2.93Å
558	F	79.8	Confident	83.9	Confident	106 Å²	106	50.3 Å²	50.3	47%	0.465	28%	0.278	S	S	.	.			trans	-88.9	135.7	177.5	-57.8	-65.9	0	0	0	111.7	H529 V553 S554 Q556 Q562 M563	H529-F558 PolarHBondContact NE2-O 2.9Å; V553-F558 WeakPolarHBondContact CA-O 3.4Å; S554-F558 PolarHBondContact N-O 3.48Å; S554-F558 PolarHBondContact OG-N 3.17Å; S554-F558 VanDerWaalsContact OG-N 3.14Å; S554-F558 PolarHBondContact OG-O 3.31Å; Q556-F558 HydrophobicContact CB-CD2 3.6Å; Q556-F558 HydrophobicContact CB-CE2 3.79Å; F558-Q562 HydrophobicContact CB-CB 4.21Å; F558-Q562 HydrophobicContact CD1-CB 4.18Å; F558-M563 HydrophobicContact CB-CG 3.73Å; F558-M563 HydrophobicContact CB-SD 4.31Å; F558-M563 HydrophobicContact CG-CG 4.49Å
559	T	88.3	Confident	83.6	Confident	29 Å²	29	53.3 Å²	53.3	18%	0.178	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-74	165.6	165.4	64.3	0	0	0	0	111.1	V553 A561 Q562 M563	V553-T559 HydrophobicContact CG1-CG2 3.69Å; T559-A561 PolarHBondContact O-N 2.8Å; T559-A561 PolarHBondContact OG1-N 3.21Å; T559-Q562 PolarHBondContact O-N 3.32Å; T559-Q562 VanDerWaalsContact O-N 3.15Å; T559-Q562 PolarHBondContact OG1-N 3.39Å; T559-M563 PolarHBondContact O-N 3.44Å
560	A	88.6	Confident	83.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.2	-33.2	173.2	0	0	0	0	0	112.6	L528 H529 A532 M563 G564 L572	L528-A560 HydrophobicContact CB-CB 4.42Å; L528-A560 HydrophobicContact CD2-CB 4.07Å; L528-A560 HydrophobicContact CG-CB 3.8Å; H529-A560 PolarHBondContact CD2-N 2.91Å; H529-A560 PolarHBondContact NE2-N 3.05Å; A532-A560 HydrophobicContact CB-CB 4.28Å; A532-A560 WeakPolarHBondContact CB-O 3.34Å; A560-M563 PolarHBondContact O-N 3.42Å; A560-G564 PolarHBondContact O-N 3.29Å; A560-L572 HydrophobicContact CB-CD1 4.12Å
561	A	87.6	Confident	83.3	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.033	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-52.3	174.8	0	0	0	0	0	111.1	T559 M563 G564 Q569 L572	T559-A561 PolarHBondContact O-N 2.8Å; T559-A561 PolarHBondContact OG1-N 3.21Å; A561-M563 PolarHBondContact O-N 3.18Å; A561-G564 PolarHBondContact O-N 2.65Å; A561-Q569 WeakPolarHBondContact O-CG 3.38Å; A561-L572 HydrophobicContact CB-CB 3.76Å; A561-L572 HydrophobicContact CB-CD1 4.09Å
562	Q	84.7	Confident	83.1	Confident	115 Å²	115	53.5 Å²	53.5	54%	0.537	28%	0.279	S	S	.	.	H	α-helix	trans	-63.8	-23.7	-177.5	-69.2	168.2	-33.1	0	0	113.7	F558 T559	F558-Q562 HydrophobicContact CB-CB 4.21Å; F558-Q562 HydrophobicContact CD1-CB 4.18Å; T559-Q562 PolarHBondContact O-N 3.32Å; T559-Q562 VanDerWaalsContact O-N 3.15Å; T559-Q562 PolarHBondContact OG1-N 3.39Å
563	M	87.1	Confident	82.6	Confident	34 Å²	34	56 Å²	56	17%	0.167	29%	0.293	C	S	.	.	H	α-helix	trans	-84.6	-16.3	173.6	-65	-171.3	65	0	0	113.7	Q525 H529 L533 F558 T559 A560 A561	Q525-M563 HydrophobicContact CG-CE 4.5Å; Q525-M563 HydrophobicContact CG-SD 4.25Å; H529-M563 HydrophobicContact CB-SD 4.27Å; L533-M563 WeakPolarHBondContact CA-O 3.45Å; L533-M563 HydrophobicContact CB-CE 4.19Å; L533-M563 HydrophobicContact CD1-CE 3.95Å; L533-M563 HydrophobicContact CD2-CE 3.87Å; L533-M563 HydrophobicContact CG-CE 4.22Å; F558-M563 HydrophobicContact CB-CG 3.73Å; F558-M563 HydrophobicContact CB-SD 4.31Å; F558-M563 HydrophobicContact CG-CG 4.49Å; T559-M563 PolarHBondContact O-N 3.44Å; A560-M563 PolarHBondContact O-N 3.42Å; A561-M563 PolarHBondContact O-N 3.18Å
564	G	86.4	Confident	81.2	Confident	8 Å²	8	60.3 Å²	60.3	8%	0.082	31%	0.309	C	S	.	.	S	Bend	trans	-90.7	162.3	-178.6	0	0	0	0	0	114	A532 A560 A561 Q569	A532-G564 WeakPolarHBondContact O-CA 3.32Å; A560-G564 PolarHBondContact O-N 3.29Å; A561-G564 PolarHBondContact O-N 2.65Å; G564-Q569 PolarHBondContact O-NE2 3.19Å
565	N	88.3	Confident	79.6	Confident	78 Å²	78	65.5 Å²	65.5	42%	0.417	34%	0.336	S	S	.	.			trans	-67.1	169.6	169.2	66.1	25.4	0	0	0	111.9	A567 V568 Q569	N565-A567 PolarHBondContact O-N 3.39Å; N565-A567 VanDerWaalsContact O-N 3.15Å; N565-A567 PolarHBondContact OD1-N 3.01Å; N565-V568 PolarHBondContact O-N 3.31Å; N565-V568 WeakPolarHBondContact OD1-CG2 3.41Å; N565-V568 PolarHBondContact OD1-N 3.18Å; N565-V568 VanDerWaalsContact OD1-N 3.1Å; N565-Q569 PolarHBondContact O-N 3.47Å
566	E	85.5	Confident	78	Confident	156 Å²	156	67 Å²	67	73%	0.729	35%	0.348	S	S	*	.	H	α-helix	trans	-53	-39.2	-175.4	-62.6	-178.2	170.6	0	0	113.6	V568 Q569 Q570	E566-V568 PolarHBondContact O-N 2.72Å; E566-Q569 PolarHBondContact O-N 2.92Å; E566-Q570 WeakPolarHBondContact O-CG 3.35Å; E566-Q570 PolarHBondContact O-N 3.33Å
567	A	83.4	Confident	76.4	Confident	41 Å²	41	68 Å²	68	34%	0.339	36%	0.362	S	S	.	.	H	α-helix	trans	-68.2	-33.8	178.8	0	0	0	0	0	112.9	I537 N565 I571	I537-A567 HydrophobicContact CD1-CB 3.7Å; I537-A567 HydrophobicContact CG1-CB 4.37Å; N565-A567 PolarHBondContact O-N 3.39Å; N565-A567 VanDerWaalsContact O-N 3.15Å; N565-A567 PolarHBondContact OD1-N 3.01Å; A567-I571 WeakPolarHBondContact O-CD1 3.36Å
568	V	85.3	Confident	74.9	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-74.6	-37.8	172.9	170.5	0	0	0	0	111.2	A532 I537 N565 E566 Q570 I571 L572	A532-V568 HydrophobicContact CB-CG1 3.67Å; I537-V568 HydrophobicContact CG1-CG2 3.81Å; N565-V568 PolarHBondContact O-N 3.31Å; N565-V568 WeakPolarHBondContact OD1-CG2 3.41Å; N565-V568 PolarHBondContact OD1-N 3.18Å; N565-V568 VanDerWaalsContact OD1-N 3.1Å; E566-V568 PolarHBondContact O-N 2.72Å; V568-Q570 PolarHBondContact O-N 3.21Å; V568-I571 PolarHBondContact O-N 3.26Å; V568-L572 HydrophobicContact CG1-CD1 3.57Å; V568-L572 HydrophobicContact CG1-CG 4.41Å; V568-L572 WeakPolarHBondContact O-CG 3.3Å; V568-L572 PolarHBondContact O-N 3.43Å
569	Q	83.9	Confident	73.5	Confident	71 Å²	71	77.8 Å²	77.8	33%	0.332	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-45	175.7	-75.1	176.5	30.8	0	0	112.5	A561 G564 N565 E566 I571 L572 N573	A561-Q569 WeakPolarHBondContact O-CG 3.38Å; G564-Q569 PolarHBondContact O-NE2 3.19Å; N565-Q569 PolarHBondContact O-N 3.47Å; E566-Q569 PolarHBondContact O-N 2.92Å; Q569-I571 PolarHBondContact O-N 3.21Å; Q569-L572 PolarHBondContact O-N 3.34Å; Q569-N573 WeakPolarHBondContact O-CB 3.49Å; Q569-N573 VanDerWaalsContact O-CG 3.24Å; Q569-N573 PolarHBondContact O-N 3.3Å; Q569-N573 PolarHBondContact O-ND2 3.08Å
570	Q	80.3	Confident	72	Confident	132 Å²	132	83.1 Å²	83.1	62%	0.617	43%	0.432	S	S	*	.	H	α-helix	trans	-55.7	-48.9	177.8	-73.6	172.5	3.6	0	0	111.8	E566 V568 L572 N573 E574	E566-Q570 WeakPolarHBondContact O-CG 3.35Å; E566-Q570 PolarHBondContact O-N 3.33Å; V568-Q570 PolarHBondContact O-N 3.21Å; Q570-L572 VanDerWaalsContact C-N 3.31Å; Q570-L572 PolarHBondContact O-N 2.89Å; Q570-N573 PolarHBondContact O-N 2.82Å; Q570-E574 WeakPolarHBondContact O-CG 3.37Å; Q570-E574 PolarHBondContact O-N 3.36Å
571	I	82.6	Confident	70.9	Confident	35 Å²	35	87.5 Å²	87.5	18%	0.179	46%	0.462	C	S	.	.	H	α-helix	trans	-65.3	-33.2	-178.3	-65.1	160.7	0	0	0	112.4	I537 K541 L544 A567 V568 Q569	I537-I571 HydrophobicContact CG2-CD1 3.57Å; K541-I571 HydrophobicContact CG-CD1 4.49Å; K541-I571 HydrophobicContact CG-CG2 4.25Å; L544-I571 HydrophobicContact CD1-CG2 4.04Å; A567-I571 WeakPolarHBondContact O-CD1 3.36Å; V568-I571 PolarHBondContact O-N 3.26Å; Q569-I571 PolarHBondContact O-N 3.21Å
572	L	78.2	Confident	70.4	Confident	4 Å²	4	92.5 Å²	92.5	2%	0.021	49%	0.489	C	S	.	.	H	α-helix	trans	-85.4	-29.1	-176.7	-68.6	170.4	0	0	0	113	L528 L544 P550 A560 A561 V568 Q569 Q570	L528-L572 HydrophobicContact CD1-CD2 4.31Å; L528-L572 HydrophobicContact CD2-CD2 3.98Å; L528-L572 HydrophobicContact CG-CD2 4.48Å; L544-L572 HydrophobicContact CD1-CD2 3.82Å; L544-L572 HydrophobicContact CD2-CD2 3.86Å; L544-L572 HydrophobicContact CG-CD2 4.18Å; P550-L572 HydrophobicContact CB-CD2 3.97Å; A560-L572 HydrophobicContact CB-CD1 4.12Å; A561-L572 HydrophobicContact CB-CB 3.76Å; A561-L572 HydrophobicContact CB-CD1 4.09Å; V568-L572 HydrophobicContact CG1-CD1 3.57Å; V568-L572 HydrophobicContact CG1-CG 4.41Å; V568-L572 WeakPolarHBondContact O-CG 3.3Å; V568-L572 PolarHBondContact O-N 3.43Å; Q569-L572 PolarHBondContact O-N 3.34Å; Q570-L572 VanDerWaalsContact C-N 3.31Å; Q570-L572 PolarHBondContact O-N 2.89Å
573	N	68.9	Low	70.3	Confident	100 Å²	100	90.2 Å²	90.2	54%	0.535	48%	0.482	S	S	.	.	H	α-helix	trans	-81.6	-18.6	-177.9	-70.9	-16.5	0	0	0	114.1	Q569 Q570 N575	Q569-N573 WeakPolarHBondContact O-CB 3.49Å; Q569-N573 VanDerWaalsContact O-CG 3.24Å; Q569-N573 PolarHBondContact O-N 3.3Å; Q569-N573 PolarHBondContact O-ND2 3.08Å; Q570-N573 PolarHBondContact O-N 2.82Å; N573-N575 PolarHBondContact O-N 3.44Å
574	E	56.3	Low	70.2	Confident	162 Å²	162	89.9 Å²	89.9	76%	0.757	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-8.5	177.4	-78.1	177.2	167.4	0	0	114.6	Q570	Q570-E574 WeakPolarHBondContact O-CG 3.37Å; Q570-E574 PolarHBondContact O-N 3.36Å
575	N	49.3	Very low	70.1	Confident	114 Å²	114	96 Å²	96	61%	0.61	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	15.9	-166.5	-71.1	-75.2	0	0	0	116	N573	N573-N575 PolarHBondContact O-N 3.44Å
576	V	44.4	Very low	70.1	Confident	97 Å²	97	99 Å²	99	59%	0.588	51%	0.508	S	S	*	.			trans	-116	122.1	-176.5	-173.4	0	0	0	0	112.8
577	P	41.4	Very low	70.5	Confident	116 Å²	116	91.6 Å²	91.6	75%	0.753	47%	0.474	S	S	*	.			trans	-75.1	140.4	177.5	-15.8	30.4	0	0	0	114.2
578	T	43.4	Very low	70.8	Confident	146 Å²	146	90.1 Å²	90.1	90%	0.896	46%	0.46	S	S	*	.			trans	-77.8	144.7	172.5	38.1	0	0	0	0	112.7
579	R	50.6	Low	71.1	Confident	192 Å²	192	93.5 Å²	93.5	73%	0.725	48%	0.476	S	S	*	.			trans	-125.1	152	176.5	-78.3	-172.2	174	-162.3	-1.5	112.1	S581	R579-S581 PolarHBondContact O-N 3.03Å
580	N	55	Low	71.6	Confident	140 Å²	140	90.4 Å²	90.4	75%	0.749	46%	0.463	S	S	*	.			trans	-69.8	111.7	-179.8	-76.7	-18.7	0	0	0	112.1
581	S	67.3	Low	72.3	Confident	92 Å²	92	84.1 Å²	84.1	64%	0.643	43%	0.433	S	S	*	.	H	α-helix	trans	-78.4	-34.3	-173.6	46.7	0	0	0	0	115.8	R579 Y585	R579-S581 PolarHBondContact O-N 3.03Å; S581-Y585 WeakPolarHBondContact O-CB 3.33Å; S581-Y585 PolarHBondContact O-N 3.47Å
582	D	76.5	Confident	72.9	Confident	109 Å²	109	85 Å²	85	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-71.4	-40.3	-167.9	-174.4	45.6	0	0	0	114.1	Y585 R586	D582-Y585 PolarHBondContact O-N 2.87Å; D582-R586 PolarHBondContact O-N 3.09Å
583	V	81.6	Confident	73.5	Confident	67 Å²	67	87.8 Å²	87.8	41%	0.406	46%	0.459	S	S	.	.	H	α-helix	trans	-68.9	-42.1	177.7	180	0	0	0	0	111	Y585 R586 F587	V583-Y585 VanDerWaalsContact C-N 3.34Å; V583-Y585 PolarHBondContact O-N 3.02Å; V583-R586 PolarHBondContact O-N 3.29Å; V583-F587 WeakPolarHBondContact O-CB 3.24Å; V583-F587 PolarHBondContact O-N 2.87Å
584	D	85.6	Confident	74.7	Confident	28 Å²	28	84.4 Å²	84.4	15%	0.15	45%	0.448	C	S	.	.	H	α-helix	trans	-63.5	-40.3	178	-77.4	5.8	0	0	0	111	F587 L588 N607 C610	D584-F587 PolarHBondContact O-N 2.79Å; D584-L588 WeakPolarHBondContact O-CD1 3.13Å; D584-L588 VanDerWaalsContact O-CG 3.22Å; D584-L588 WeakPolarHBondContact O-CG 3.26Å; D584-L588 PolarHBondContact O-N 3.31Å; D584-N607 VanDerWaalsContact OD1-CB 3.25Å; D584-N607 WeakPolarHBondContact OD1-CB 3.31Å; D584-C610 HydrophobicContact CB-CB 3.87Å; D584-C610 VanDerWaalsContact OD2-CB 3.23Å; D584-C610 WeakPolarHBondContact OD2-CB 3.44Å
585	Y	85	Confident	76.6	Confident	136 Å²	136	79.7 Å²	79.7	53%	0.533	43%	0.428	S	S	.	.	H	α-helix	trans	-59.4	-50.9	174.8	178.6	-95.3	0	0	0	112.3	S581 D582 V583 F587 L588 E589	S581-Y585 WeakPolarHBondContact O-CB 3.33Å; S581-Y585 PolarHBondContact O-N 3.47Å; D582-Y585 PolarHBondContact O-N 2.87Å; V583-Y585 VanDerWaalsContact C-N 3.34Å; V583-Y585 PolarHBondContact O-N 3.02Å; Y585-F587 VanDerWaalsContact C-N 3.27Å; Y585-F587 PolarHBondContact O-N 2.81Å; Y585-L588 PolarHBondContact O-N 3.18Å; Y585-E589 HydrophobicContact CE1-CG 4.27Å; Y585-E589 PolarHBondContact O-N 3.06Å
586	R	87.6	Confident	78.8	Confident	141 Å²	141	76.5 Å²	76.5	53%	0.532	41%	0.411	S	S	.	.	H	α-helix	trans	-60.8	-37	178.3	-72.2	178.4	59	-169.4	-5.5	112.5	D582 V583 A590 L602	D582-R586 PolarHBondContact O-N 3.09Å; V583-R586 PolarHBondContact O-N 3.29Å; R586-A590 WeakPolarHBondContact O-CB 3.25Å; R586-A590 PolarHBondContact O-N 3.08Å; R586-L602 HydrophobicContact CB-CD1 3.98Å
587	F	92.8	Very high	81.2	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-70	-38.8	178.2	-176.4	-127.7	0	0	0	112.7	V583 D584 Y585 A590 A591 V599 L602 C603 N607 P620 L636	V583-F587 WeakPolarHBondContact O-CB 3.24Å; V583-F587 PolarHBondContact O-N 2.87Å; D584-F587 PolarHBondContact O-N 2.79Å; Y585-F587 VanDerWaalsContact C-N 3.27Å; Y585-F587 PolarHBondContact O-N 2.81Å; F587-A590 PolarHBondContact O-N 3.03Å; F587-A591 WeakPolarHBondContact O-CB 3.16Å; F587-A591 PolarHBondContact O-N 3.35Å; F587-A591 VanDerWaalsContact O-N 3.07Å; F587-V599 HydrophobicContact CE2-CB 4.31Å; F587-V599 HydrophobicContact CE2-CG1 3.95Å; F587-V599 HydrophobicContact CE2-CG2 4.4Å; F587-V599 WeakPolarHBondContact CE2-O 3.42Å; F587-L602 HydrophobicContact CB-CB 4.24Å; F587-L602 HydrophobicContact CB-CD1 4.31Å; F587-L602 HydrophobicContact CD2-CB 3.75Å; F587-L602 HydrophobicContact CE2-CB 4.5Å; F587-L602 HydrophobicContact CG-CB 4.29Å; F587-C603 HydrophobicContact CE2-CB 3.72Å; F587-C603 HydrophobicContact CZ-CB 3.74Å; F587-N607 WeakPolarHBondContact CE1-O 3.49Å; F587-P620 HydrophobicContact CD1-CG 3.71Å; F587-P620 HydrophobicContact CE1-CB 4.17Å; F587-P620 HydrophobicContact CE1-CG 3.54Å; F587-P620 HydrophobicContact CZ-CG 4.37Å; F587-L636 HydrophobicContact CZ-CD2 3.84Å
588	L	90.9	Very high	83.6	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.058	39%	0.385	C	S	.	.	H	α-helix	trans	-63.2	-46.5	173.8	-71.1	160.1	0	0	0	112	D584 Y585 A591 K592 D612 P620 F623	D584-L588 WeakPolarHBondContact O-CD1 3.13Å; D584-L588 VanDerWaalsContact O-CG 3.22Å; D584-L588 WeakPolarHBondContact O-CG 3.26Å; D584-L588 PolarHBondContact O-N 3.31Å; Y585-L588 PolarHBondContact O-N 3.18Å; L588-A591 PolarHBondContact O-N 2.8Å; L588-K592 WeakPolarHBondContact O-CB 3.26Å; L588-K592 PolarHBondContact O-N 3.04Å; L588-K592 VanDerWaalsContact O-N 3.08Å; L588-D612 HydrophobicContact CD1-CB 4.14Å; L588-P620 HydrophobicContact CD2-CG 3.8Å; L588-P620 HydrophobicContact CG-CG 4.48Å; L588-F623 HydrophobicContact CD2-CD2 3.98Å; L588-F623 HydrophobicContact CD2-CE2 3.95Å
589	E	90.9	Very high	86.1	Confident	70 Å²	70	66.3 Å²	66.3	33%	0.327	34%	0.342	S	S	.	.	H	α-helix	trans	-66.8	-37.9	177.1	-78.3	-61.2	126.9	0	0	112.4	Y585 A591 K592 A593	Y585-E589 HydrophobicContact CE1-CG 4.27Å; Y585-E589 PolarHBondContact O-N 3.06Å; E589-A591 PolarHBondContact O-N 3.43Å; E589-K592 WeakPolarHBondContact O-CB 3.32Å; E589-K592 PolarHBondContact O-N 2.82Å; E589-K592 WeakPolarHBondContact OE1-CD 3.39Å; E589-K592 IonicContact OE1-NZ 2.62Å; E589-K592 PolarHBondContact OE1-NZ 2.72Å; E589-K592 IonicContact OE2-NZ 2.83Å; E589-K592 PolarHBondContact OE2-NZ 2.92Å; E589-A593 VanDerWaalsContact O-CB 3.28Å; E589-A593 WeakPolarHBondContact O-CB 3.5Å; E589-A593 PolarHBondContact O-N 3Å
590	A	93.8	Very high	88.2	Confident	7 Å²	7	61.4 Å²	61.4	6%	0.058	33%	0.328	C	S	.	.	H	α-helix	trans	-60.7	-44.8	174	0	0	0	0	0	111.9	R586 F587 K592 A593 G594 D595 T598 V599	R586-A590 WeakPolarHBondContact O-CB 3.25Å; R586-A590 PolarHBondContact O-N 3.08Å; F587-A590 PolarHBondContact O-N 3.03Å; A590-K592 VanDerWaalsContact C-N 3.32Å; A590-K592 PolarHBondContact O-N 3.19Å; A590-A593 PolarHBondContact O-N 3.45Å; A590-G594 PolarHBondContact O-N 2.68Å; A590-D595 HydrophobicContact CB-CB 4.44Å; A590-D595 PolarHBondContact O-N 3.22Å; A590-T598 HydrophobicContact CB-CG2 3.66Å; A590-V599 HydrophobicContact CB-CG2 3.91Å
591	A	95.9	Very high	90	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-32.9	178.3	0	0	0	0	0	113.5	F587 L588 E589 V599 P620 V632 L636	F587-A591 WeakPolarHBondContact O-CB 3.16Å; F587-A591 PolarHBondContact O-N 3.35Å; F587-A591 VanDerWaalsContact O-N 3.07Å; L588-A591 PolarHBondContact O-N 2.8Å; E589-A591 PolarHBondContact O-N 3.43Å; A591-V599 HydrophobicContact CB-CG2 4.09Å; A591-P620 HydrophobicContact CB-CB 3.69Å; A591-V632 HydrophobicContact CB-CG1 4.12Å; A591-L636 HydrophobicContact CB-CD1 4.42Å
592	K	94.8	Very high	91	Very high	53 Å²	53	59.6 Å²	59.6	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-72	-44.2	173.4	-180	-175.7	162	-149.8	0	112.3	L588 E589 A590 G594 F623 Y627 R629	L588-K592 WeakPolarHBondContact O-CB 3.26Å; L588-K592 PolarHBondContact O-N 3.04Å; L588-K592 VanDerWaalsContact O-N 3.08Å; E589-K592 WeakPolarHBondContact O-CB 3.32Å; E589-K592 PolarHBondContact O-N 2.82Å; E589-K592 WeakPolarHBondContact OE1-CD 3.39Å; E589-K592 IonicContact OE1-NZ 2.62Å; E589-K592 PolarHBondContact OE1-NZ 2.72Å; E589-K592 IonicContact OE2-NZ 2.83Å; E589-K592 PolarHBondContact OE2-NZ 2.92Å; A590-K592 VanDerWaalsContact C-N 3.32Å; A590-K592 PolarHBondContact O-N 3.19Å; K592-G594 PolarHBondContact O-N 3.5Å; K592-F623 HydrophobicContact CB-CB 3.82Å; K592-F623 HydrophobicContact CB-CD1 4.15Å; K592-F623 HydrophobicContact CB-CG 4.12Å; K592-F623 HydrophobicContact CD-CD1 3.92Å; K592-F623 HydrophobicContact CD-CE1 4.19Å; K592-F623 HydrophobicContact CG-CB 4.4Å; K592-F623 HydrophobicContact CG-CD1 3.98Å; K592-F623 HydrophobicContact CG-CG 4.45Å; K592-Y627 HydrophobicContact CG-CD2 4.02Å; K592-Y627 HydrophobicContact CG-CE1 4.48Å; K592-Y627 HydrophobicContact CG-CE2 3.89Å; K592-Y627 HydrophobicContact CG-CG 4.39Å; K592-R629 PolarHBondContact O-NE 3.49Å; K592-R629 PolarHBondContact O-NH2 3.34Å
593	A	91.8	Very high	91.8	Very high	62 Å²	62	55.6 Å²	55.6	51%	0.512	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-31.7	175.7	0	0	0	0	0	112	E589 A590 R629	E589-A593 VanDerWaalsContact O-CB 3.28Å; E589-A593 WeakPolarHBondContact O-CB 3.5Å; E589-A593 PolarHBondContact O-N 3Å; A590-A593 PolarHBondContact O-N 3.45Å; A593-R629 PolarHBondContact O-NE 3.3Å; A593-R629 PolarHBondContact O-NH2 3.45Å; A593-R629 VanDerWaalsContact O-NH2 3.11Å
594	G	94.1	Very high	92	Very high	29 Å²	29	54 Å²	54	30%	0.299	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	16.5	-172.3	0	0	0	0	0	113.2	A590 K592 L596	A590-G594 PolarHBondContact O-N 2.68Å; K592-G594 PolarHBondContact O-N 3.5Å; G594-L596 PolarHBondContact O-N 2.82Å
595	D	95.3	Very high	91.8	Very high	63 Å²	63	58.3 Å²	58.3	34%	0.337	31%	0.308	S	S	.	.			trans	-75.8	89.9	177.6	-179.8	-7.6	0	0	0	109.5	A590 D597 T598 V599	A590-D595 HydrophobicContact CB-CB 4.44Å; A590-D595 PolarHBondContact O-N 3.22Å; D595-D597 VanDerWaalsContact C-N 3.3Å; D595-D597 PolarHBondContact O-N 2.87Å; D595-D597 PolarHBondContact OD1-N 2.86Å; D595-T598 VanDerWaalsContact CG-CB 3.44Å; D595-T598 VanDerWaalsContact CG-OG1 3.26Å; D595-T598 PolarHBondContact OD1-N 3.3Å; D595-T598 PolarHBondContact OD1-OG1 3.28Å; D595-T598 WeakPolarHBondContact OD2-CB 3.25Å; D595-T598 PolarHBondContact OD2-OG1 3.26Å; D595-V599 WeakPolarHBondContact O-CB 3.3Å; D595-V599 VanDerWaalsContact O-CG2 3.24Å; D595-V599 WeakPolarHBondContact O-CG2 3.43Å; D595-V599 PolarHBondContact O-N 3.34Å
596	L	95.6	Very high	91.4	Very high	48 Å²	48	59.4 Å²	59.4	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-34.6	-178.2	-177.7	62	0	0	0	112.1	G594 V599 Q600 A631 V632 Y635	G594-L596 PolarHBondContact O-N 2.82Å; L596-V599 PolarHBondContact O-N 3.43Å; L596-Q600 HydrophobicContact CD1-CG 4.29Å; L596-Q600 HydrophobicContact CG-CG 4.4Å; L596-Q600 WeakPolarHBondContact O-CB 3.29Å; L596-Q600 VanDerWaalsContact O-CG 3.24Å; L596-Q600 WeakPolarHBondContact O-CG 3.39Å; L596-Q600 PolarHBondContact O-N 3.14Å; L596-A631 HydrophobicContact CD2-CB 4.22Å; L596-V632 HydrophobicContact CB-CG2 4.2Å; L596-V632 HydrophobicContact CD1-CG2 4.14Å; L596-Y635 HydrophobicContact CD1-CD1 4.4Å; L596-Y635 HydrophobicContact CD1-CD2 4.41Å; L596-Y635 HydrophobicContact CD1-CG 3.92Å
597	D	94.8	Very high	91.4	Very high	108 Å²	108	53.1 Å²	53.1	58%	0.578	29%	0.294	S	S	*	.	H	α-helix	trans	-68.7	-45.1	-178.1	-64.6	-40	0	0	0	110.7	D595 Q600 Q601	D595-D597 VanDerWaalsContact C-N 3.3Å; D595-D597 PolarHBondContact O-N 2.87Å; D595-D597 PolarHBondContact OD1-N 2.86Å; D597-Q600 PolarHBondContact O-N 3.14Å; D597-Q601 WeakPolarHBondContact O-CG 3.34Å; D597-Q601 PolarHBondContact O-N 3.01Å
598	T	92.2	Very high	91.3	Very high	36 Å²	36	53.4 Å²	53.4	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-36.9	174	-62.4	0	0	0	0	111.8	A590 D595 Q601 L602	A590-T598 HydrophobicContact CB-CG2 3.66Å; D595-T598 VanDerWaalsContact CG-CB 3.44Å; D595-T598 VanDerWaalsContact CG-OG1 3.26Å; D595-T598 PolarHBondContact OD1-N 3.3Å; D595-T598 PolarHBondContact OD1-OG1 3.28Å; D595-T598 WeakPolarHBondContact OD2-CB 3.25Å; D595-T598 PolarHBondContact OD2-OG1 3.26Å; T598-Q601 PolarHBondContact O-N 2.92Å; T598-L602 HydrophobicContact CG2-CD1 3.69Å; T598-L602 HydrophobicContact CG2-CG 4.18Å; T598-L602 WeakPolarHBondContact O-CB 3.17Å; T598-L602 WeakPolarHBondContact O-CG 3.36Å; T598-L602 PolarHBondContact O-N 3.22Å
599	V	95.6	Very high	91.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-45.9	172.3	163.9	0	0	0	0	110.8	F587 A590 A591 D595 L596 Q601 L602 C603 V632 Y635 L636	F587-V599 HydrophobicContact CE2-CB 4.31Å; F587-V599 HydrophobicContact CE2-CG1 3.95Å; F587-V599 HydrophobicContact CE2-CG2 4.4Å; F587-V599 WeakPolarHBondContact CE2-O 3.42Å; A590-V599 HydrophobicContact CB-CG2 3.91Å; A591-V599 HydrophobicContact CB-CG2 4.09Å; D595-V599 WeakPolarHBondContact O-CB 3.3Å; D595-V599 VanDerWaalsContact O-CG2 3.24Å; D595-V599 WeakPolarHBondContact O-CG2 3.43Å; D595-V599 PolarHBondContact O-N 3.34Å; L596-V599 PolarHBondContact O-N 3.43Å; V599-Q601 VanDerWaalsContact C-N 3.34Å; V599-Q601 PolarHBondContact O-N 2.92Å; V599-L602 PolarHBondContact O-N 3.21Å; V599-C603 WeakPolarHBondContact O-CB 3.41Å; V599-C603 PolarHBondContact O-N 2.9Å; V599-V632 HydrophobicContact CG1-CG1 4.33Å; V599-V632 HydrophobicContact CG2-CG1 4.14Å; V599-Y635 HydrophobicContact CG1-CD1 3.71Å; V599-Y635 HydrophobicContact CG1-CE1 3.99Å; V599-L636 HydrophobicContact CG1-CD2 4.23Å
600	Q	94.7	Very high	91.2	Very high	89 Å²	89	52 Å²	52	42%	0.416	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-38.3	177.5	-76.7	177.9	12.5	0	0	112.7	L596 D597 Y635	L596-Q600 HydrophobicContact CD1-CG 4.29Å; L596-Q600 HydrophobicContact CG-CG 4.4Å; L596-Q600 WeakPolarHBondContact O-CB 3.29Å; L596-Q600 VanDerWaalsContact O-CG 3.24Å; L596-Q600 WeakPolarHBondContact O-CG 3.39Å; L596-Q600 PolarHBondContact O-N 3.14Å; D597-Q600 PolarHBondContact O-N 3.14Å; Q600-Y635 HydrophobicContact CG-CD1 4.46Å; Q600-Y635 HydrophobicContact CG-CD2 4.03Å; Q600-Y635 HydrophobicContact CG-CE1 4.04Å; Q600-Y635 HydrophobicContact CG-CE2 3.56Å; Q600-Y635 HydrophobicContact CG-CG 4.46Å
601	Q	92.5	Very high	90.9	Very high	158 Å²	158	55.5 Å²	55.5	74%	0.738	30%	0.303	S	S	*	.	H	α-helix	trans	-71.8	-32.6	178.7	-71.9	174.6	26.7	0	0	113.8	D597 T598 V599	D597-Q601 WeakPolarHBondContact O-CG 3.34Å; D597-Q601 PolarHBondContact O-N 3.01Å; T598-Q601 PolarHBondContact O-N 2.92Å; V599-Q601 VanDerWaalsContact C-N 3.34Å; V599-Q601 PolarHBondContact O-N 2.92Å
602	L	90.1	Very high	90.4	Very high	36 Å²	36	57.2 Å²	57.2	19%	0.188	31%	0.312	C	S	.	.	H	α-helix	trans	-100.4	-14.1	-174.5	-62.7	-178	0	0	0	114.3	R586 F587 T598 V599 S604 N607	R586-L602 HydrophobicContact CB-CD1 3.98Å; F587-L602 HydrophobicContact CB-CB 4.24Å; F587-L602 HydrophobicContact CB-CD1 4.31Å; F587-L602 HydrophobicContact CD2-CB 3.75Å; F587-L602 HydrophobicContact CE2-CB 4.5Å; F587-L602 HydrophobicContact CG-CB 4.29Å; T598-L602 HydrophobicContact CG2-CD1 3.69Å; T598-L602 HydrophobicContact CG2-CG 4.18Å; T598-L602 WeakPolarHBondContact O-CB 3.17Å; T598-L602 WeakPolarHBondContact O-CG 3.36Å; T598-L602 PolarHBondContact O-N 3.22Å; V599-L602 PolarHBondContact O-N 3.21Å; L602-S604 PolarHBondContact O-N 3.07Å; L602-N607 PolarHBondContact O-ND2 3.37Å; L602-N607 PolarHBondContact O-OD1 3.16Å
603	C	91.5	Very high	89.7	Confident	25 Å²	25	60.8 Å²	60.8	17%	0.169	33%	0.333	C	S	.	.			trans	-70.7	126.4	-178	-174.5	0	0	0	0	112	F587 V599 Y635	F587-C603 HydrophobicContact CE2-CB 3.72Å; F587-C603 HydrophobicContact CZ-CB 3.74Å; V599-C603 WeakPolarHBondContact O-CB 3.41Å; V599-C603 PolarHBondContact O-N 2.9Å; C603-Y635 HydrophobicContact CB-CE1 4.03Å
604	S	86.9	Confident	88.9	Confident	33 Å²	33	66.8 Å²	66.8	23%	0.231	35%	0.35	C	S	.	.			trans	-137.1	159.5	174.2	75.5	0	0	0	0	110.6	L602 Q606 N607 V608	L602-S604 PolarHBondContact O-N 3.07Å; S604-Q606 PolarHBondContact O-N 3.34Å; S604-Q606 PolarHBondContact OG-N 3.24Å; S604-N607 WeakPolarHBondContact CA-OD1 3.42Å; S604-N607 WeakPolarHBondContact CB-OD1 3.49Å; S604-N607 PolarHBondContact N-OD1 3.23Å; S604-N607 PolarHBondContact O-N 3.23Å; S604-N607 PolarHBondContact O-OD1 3.46Å; S604-N607 VanDerWaalsContact O-OD1 3.1Å; S604-N607 VanDerWaalsContact OG-CG 3.26Å; S604-N607 PolarHBondContact OG-N 3.16Å; S604-N607 PolarHBondContact OG-OD1 3.04Å; S604-V608 WeakPolarHBondContact O-CB 3.22Å; S604-V608 PolarHBondContact O-N 3.37Å
605	P	80.9	Confident	88.3	Confident	120 Å²	120	66.9 Å²	66.9	78%	0.779	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.7	174.2	-25.1	35.2	0	0	0	114.4
606	Q	77.1	Confident	87.7	Confident	158 Å²	158	69 Å²	69	74%	0.738	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-27.7	-179.5	-64.5	115.8	26.4	0	0	113.7	S604	S604-Q606 PolarHBondContact O-N 3.34Å; S604-Q606 PolarHBondContact OG-N 3.24Å
607	N	87.3	Confident	87.4	Confident	10 Å²	10	69.8 Å²	69.8	5%	0.053	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-4.8	-176.3	73.6	-13.1	0	0	0	115.2	D584 F587 L602 S604 N609 C610	D584-N607 VanDerWaalsContact OD1-CB 3.25Å; D584-N607 WeakPolarHBondContact OD1-CB 3.31Å; F587-N607 WeakPolarHBondContact CE1-O 3.49Å; L602-N607 PolarHBondContact O-ND2 3.37Å; L602-N607 PolarHBondContact O-OD1 3.16Å; S604-N607 WeakPolarHBondContact CA-OD1 3.42Å; S604-N607 WeakPolarHBondContact CB-OD1 3.49Å; S604-N607 PolarHBondContact N-OD1 3.23Å; S604-N607 PolarHBondContact O-N 3.23Å; S604-N607 PolarHBondContact O-OD1 3.46Å; S604-N607 VanDerWaalsContact O-OD1 3.1Å; S604-N607 VanDerWaalsContact OG-CG 3.26Å; S604-N607 PolarHBondContact OG-N 3.16Å; S604-N607 PolarHBondContact OG-OD1 3.04Å; N607-N609 PolarHBondContact O-N 3.44Å; N607-C610 HydrophobicContact CB-CB 4.28Å; N607-C610 VanDerWaalsContact O-CB 3.22Å; N607-C610 WeakPolarHBondContact O-CB 3.32Å; N607-C610 PolarHBondContact O-N 2.93Å; N607-C610 PolarHBondContact O-SG 3.33Å; N607-C610 VanDerWaalsContact O-SG 3.32Å
608	V	90.4	Very high	87.3	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.03	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-29	176.4	67.5	0	0	0	0	113.3	S604 L636 A641	S604-V608 WeakPolarHBondContact O-CB 3.22Å; S604-V608 PolarHBondContact O-N 3.37Å; V608-L636 HydrophobicContact CG2-CD2 4.18Å; V608-A641 HydrophobicContact CG2-CB 3.95Å
609	N	92	Very high	87.4	Confident	50 Å²	50	63 Å²	63	27%	0.267	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	31	174.7	-66.8	-55	0	0	0	113.3	N607 G640 A641 D642	N607-N609 PolarHBondContact O-N 3.44Å; N609-G640 PolarHBondContact ND2-O 2.85Å; N609-A641 WeakPolarHBondContact OD1-CA 3.35Å; N609-D642 PolarHBondContact ND2-N 2.84Å; N609-D642 PolarHBondContact OD1-N 3.46Å
610	C	89.1	Confident	87.5	Confident	2 Å²	2	63 Å²	63	1%	0.014	32%	0.32	C	S	.	.			trans	-58.5	167.6	170.9	70.5	0	0	0	0	111.5	D584 N607 T619 P620	D584-C610 HydrophobicContact CB-CB 3.87Å; D584-C610 VanDerWaalsContact OD2-CB 3.23Å; D584-C610 WeakPolarHBondContact OD2-CB 3.44Å; N607-C610 HydrophobicContact CB-CB 4.28Å; N607-C610 VanDerWaalsContact O-CB 3.22Å; N607-C610 WeakPolarHBondContact O-CB 3.32Å; N607-C610 PolarHBondContact O-N 2.93Å; N607-C610 PolarHBondContact O-SG 3.33Å; N607-C610 VanDerWaalsContact O-SG 3.32Å; C610-T619 WeakPolarHBondContact O-CA 3.24Å; C610-P620 VanDerWaalsContact SG-CG 3.59Å
611	R	87.6	Confident	87.6	Confident	80 Å²	80	58.8 Å²	58.8	30%	0.302	30%	0.3	S	S	.	.			trans	-131.5	132.4	-168.7	-60.8	-64.2	-178.3	140.7	3.6	110.8	L613 H617 K646	R611-L613 VanDerWaalsContact C-N 3.32Å; R611-L613 HydrophobicContact CB-CD2 4.07Å; R611-L613 PolarHBondContact O-N 3.03Å; R611-H617 VanDerWaalsContact CD-O 3.25Å; R611-H617 WeakPolarHBondContact CD-O 3.17Å; R611-H617 PolarHBondContact NH1-O 3.36Å; R611-K646 PolarHBondContact NH1-O 2.77Å
612	D	85.4	Confident	87.9	Confident	37 Å²	37	51.3 Å²	51.3	20%	0.198	27%	0.265	C	S	.	.			trans	-64.9	88.6	163.7	163.5	31.8	0	0	0	109.9	L588 E614 G615 R616 H617 S618 F623	L588-D612 HydrophobicContact CD1-CB 4.14Å; D612-E614 VanDerWaalsContact C-N 3.3Å; D612-E614 PolarHBondContact O-N 3.01Å; D612-G615 WeakPolarHBondContact OD1-CA 3.47Å; D612-G615 PolarHBondContact OD1-N 3.43Å; D612-G615 WeakPolarHBondContact OD2-CA 3.49Å; D612-R616 PolarHBondContact OD2-N 3.2Å; D612-H617 WeakPolarHBondContact O-CA 3.28Å; D612-H617 PolarHBondContact O-CD2 3.28Å; D612-H617 PolarHBondContact O-N 3.09Å; D612-S618 PolarHBondContact N-O 3.42Å; D612-F623 HydrophobicContact CB-CE2 4.05Å; D612-F623 HydrophobicContact CB-CZ 4.25Å
613	L	78.8	Confident	88.2	Confident	128 Å²	128	51.2 Å²	51.2	67%	0.67	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-24.1	-176.2	-62.9	-179.8	0	0	0	113.3	R611	R611-L613 VanDerWaalsContact C-N 3.32Å; R611-L613 HydrophobicContact CB-CD2 4.07Å; R611-L613 PolarHBondContact O-N 3.03Å
614	E	74.3	Confident	88.5	Confident	187 Å²	187	50 Å²	50	87%	0.874	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-30	-177.6	-62.6	-173.9	169.5	0	0	112.2	D612	D612-E614 VanDerWaalsContact C-N 3.3Å; D612-E614 PolarHBondContact O-N 3.01Å
615	G	82.2	Confident	89	Confident	31 Å²	31	48.4 Å²	48.4	32%	0.32	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-115.5	176.5	0	0	0	0	0	114	D612	D612-G615 WeakPolarHBondContact OD1-CA 3.47Å; D612-G615 PolarHBondContact OD1-N 3.43Å; D612-G615 WeakPolarHBondContact OD2-CA 3.49Å
616	R	83.9	Confident	89.6	Confident	107 Å²	107	43.1 Å²	43.1	40%	0.404	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	13.3	-168.2	-62.9	-162	-56.3	124.8	10.7	114.2	D612 S618 D647 K648	D612-R616 PolarHBondContact OD2-N 3.2Å; R616-S618 PolarHBondContact O-N 3.02Å; R616-S618 VanDerWaalsContact O-N 3.16Å; R616-D647 IonicContact CZ-OD2 2.87Å; R616-D647 IonicContact NH1-OD2 3.71Å; R616-D647 PolarHBondContact NH1-OD2 2.82Å; R616-D647 IonicContact NH2-OD2 3.89Å; R616-D647 PolarHBondContact NH2-OD2 3.24Å; R616-D647 WeakPolarHBondContact O-CB 3.41Å; R616-K648 WeakPolarHBondContact O-CB 3.35Å; R616-K648 PolarHBondContact O-N 2.92Å
617	H	87.9	Confident	90.5	Very high	66 Å²	66	41.1 Å²	41.1	31%	0.306	20%	0.197	S	C	.	.			trans	54.6	29.5	-171.3	-56.5	-170.8	0	0	0	112.1	R611 D612 K648	R611-H617 VanDerWaalsContact CD-O 3.25Å; R611-H617 WeakPolarHBondContact CD-O 3.17Å; R611-H617 PolarHBondContact NH1-O 3.36Å; D612-H617 WeakPolarHBondContact O-CA 3.28Å; D612-H617 PolarHBondContact O-CD2 3.28Å; D612-H617 PolarHBondContact O-N 3.09Å; H617-K648 HydrophobicContact CB-CB 4.39Å
618	S	92.6	Very high	90.9	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.014	21%	0.212	C	C	.	.			trans	-69.1	144.6	175	-69.2	0	0	0	0	110.3	D612 R616	D612-S618 PolarHBondContact N-O 3.42Å; R616-S618 PolarHBondContact O-N 3.02Å; R616-S618 VanDerWaalsContact O-N 3.16Å
619	T	95.7	Very high	91.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.227	C	C	.	.			trans	-89.2	166.8	173	67.6	0	0	0	0	111.1	C610 L621 H622 F623 A645	C610-T619 WeakPolarHBondContact O-CA 3.24Å; T619-L621 PolarHBondContact O-N 3.02Å; T619-L621 VanDerWaalsContact O-N 3.15Å; T619-H622 PolarHBondContact N-ND1 2.87Å; T619-H622 WeakPolarHBondContact O-CB 3.14Å; T619-H622 PolarHBondContact O-N 2.9Å; T619-H622 PolarHBondContact OG1-ND1 3.31Å; T619-F623 WeakPolarHBondContact O-CD2 3.47Å; T619-F623 PolarHBondContact O-N 3.35Å; T619-A645 HydrophobicContact CG2-CB 3.83Å
620	P	96.3	Very high	91.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-50.9	-38.3	172.5	-29	37.1	0	0	0	112.7	F587 L588 A591 C610 H622 F623 A624 L636	F587-P620 HydrophobicContact CD1-CG 3.71Å; F587-P620 HydrophobicContact CE1-CB 4.17Å; F587-P620 HydrophobicContact CE1-CG 3.54Å; F587-P620 HydrophobicContact CZ-CG 4.37Å; L588-P620 HydrophobicContact CD2-CG 3.8Å; L588-P620 HydrophobicContact CG-CG 4.48Å; A591-P620 HydrophobicContact CB-CB 3.69Å; C610-P620 VanDerWaalsContact SG-CG 3.59Å; P620-H622 PolarHBondContact O-N 3.11Å; P620-F623 PolarHBondContact O-N 3.39Å; P620-A624 WeakPolarHBondContact O-CB 3.06Å; P620-A624 PolarHBondContact O-N 2.65Å; P620-L636 HydrophobicContact CB-CD1 3.86Å; P620-L636 HydrophobicContact CB-CD2 4.27Å
621	L	97.5	Very high	91.9	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-32.6	177.2	-172.4	62.4	0	0	0	113.2	T619 A625 V633 L636 L637 A641 P653 L669	T619-L621 PolarHBondContact O-N 3.02Å; T619-L621 VanDerWaalsContact O-N 3.15Å; L621-A625 WeakPolarHBondContact O-CB 3.49Å; L621-A625 PolarHBondContact O-N 2.95Å; L621-V633 HydrophobicContact CD1-CB 4.42Å; L621-V633 HydrophobicContact CD1-CG1 4.02Å; L621-V633 HydrophobicContact CD1-CG2 4.42Å; L621-L636 HydrophobicContact CB-CD1 4.42Å; L621-L636 HydrophobicContact CD1-CB 4.32Å; L621-L637 HydrophobicContact CD1-CD2 4.3Å; L621-L637 HydrophobicContact CD1-CG 4.13Å; L621-L637 HydrophobicContact CD2-CD2 3.81Å; L621-A641 HydrophobicContact CB-CB 4.18Å; L621-A641 HydrophobicContact CD2-CB 3.94Å; L621-A641 HydrophobicContact CG-CB 4.49Å; L621-P653 HydrophobicContact CB-CG 4.25Å; L621-P653 HydrophobicContact CD2-CB 4.45Å; L621-P653 HydrophobicContact CD2-CG 3.97Å; L621-P653 HydrophobicContact CG-CB 4.06Å; L621-P653 HydrophobicContact CG-CG 3.84Å; L621-L669 HydrophobicContact CD1-CD2 4.23Å; L621-L669 HydrophobicContact CD2-CD2 4.26Å; L621-L669 HydrophobicContact CG-CD2 4.37Å
622	H	97.7	Very high	92.3	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-40.8	173.9	-73.6	79.1	0	0	0	112	T619 P620 G626 A645 L651 N656	T619-H622 PolarHBondContact N-ND1 2.87Å; T619-H622 WeakPolarHBondContact O-CB 3.14Å; T619-H622 PolarHBondContact O-N 2.9Å; T619-H622 PolarHBondContact OG1-ND1 3.31Å; P620-H622 PolarHBondContact O-N 3.11Å; H622-G626 PolarHBondContact O-N 3.48Å; H622-A645 PolarHBondContact CE1-O 3.3Å; H622-A645 PolarHBondContact NE2-O 3.49Å; H622-L651 PolarHBondContact NE2-O 2.92Å; H622-N656 PolarHBondContact O-ND2 2.87Å
623	F	96.7	Very high	92.9	Very high	33 Å²	33	44.3 Å²	44.3	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-69.9	-52	177.4	-73.7	-69.9	0	0	0	110.6	L588 K592 D612 T619 P620 A625 G626 Y627	L588-F623 HydrophobicContact CD2-CD2 3.98Å; L588-F623 HydrophobicContact CD2-CE2 3.95Å; K592-F623 HydrophobicContact CB-CB 3.82Å; K592-F623 HydrophobicContact CB-CD1 4.15Å; K592-F623 HydrophobicContact CB-CG 4.12Å; K592-F623 HydrophobicContact CD-CD1 3.92Å; K592-F623 HydrophobicContact CD-CE1 4.19Å; K592-F623 HydrophobicContact CG-CB 4.4Å; K592-F623 HydrophobicContact CG-CD1 3.98Å; K592-F623 HydrophobicContact CG-CG 4.45Å; D612-F623 HydrophobicContact CB-CE2 4.05Å; D612-F623 HydrophobicContact CB-CZ 4.25Å; T619-F623 WeakPolarHBondContact O-CD2 3.47Å; T619-F623 PolarHBondContact O-N 3.35Å; P620-F623 PolarHBondContact O-N 3.39Å; F623-A625 PolarHBondContact O-N 3.37Å; F623-G626 PolarHBondContact O-N 3.23Å; F623-G626 VanDerWaalsContact O-N 3.09Å; F623-Y627 HydrophobicContact CD1-CE2 4.09Å; F623-Y627 WeakPolarHBondContact O-CD2 3.16Å; F623-Y627 PolarHBondContact O-N 3.14Å
624	A	97.6	Very high	93.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-54.7	-41.4	176.9	0	0	0	0	0	111.7	P620 N628 R629 V632 V633 L636	P620-A624 WeakPolarHBondContact O-CB 3.06Å; P620-A624 PolarHBondContact O-N 2.65Å; A624-N628 PolarHBondContact O-N 3.25Å; A624-R629 HydrophobicContact CB-CB 4.11Å; A624-R629 PolarHBondContact O-N 2.86Å; A624-V632 HydrophobicContact CB-CB 4.26Å; A624-V632 HydrophobicContact CB-CG1 3.7Å; A624-V633 VanDerWaalsContact C-CG2 3.49Å; A624-V633 HydrophobicContact CB-CG2 3.6Å; A624-L636 HydrophobicContact CB-CD1 4.11Å
625	A	97.3	Very high	94.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69.8	-38.8	176.9	0	0	0	0	0	113.9	L621 F623 V633 P653 H662 V665 L669	L621-A625 WeakPolarHBondContact O-CB 3.49Å; L621-A625 PolarHBondContact O-N 2.95Å; F623-A625 PolarHBondContact O-N 3.37Å; A625-V633 HydrophobicContact CB-CG2 4.48Å; A625-P653 HydrophobicContact CB-CB 3.92Å; A625-H662 PolarHBondContact O-CD2 3.46Å; A625-H662 VanDerWaalsContact O-CD2 3.26Å; A625-V665 HydrophobicContact CB-CG1 3.75Å; A625-L669 HydrophobicContact CB-CD1 4.02Å
626	G	94.8	Very high	95.6	Very high	8 Å²	8	34.2 Å²	34.2	8%	0.082	16%	0.161	C	C	.	.	H	α-helix	trans	-74.8	-25.1	179.9	0	0	0	0	0	114.8	H622 F623 H662	H622-G626 PolarHBondContact O-N 3.48Å; F623-G626 PolarHBondContact O-N 3.23Å; F623-G626 VanDerWaalsContact O-N 3.09Å; G626-H662 PolarHBondContact O-CD2 2.92Å; G626-H662 PolarHBondContact O-NE2 3.17Å
627	Y	95	Very high	96.2	Very high	117 Å²	117	30 Å²	30	46%	0.459	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	16.8	-177.8	-71.6	-97	0	0	0	113.6	K592 F623 R629	K592-Y627 HydrophobicContact CG-CD2 4.02Å; K592-Y627 HydrophobicContact CG-CE1 4.48Å; K592-Y627 HydrophobicContact CG-CE2 3.89Å; K592-Y627 HydrophobicContact CG-CG 4.39Å; F623-Y627 HydrophobicContact CD1-CE2 4.09Å; F623-Y627 WeakPolarHBondContact O-CD2 3.16Å; F623-Y627 PolarHBondContact O-N 3.14Å; Y627-R629 VanDerWaalsContact O-CD 3.28Å; Y627-R629 WeakPolarHBondContact O-CD 3.43Å; Y627-R629 PolarHBondContact O-N 2.89Å; Y627-R629 PolarHBondContact O-NE 2.8Å
628	N	96.3	Very high	96.6	Very high	68 Å²	68	32.8 Å²	32.8	36%	0.364	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	43.2	179.5	-158.5	34.5	0	0	0	115	A624 V630 H662 V665	A624-N628 PolarHBondContact O-N 3.25Å; N628-V630 VanDerWaalsContact C-N 3.34Å; N628-V630 PolarHBondContact O-N 2.82Å; N628-H662 HydrophobicContact CB-CB 4.4Å; N628-V665 WeakPolarHBondContact OD1-CG2 3.42Å
629	R	97.4	Very high	96.7	Very high	89 Å²	89	37.1 Å²	37.1	34%	0.336	18%	0.179	S	C	.	.			trans	-91.8	63.9	-177.3	-50.6	-50.3	-171	-168.6	5.8	111.2	K592 A593 A624 Y627 A631 V632 V633	K592-R629 PolarHBondContact O-NE 3.49Å; K592-R629 PolarHBondContact O-NH2 3.34Å; A593-R629 PolarHBondContact O-NE 3.3Å; A593-R629 PolarHBondContact O-NH2 3.45Å; A593-R629 VanDerWaalsContact O-NH2 3.11Å; A624-R629 HydrophobicContact CB-CB 4.11Å; A624-R629 PolarHBondContact O-N 2.86Å; Y627-R629 VanDerWaalsContact O-CD 3.28Å; Y627-R629 WeakPolarHBondContact O-CD 3.43Å; Y627-R629 PolarHBondContact O-N 2.89Å; Y627-R629 PolarHBondContact O-NE 2.8Å; R629-A631 PolarHBondContact O-N 2.73Å; R629-V632 HydrophobicContact CB-CB 3.94Å; R629-V632 HydrophobicContact CB-CG2 4.35Å; R629-V632 CarbonylContact O-C 3.59Å; R629-V632 WeakPolarHBondContact O-CA 3.46Å; R629-V632 PolarHBondContact O-N 2.72Å; R629-V633 WeakPolarHBondContact O-CG2 3.48Å; R629-V633 PolarHBondContact O-N 3.43Å
630	V	96.9	Very high	96.4	Very high	39 Å²	39	39.4 Å²	39.4	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-44.6	-54.2	-171.8	-179.2	0	0	0	0	113.1	N628 V632 V633 E634 E664 V665 L668	N628-V630 VanDerWaalsContact C-N 3.34Å; N628-V630 PolarHBondContact O-N 2.82Å; V630-V632 VanDerWaalsContact C-N 3.33Å; V630-V632 PolarHBondContact O-N 2.81Å; V630-V633 WeakPolarHBondContact O-CB 3.32Å; V630-V633 PolarHBondContact O-N 3.14Å; V630-E634 PolarHBondContact O-N 2.81Å; V630-E664 HydrophobicContact CG2-CB 4.36Å; V630-V665 HydrophobicContact CG2-CG2 3.94Å; V630-L668 HydrophobicContact CG1-CD1 3.71Å
631	A	97.1	Very high	96.4	Very high	52 Å²	52	39.9 Å²	39.9	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-64.6	-32.6	-179.2	0	0	0	0	0	113.9	L596 R629 Y635	L596-A631 HydrophobicContact CD2-CB 4.22Å; R629-A631 PolarHBondContact O-N 2.73Å; A631-Y635 WeakPolarHBondContact O-CB 3.3Å; A631-Y635 PolarHBondContact O-N 3.41Å
632	V	97.8	Very high	96.1	Very high	2 Å²	2	43 Å²	43	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-74.6	-40	174.5	172.6	0	0	0	0	110.9	A591 L596 V599 A624 R629 V630 Y635 L636	A591-V632 HydrophobicContact CB-CG1 4.12Å; L596-V632 HydrophobicContact CB-CG2 4.2Å; L596-V632 HydrophobicContact CD1-CG2 4.14Å; V599-V632 HydrophobicContact CG1-CG1 4.33Å; V599-V632 HydrophobicContact CG2-CG1 4.14Å; A624-V632 HydrophobicContact CB-CB 4.26Å; A624-V632 HydrophobicContact CB-CG1 3.7Å; R629-V632 HydrophobicContact CB-CB 3.94Å; R629-V632 HydrophobicContact CB-CG2 4.35Å; R629-V632 CarbonylContact O-C 3.59Å; R629-V632 WeakPolarHBondContact O-CA 3.46Å; R629-V632 PolarHBondContact O-N 2.72Å; V630-V632 VanDerWaalsContact C-N 3.33Å; V630-V632 PolarHBondContact O-N 2.81Å; V632-Y635 PolarHBondContact O-N 3.21Å; V632-L636 HydrophobicContact CG1-CD1 3.73Å; V632-L636 HydrophobicContact CG1-CG 4.12Å; V632-L636 VanDerWaalsContact O-CB 3.28Å; V632-L636 WeakPolarHBondContact O-CB 3.18Å; V632-L636 WeakPolarHBondContact O-CG 3.29Å; V632-L636 PolarHBondContact O-N 3.29Å
633	V	98	Very high	96	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.5	-49.4	173.7	170.1	0	0	0	0	110	L621 A624 A625 R629 V630 L636 L637 V665 L669	L621-V633 HydrophobicContact CD1-CB 4.42Å; L621-V633 HydrophobicContact CD1-CG1 4.02Å; L621-V633 HydrophobicContact CD1-CG2 4.42Å; A624-V633 VanDerWaalsContact C-CG2 3.49Å; A624-V633 HydrophobicContact CB-CG2 3.6Å; A625-V633 HydrophobicContact CB-CG2 4.48Å; R629-V633 WeakPolarHBondContact O-CG2 3.48Å; R629-V633 PolarHBondContact O-N 3.43Å; V630-V633 WeakPolarHBondContact O-CB 3.32Å; V630-V633 PolarHBondContact O-N 3.14Å; V633-L636 PolarHBondContact O-N 3.32Å; V633-L637 HydrophobicContact CG1-CD1 3.76Å; V633-L637 HydrophobicContact CG1-CG 4.47Å; V633-L637 WeakPolarHBondContact O-CB 3.27Å; V633-L637 WeakPolarHBondContact O-CD1 3.48Å; V633-L637 VanDerWaalsContact O-CG 3.23Å; V633-L637 WeakPolarHBondContact O-CG 3.31Å; V633-L637 PolarHBondContact O-N 3.31Å; V633-V665 HydrophobicContact CG1-CG1 4.47Å; V633-V665 HydrophobicContact CG2-CG1 4.23Å; V633-V665 HydrophobicContact CG2-CG2 4.39Å; V633-L669 HydrophobicContact CG1-CD2 4.36Å
634	E	97.3	Very high	95.8	Very high	91 Å²	91	46.5 Å²	46.5	43%	0.425	24%	0.241	S	C	.	.	H	α-helix	trans	-60.7	-47.7	177.6	-175.9	170.4	-145.3	0	0	111.7	V630 L637 H638	V630-E634 PolarHBondContact O-N 2.81Å; E634-L637 PolarHBondContact O-N 2.87Å; E634-H638 PolarHBondContact O-N 3.5Å; E634-H638 VanDerWaalsContact O-N 3.13Å; E634-H638 PolarHBondContact O-ND1 2.92Å
635	Y	97.4	Very high	95.5	Very high	44 Å²	44	46.6 Å²	46.6	17%	0.173	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-48.5	177.2	-179.4	-93.5	0	0	0	112.4	L596 V599 Q600 C603 A631 V632 L637 H638 H639	L596-Y635 HydrophobicContact CD1-CD1 4.4Å; L596-Y635 HydrophobicContact CD1-CD2 4.41Å; L596-Y635 HydrophobicContact CD1-CG 3.92Å; V599-Y635 HydrophobicContact CG1-CD1 3.71Å; V599-Y635 HydrophobicContact CG1-CE1 3.99Å; Q600-Y635 HydrophobicContact CG-CD1 4.46Å; Q600-Y635 HydrophobicContact CG-CD2 4.03Å; Q600-Y635 HydrophobicContact CG-CE1 4.04Å; Q600-Y635 HydrophobicContact CG-CE2 3.56Å; Q600-Y635 HydrophobicContact CG-CG 4.46Å; C603-Y635 HydrophobicContact CB-CE1 4.03Å; A631-Y635 WeakPolarHBondContact O-CB 3.3Å; A631-Y635 PolarHBondContact O-N 3.41Å; V632-Y635 PolarHBondContact O-N 3.21Å; Y635-L637 PolarHBondContact O-N 2.89Å; Y635-H638 PolarHBondContact O-N 2.89Å; Y635-H639 AromaticContact CD2-CE1 3.56Å; Y635-H639 AromaticContact CD2-ND1 3.71Å; Y635-H639 AromaticContact CE1-ND1 3.83Å; Y635-H639 AromaticContact CE2-CE1 3.06Å; Y635-H639 WeakPolarHBondContact CE2-CE1 3.42Å; Y635-H639 AromaticContact CE2-ND1 3.47Å; Y635-H639 WeakPolarHBondContact CE2-ND1 3.36Å; Y635-H639 AromaticContact CE2-NE2 3.6Å; Y635-H639 AromaticContact CG-ND1 3.98Å; Y635-H639 AromaticContact CZ-CD2 3.88Å; Y635-H639 AromaticContact CZ-CE1 3.41Å; Y635-H639 VanDerWaalsContact CZ-CE1 3.41Å; Y635-H639 AromaticContact CZ-CG 3.83Å; Y635-H639 AromaticContact CZ-ND1 3.52Å; Y635-H639 AromaticContact CZ-NE2 3.63Å; Y635-H639 PolarHBondContact O-N 3.33Å; Y635-H639 VanDerWaalsContact O-N 3.14Å; Y635-H639 PolarHBondContact O-ND1 3.44Å; Y635-H639 PolarHBondContact OH-NE2 3.12Å
636	L	97.3	Very high	95.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-42.9	180	-74.8	174.4	0	0	0	112	F587 A591 V599 V608 P620 L621 A624 V632 V633 H638 H639 G640 A641	F587-L636 HydrophobicContact CZ-CD2 3.84Å; A591-L636 HydrophobicContact CB-CD1 4.42Å; V599-L636 HydrophobicContact CG1-CD2 4.23Å; V608-L636 HydrophobicContact CG2-CD2 4.18Å; P620-L636 HydrophobicContact CB-CD1 3.86Å; P620-L636 HydrophobicContact CB-CD2 4.27Å; L621-L636 HydrophobicContact CB-CD1 4.42Å; L621-L636 HydrophobicContact CD1-CB 4.32Å; A624-L636 HydrophobicContact CB-CD1 4.11Å; V632-L636 HydrophobicContact CG1-CD1 3.73Å; V632-L636 HydrophobicContact CG1-CG 4.12Å; V632-L636 VanDerWaalsContact O-CB 3.28Å; V632-L636 WeakPolarHBondContact O-CB 3.18Å; V632-L636 WeakPolarHBondContact O-CG 3.29Å; V632-L636 PolarHBondContact O-N 3.29Å; V633-L636 PolarHBondContact O-N 3.32Å; L636-H638 VanDerWaalsContact C-N 3.33Å; L636-H638 PolarHBondContact O-N 2.88Å; L636-H639 CarbonylContact O-C 3.54Å; L636-H639 PolarHBondContact O-N 3.25Å; L636-H639 VanDerWaalsContact O-N 3.12Å; L636-G640 PolarHBondContact O-N 3Å; L636-A641 HydrophobicContact CB-CB 3.82Å; L636-A641 WeakPolarHBondContact O-CB 3.48Å; L636-A641 PolarHBondContact O-N 3.17Å
637	L	96.1	Very high	95.1	Very high	19 Å²	19	51.2 Å²	51.2	10%	0.099	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-39.1	177.1	-72.4	168	0	0	0	112	L621 V633 E634 Y635 H639 V643 L669 H672	L621-L637 HydrophobicContact CD1-CD2 4.3Å; L621-L637 HydrophobicContact CD1-CG 4.13Å; L621-L637 HydrophobicContact CD2-CD2 3.81Å; V633-L637 HydrophobicContact CG1-CD1 3.76Å; V633-L637 HydrophobicContact CG1-CG 4.47Å; V633-L637 WeakPolarHBondContact O-CB 3.27Å; V633-L637 WeakPolarHBondContact O-CD1 3.48Å; V633-L637 VanDerWaalsContact O-CG 3.23Å; V633-L637 WeakPolarHBondContact O-CG 3.31Å; V633-L637 PolarHBondContact O-N 3.31Å; E634-L637 PolarHBondContact O-N 2.87Å; Y635-L637 PolarHBondContact O-N 2.89Å; L637-H639 VanDerWaalsContact C-N 3.28Å; L637-H639 PolarHBondContact O-N 2.98Å; L637-V643 HydrophobicContact CD2-CB 4.15Å; L637-V643 HydrophobicContact CD2-CG2 4.16Å; L637-L669 HydrophobicContact CD1-CD2 4.27Å; L637-L669 HydrophobicContact CD2-CD2 4.38Å; L637-H672 HydrophobicContact CD1-CB 4.06Å; L637-H672 HydrophobicContact CD2-CB 4.1Å
638	H	95.4	Very high	94.7	Very high	124 Å²	124	51.3 Å²	51.3	57%	0.574	26%	0.263	S	S	*	.	H	α-helix	trans	-67.7	-25.2	174.3	-75.9	90.4	0	0	0	113.5	E634 Y635 L636	E634-H638 PolarHBondContact O-N 3.5Å; E634-H638 VanDerWaalsContact O-N 3.13Å; E634-H638 PolarHBondContact O-ND1 2.92Å; Y635-H638 PolarHBondContact O-N 2.89Å; L636-H638 VanDerWaalsContact C-N 3.33Å; L636-H638 PolarHBondContact O-N 2.88Å
639	H	95	Very high	94.1	Very high	92 Å²	92	48.5 Å²	48.5	43%	0.426	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	18	-177.4	-66.6	74.7	0	0	0	113.7	Y635 L636 L637	Y635-H639 AromaticContact CD2-CE1 3.56Å; Y635-H639 AromaticContact CD2-ND1 3.71Å; Y635-H639 AromaticContact CE1-ND1 3.83Å; Y635-H639 AromaticContact CE2-CE1 3.06Å; Y635-H639 WeakPolarHBondContact CE2-CE1 3.42Å; Y635-H639 AromaticContact CE2-ND1 3.47Å; Y635-H639 WeakPolarHBondContact CE2-ND1 3.36Å; Y635-H639 AromaticContact CE2-NE2 3.6Å; Y635-H639 AromaticContact CG-ND1 3.98Å; Y635-H639 AromaticContact CZ-CD2 3.88Å; Y635-H639 AromaticContact CZ-CE1 3.41Å; Y635-H639 VanDerWaalsContact CZ-CE1 3.41Å; Y635-H639 AromaticContact CZ-CG 3.83Å; Y635-H639 AromaticContact CZ-ND1 3.52Å; Y635-H639 AromaticContact CZ-NE2 3.63Å; Y635-H639 PolarHBondContact O-N 3.33Å; Y635-H639 VanDerWaalsContact O-N 3.14Å; Y635-H639 PolarHBondContact O-ND1 3.44Å; Y635-H639 PolarHBondContact OH-NE2 3.12Å; L636-H639 CarbonylContact O-C 3.54Å; L636-H639 PolarHBondContact O-N 3.25Å; L636-H639 VanDerWaalsContact O-N 3.12Å; L637-H639 VanDerWaalsContact C-N 3.28Å; L637-H639 PolarHBondContact O-N 2.98Å
640	G	89.8	Confident	93.7	Very high	48 Å²	48	44.4 Å²	44.4	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	21.9	171.5	0	0	0	0	0	115.4	N609 L636 D642	N609-G640 PolarHBondContact ND2-O 2.85Å; L636-G640 PolarHBondContact O-N 3Å; G640-D642 PolarHBondContact O-N 2.93Å
641	A	95.3	Very high	93.7	Very high	10 Å²	10	43.7 Å²	43.7	8%	0.083	23%	0.231	C	C	.	.			trans	-63.6	130.9	167.8	0	0	0	0	0	111	V608 N609 L621 L636 V643	V608-A641 HydrophobicContact CG2-CB 3.95Å; N609-A641 WeakPolarHBondContact OD1-CA 3.35Å; L621-A641 HydrophobicContact CB-CB 4.18Å; L621-A641 HydrophobicContact CD2-CB 3.94Å; L621-A641 HydrophobicContact CG-CB 4.49Å; L636-A641 HydrophobicContact CB-CB 3.82Å; L636-A641 WeakPolarHBondContact O-CB 3.48Å; L636-A641 PolarHBondContact O-N 3.17Å; A641-V643 PolarHBondContact O-N 3.32Å
642	D	92.1	Very high	93.7	Very high	66 Å²	66	41.3 Å²	41.3	35%	0.353	21%	0.211	S	C	.	.			trans	-77.4	106.9	-177.5	173.5	18.6	0	0	0	110.4	N609 G640 H644 A645	N609-D642 PolarHBondContact ND2-N 2.84Å; N609-D642 PolarHBondContact OD1-N 3.46Å; G640-D642 PolarHBondContact O-N 2.93Å; D642-H644 PolarHBondContact O-N 2.96Å; D642-H644 WeakPolarHBondContact OD1-CA 3.24Å; D642-H644 WeakPolarHBondContact OD1-CB 3.43Å; D642-H644 PolarHBondContact OD1-N 2.96Å; D642-A645 HydrophobicContact CB-CB 4.02Å; D642-A645 VanDerWaalsContact O-CB 3.26Å; D642-A645 WeakPolarHBondContact O-CB 3.43Å; D642-A645 PolarHBondContact O-N 3.08Å; D642-A645 VanDerWaalsContact O-N 3.14Å; D642-A645 PolarHBondContact OD1-N 3.44Å; D642-A645 VanDerWaalsContact OD2-CA 3.29Å; D642-A645 WeakPolarHBondContact OD2-CA 3.32Å; D642-A645 PolarHBondContact OD2-N 3.07Å; D642-A645 VanDerWaalsContact OD2-N 3.13Å
643	V	95.1	Very high	93.7	Very high	13 Å²	13	41.2 Å²	41.2	8%	0.079	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.1	177	77.9	0	0	0	0	113.1	L637 A641 L669 A674	L637-V643 HydrophobicContact CD2-CB 4.15Å; L637-V643 HydrophobicContact CD2-CG2 4.16Å; A641-V643 PolarHBondContact O-N 3.32Å; V643-L669 HydrophobicContact CG2-CB 4.41Å; V643-L669 HydrophobicContact CG2-CD2 3.82Å; V643-A674 HydrophobicContact CG2-CB 3.68Å
644	H	93.9	Very high	93.7	Very high	95 Å²	95	41.3 Å²	41.3	44%	0.44	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	1.2	177.5	-57.3	-52.5	0	0	0	113.6	D642 K646 V652 G673	D642-H644 PolarHBondContact O-N 2.96Å; D642-H644 WeakPolarHBondContact OD1-CA 3.24Å; D642-H644 WeakPolarHBondContact OD1-CB 3.43Å; D642-H644 PolarHBondContact OD1-N 2.96Å; H644-K646 PolarHBondContact O-N 3.4Å; H644-V652 WeakPolarHBondContact O-CG1 3.46Å; H644-G673 PolarHBondContact CE1-O 3.2Å
645	A	91.3	Very high	93.7	Very high	2 Å²	2	37 Å²	37	2%	0.017	19%	0.191	C	C	.	.			trans	-54.6	128.2	178.8	0	0	0	0	0	109.5	T619 H622 D642 V652	T619-A645 HydrophobicContact CG2-CB 3.83Å; H622-A645 PolarHBondContact CE1-O 3.3Å; H622-A645 PolarHBondContact NE2-O 3.49Å; D642-A645 HydrophobicContact CB-CB 4.02Å; D642-A645 VanDerWaalsContact O-CB 3.26Å; D642-A645 WeakPolarHBondContact O-CB 3.43Å; D642-A645 PolarHBondContact O-N 3.08Å; D642-A645 VanDerWaalsContact O-N 3.14Å; D642-A645 PolarHBondContact OD1-N 3.44Å; D642-A645 VanDerWaalsContact OD2-CA 3.29Å; D642-A645 WeakPolarHBondContact OD2-CA 3.32Å; D642-A645 PolarHBondContact OD2-N 3.07Å; D642-A645 VanDerWaalsContact OD2-N 3.13Å; A645-V652 WeakPolarHBondContact O-CA 3.3Å
646	K	92.1	Very high	93.7	Very high	95 Å²	95	35.6 Å²	35.6	41%	0.413	19%	0.186	S	C	.	.			trans	-98.6	134.9	175.9	-67.9	-167.8	174.8	-151.1	0	111.4	R611 H644 G650 L651 V652 A679	R611-K646 PolarHBondContact NH1-O 2.77Å; H644-K646 PolarHBondContact O-N 3.4Å; K646-G650 WeakPolarHBondContact CD-O 3.48Å; K646-L651 CarbonylContact C-O 3.44Å; K646-L651 WeakPolarHBondContact CA-O 3.44Å; K646-V652 HydrophobicContact CG-CG1 3.86Å; K646-A679 PolarHBondContact NZ-O 3.32Å
647	D	89.9	Confident	93.7	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.053	19%	0.186	C	C	.	.			trans	-77.3	-177.4	168.1	83.3	4.9	0	0	0	111.9	R616 G649 G650 L651	R616-D647 IonicContact CZ-OD2 2.87Å; R616-D647 IonicContact NH1-OD2 3.71Å; R616-D647 PolarHBondContact NH1-OD2 2.82Å; R616-D647 IonicContact NH2-OD2 3.89Å; R616-D647 PolarHBondContact NH2-OD2 3.24Å; R616-D647 WeakPolarHBondContact O-CB 3.41Å; D647-G649 PolarHBondContact O-N 3.39Å; D647-G649 VanDerWaalsContact OD1-CA 3.31Å; D647-G649 WeakPolarHBondContact OD1-CA 3.29Å; D647-G649 PolarHBondContact OD1-N 2.67Å; D647-G650 WeakPolarHBondContact O-CA 3.12Å; D647-G650 PolarHBondContact O-N 3.33Å; D647-G650 PolarHBondContact OD1-N 3.13Å; D647-L651 PolarHBondContact N-O 3.12Å; D647-L651 PolarHBondContact OD1-N 3.36Å; D647-L651 VanDerWaalsContact OD1-N 3.07Å
648	K	86.4	Confident	93.8	Very high	118 Å²	118	34.7 Å²	34.7	51%	0.513	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.1	-179.6	-174.8	172.1	-179.1	172.4	0	113.8	R616 H617 L681	R616-K648 WeakPolarHBondContact O-CB 3.35Å; R616-K648 PolarHBondContact O-N 2.92Å; H617-K648 HydrophobicContact CB-CB 4.39Å; K648-L681 WeakPolarHBondContact O-CD1 3.46Å
649	G	85.3	Confident	93.8	Very high	10 Å²	10	29.8 Å²	29.8	10%	0.103	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-1.4	171.5	0	0	0	0	0	113.8	D647 L651 L681	D647-G649 PolarHBondContact O-N 3.39Å; D647-G649 VanDerWaalsContact OD1-CA 3.31Å; D647-G649 WeakPolarHBondContact OD1-CA 3.29Å; D647-G649 PolarHBondContact OD1-N 2.67Å; G649-L651 VanDerWaalsContact C-N 3.29Å; G649-L681 WeakPolarHBondContact O-CB 3.29Å; G649-L681 VanDerWaalsContact O-CG 3.31Å; G649-L681 WeakPolarHBondContact O-CG 3.34Å; G649-L681 PolarHBondContact O-N 2.8Å
650	G	88.9	Confident	93.7	Very high	3 Å²	3	32.6 Å²	32.6	3%	0.031	17%	0.169	C	C	.	.	S	Bend	trans	82	3.5	-174.9	0	0	0	0	0	114.3	K646 D647	K646-G650 WeakPolarHBondContact CD-O 3.48Å; D647-G650 WeakPolarHBondContact O-CA 3.12Å; D647-G650 PolarHBondContact O-N 3.33Å; D647-G650 PolarHBondContact OD1-N 3.13Å
651	L	95.4	Very high	94	Very high	24 Å²	24	31.5 Å²	31.5	13%	0.126	16%	0.158	C	C	.	.			trans	-74.8	135.5	-179.1	-62	157	0	0	0	109.2	H622 K646 D647 G649 H655 D680	H622-L651 PolarHBondContact NE2-O 2.92Å; K646-L651 CarbonylContact C-O 3.44Å; K646-L651 WeakPolarHBondContact CA-O 3.44Å; D647-L651 PolarHBondContact N-O 3.12Å; D647-L651 PolarHBondContact OD1-N 3.36Å; D647-L651 VanDerWaalsContact OD1-N 3.07Å; G649-L651 VanDerWaalsContact C-N 3.29Å; L651-H655 HydrophobicContact CB-CB 4.29Å; L651-H655 HydrophobicContact CD2-CB 3.63Å; L651-D680 HydrophobicContact CD2-CB 3.84Å; L651-D680 HydrophobicContact CG-CB 4.16Å
652	V	97.4	Very high	94.1	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.012	16%	0.162	C	C	.	.			trans	-92.6	164	165.3	-52	0	0	0	0	111.5	H644 A645 K646 L654 H655 V678	H644-V652 WeakPolarHBondContact O-CG1 3.46Å; A645-V652 WeakPolarHBondContact O-CA 3.3Å; K646-V652 HydrophobicContact CG-CG1 3.86Å; V652-L654 HydrophobicContact CG2-CB 4.08Å; V652-L654 PolarHBondContact O-N 3.3Å; V652-H655 WeakPolarHBondContact CG2-ND1 3.44Å; V652-H655 PolarHBondContact N-ND1 3.02Å; V652-H655 PolarHBondContact O-N 2.97Å; V652-H655 PolarHBondContact O-ND1 3.25Å; V652-V678 HydrophobicContact CG1-CG2 3.92Å; V652-V678 HydrophobicContact CG2-CG1 3.6Å
653	P	97.6	Very high	94.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-52.7	-31.4	-177.8	-28.8	36.3	0	0	0	115.1	L621 A625 H655 N656 A657 L669	L621-P653 HydrophobicContact CB-CG 4.25Å; L621-P653 HydrophobicContact CD2-CB 4.45Å; L621-P653 HydrophobicContact CD2-CG 3.97Å; L621-P653 HydrophobicContact CG-CB 4.06Å; L621-P653 HydrophobicContact CG-CG 3.84Å; A625-P653 HydrophobicContact CB-CB 3.92Å; P653-H655 VanDerWaalsContact C-N 3.31Å; P653-H655 PolarHBondContact O-N 3Å; P653-N656 WeakPolarHBondContact O-CB 3.31Å; P653-N656 PolarHBondContact O-N 3.37Å; P653-N656 VanDerWaalsContact O-N 3.16Å; P653-A657 PolarHBondContact O-N 3.26Å; P653-L669 HydrophobicContact CB-CD1 4.17Å; P653-L669 HydrophobicContact CB-CD2 4.21Å
654	L	98	Very high	94.4	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-34.7	176.8	-176	60.8	0	0	0	112.7	V652 N656 A657 C658 A666 L669 V670 A674 V676 P686 L702	V652-L654 HydrophobicContact CG2-CB 4.08Å; V652-L654 PolarHBondContact O-N 3.3Å; L654-N656 VanDerWaalsContact C-N 3.35Å; L654-N656 PolarHBondContact O-N 2.76Å; L654-A657 PolarHBondContact O-N 2.99Å; L654-C658 WeakPolarHBondContact O-CB 3.32Å; L654-C658 PolarHBondContact O-N 3.46Å; L654-C658 PolarHBondContact O-SG 3.28Å; L654-A666 HydrophobicContact CD1-CB 4Å; L654-L669 HydrophobicContact CB-CD1 4.36Å; L654-L669 HydrophobicContact CD1-CB 4.21Å; L654-L669 HydrophobicContact CD1-CD1 4.39Å; L654-V670 HydrophobicContact CD1-CG2 4.04Å; L654-V670 HydrophobicContact CD2-CG2 3.98Å; L654-A674 HydrophobicContact CB-CB 4.26Å; L654-A674 HydrophobicContact CD2-CB 3.85Å; L654-V676 HydrophobicContact CD2-CG1 4.38Å; L654-P686 HydrophobicContact CB-CG 4.42Å; L654-P686 HydrophobicContact CD2-CB 4.11Å; L654-P686 HydrophobicContact CD2-CG 3.87Å; L654-P686 HydrophobicContact CG-CB 3.99Å; L654-P686 HydrophobicContact CG-CG 3.97Å; L654-L702 HydrophobicContact CD2-CD2 4.22Å
655	H	98.2	Very high	94.6	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-64.1	-41	175.1	-61.3	92	0	0	0	111.6	L651 V652 P653 C658 S659 F684 P686 E689	L651-H655 HydrophobicContact CB-CB 4.29Å; L651-H655 HydrophobicContact CD2-CB 3.63Å; V652-H655 WeakPolarHBondContact CG2-ND1 3.44Å; V652-H655 PolarHBondContact N-ND1 3.02Å; V652-H655 PolarHBondContact O-N 2.97Å; V652-H655 PolarHBondContact O-ND1 3.25Å; P653-H655 VanDerWaalsContact C-N 3.31Å; P653-H655 PolarHBondContact O-N 3Å; H655-C658 PolarHBondContact O-N 3.01Å; H655-S659 VanDerWaalsContact O-CB 3.28Å; H655-S659 WeakPolarHBondContact O-CB 3.37Å; H655-S659 PolarHBondContact O-N 2.95Å; H655-F684 PolarHBondContact NE2-O 2.76Å; H655-P686 WeakPolarHBondContact NE2-CD 3.47Å; H655-E689 HydrophobicContact CB-CG 4.45Å
656	N	96.9	Very high	94.9	Very high	14 Å²	14	34.5 Å²	34.5	8%	0.075	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-47.5	177.7	-68.6	-4.7	0	0	0	110.2	H622 P653 L654 C658 S659 Y660	H622-N656 PolarHBondContact O-ND2 2.87Å; P653-N656 WeakPolarHBondContact O-CB 3.31Å; P653-N656 PolarHBondContact O-N 3.37Å; P653-N656 VanDerWaalsContact O-N 3.16Å; L654-N656 VanDerWaalsContact C-N 3.35Å; L654-N656 PolarHBondContact O-N 2.76Å; N656-C658 PolarHBondContact O-N 3.29Å; N656-S659 PolarHBondContact O-N 3.35Å; N656-Y660 VanDerWaalsContact O-CD2 3.22Å; N656-Y660 WeakPolarHBondContact O-CD2 3.49Å; N656-Y660 PolarHBondContact O-N 3.44Å; N656-Y660 VanDerWaalsContact O-N 3.11Å
657	A	97.6	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-45.7	176.8	0	0	0	0	0	111.9	P653 L654 G661 H662 V665 A666 L669	P653-A657 PolarHBondContact O-N 3.26Å; L654-A657 PolarHBondContact O-N 2.99Å; A657-G661 PolarHBondContact O-N 3.3Å; A657-H662 PolarHBondContact O-N 3.22Å; A657-V665 HydrophobicContact CB-CB 4.28Å; A657-V665 HydrophobicContact CB-CG1 3.67Å; A657-A666 HydrophobicContact CB-CB 4.05Å; A657-L669 HydrophobicContact CB-CD1 4.09Å
658	C	97.4	Very high	95.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67	-42.1	179.3	-66.7	0	0	0	0	113.6	L654 H655 N656 P686 E689 A690 K695 I698	L654-C658 WeakPolarHBondContact O-CB 3.32Å; L654-C658 PolarHBondContact O-N 3.46Å; L654-C658 PolarHBondContact O-SG 3.28Å; H655-C658 PolarHBondContact O-N 3.01Å; N656-C658 PolarHBondContact O-N 3.29Å; C658-P686 HydrophobicContact CB-CB 4.35Å; C658-P686 WeakPolarHBondContact CB-O 3.33Å; C658-E689 HydrophobicContact CB-CB 4.44Å; C658-A690 HydrophobicContact CB-CB 4.28Å; C658-K695 WeakPolarHBondContact O-CG 3.02Å; C658-I698 HydrophobicContact CB-CG2 4.01Å; C658-I698 VanDerWaalsContact SG-CG2 3.51Å
659	S	95.8	Very high	96	Very high	21 Å²	21	27.1 Å²	27.1	15%	0.147	13%	0.133	C	C	.	.	H	α-helix	trans	-68.3	-43.8	-178.2	-159.8	0	0	0	0	111.6	H655 N656 E689 K693	H655-S659 VanDerWaalsContact O-CB 3.28Å; H655-S659 WeakPolarHBondContact O-CB 3.37Å; H655-S659 PolarHBondContact O-N 2.95Å; N656-S659 PolarHBondContact O-N 3.35Å; S659-E689 WeakPolarHBondContact CB-OE2 3.36Å; S659-E689 PolarHBondContact OG-OE2 3.48Å; S659-K693 WeakPolarHBondContact O-CB 3.32Å; S659-K693 WeakPolarHBondContact O-CG 3.37Å; S659-K693 WeakPolarHBondContact OG-CE 3.41Å
660	Y	94.3	Very high	96.6	Very high	150 Å²	150	27.3 Å²	27.3	59%	0.588	13%	0.132	S	C	*	.	H	α-helix	trans	-79.5	-24.7	179.3	-68.1	-65.9	0	0	0	113.5	N656 H662 K695	N656-Y660 VanDerWaalsContact O-CD2 3.22Å; N656-Y660 WeakPolarHBondContact O-CD2 3.49Å; N656-Y660 PolarHBondContact O-N 3.44Å; N656-Y660 VanDerWaalsContact O-N 3.11Å; Y660-H662 VanDerWaalsContact CB-NE2 3.28Å; Y660-H662 WeakPolarHBondContact CB-NE2 3.37Å; Y660-K695 WeakPolarHBondContact O-CE 3.27Å; Y660-K695 PolarHBondContact O-NZ 2.91Å
661	G	94.5	Very high	97	Very high	26 Å²	26	35.1 Å²	35.1	27%	0.268	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.2	26.2	174.5	0	0	0	0	0	115.1	A657 Y663	A657-G661 PolarHBondContact O-N 3.3Å; G661-Y663 PolarHBondContact O-N 3.28Å
662	H	97.1	Very high	97	Very high	39 Å²	39	37.6 Å²	37.6	18%	0.181	17%	0.171	C	C	.	.			trans	-88.3	84.2	-174.1	-55.8	-37.5	0	0	0	110.7	A625 G626 N628 A657 Y660 E664 V665 A666	A625-H662 PolarHBondContact O-CD2 3.46Å; A625-H662 VanDerWaalsContact O-CD2 3.26Å; G626-H662 PolarHBondContact O-CD2 2.92Å; G626-H662 PolarHBondContact O-NE2 3.17Å; N628-H662 HydrophobicContact CB-CB 4.4Å; A657-H662 PolarHBondContact O-N 3.22Å; Y660-H662 VanDerWaalsContact CB-NE2 3.28Å; Y660-H662 WeakPolarHBondContact CB-NE2 3.37Å; H662-E664 PolarHBondContact O-N 3.29Å; H662-V665 HydrophobicContact CB-CB 4.02Å; H662-V665 HydrophobicContact CB-CG2 4.29Å; H662-V665 PolarHBondContact O-N 3.4Å; H662-A666 WeakPolarHBondContact O-CB 3.42Å; H662-A666 PolarHBondContact O-N 3.48Å
663	Y	97.1	Very high	96.8	Very high	92 Å²	92	39.7 Å²	39.7	36%	0.361	19%	0.193	S	C	.	.	H	α-helix	trans	-56.3	-51.1	-173.2	178.5	-85.5	0	0	0	113.3	G661 V665 A666 E667 E697 I698 L701	G661-Y663 PolarHBondContact O-N 3.28Å; Y663-V665 VanDerWaalsContact C-N 3.34Å; Y663-V665 PolarHBondContact O-N 3.35Å; Y663-A666 PolarHBondContact O-N 3.08Å; Y663-A666 VanDerWaalsContact O-N 3.13Å; Y663-E667 HydrophobicContact CE1-CB 4.5Å; Y663-E667 PolarHBondContact O-N 3.01Å; Y663-E697 HydrophobicContact CD2-CB 4.04Å; Y663-E697 HydrophobicContact CE2-CB 4.23Å; Y663-I698 HydrophobicContact CD2-CG1 4.29Å; Y663-L701 HydrophobicContact CD2-CD2 4.37Å; Y663-L701 HydrophobicContact CE2-CB 4.09Å; Y663-L701 HydrophobicContact CE2-CD2 4.08Å; Y663-L701 HydrophobicContact CE2-CG 4.48Å
664	E	96.7	Very high	96.7	Very high	118 Å²	118	40 Å²	40	55%	0.551	20%	0.196	S	C	*	.	H	α-helix	trans	-61.6	-41.8	-176.6	-63.8	173.7	173.3	0	0	111.8	V630 H662 E667 L668	V630-E664 HydrophobicContact CG2-CB 4.36Å; H662-E664 PolarHBondContact O-N 3.29Å; E664-E667 PolarHBondContact O-N 3.39Å; E664-L668 WeakPolarHBondContact O-CB 3.29Å; E664-L668 PolarHBondContact O-N 3.16Å
665	V	98.1	Very high	96.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-45	173.7	170.6	0	0	0	0	111.3	A625 N628 V630 V633 A657 H662 Y663 E667 L668 L669	A625-V665 HydrophobicContact CB-CG1 3.75Å; N628-V665 WeakPolarHBondContact OD1-CG2 3.42Å; V630-V665 HydrophobicContact CG2-CG2 3.94Å; V633-V665 HydrophobicContact CG1-CG1 4.47Å; V633-V665 HydrophobicContact CG2-CG1 4.23Å; V633-V665 HydrophobicContact CG2-CG2 4.39Å; A657-V665 HydrophobicContact CB-CB 4.28Å; A657-V665 HydrophobicContact CB-CG1 3.67Å; H662-V665 HydrophobicContact CB-CB 4.02Å; H662-V665 HydrophobicContact CB-CG2 4.29Å; H662-V665 PolarHBondContact O-N 3.4Å; Y663-V665 VanDerWaalsContact C-N 3.34Å; Y663-V665 PolarHBondContact O-N 3.35Å; V665-E667 VanDerWaalsContact C-N 3.31Å; V665-E667 PolarHBondContact O-N 2.93Å; V665-L668 PolarHBondContact O-N 3.42Å; V665-L669 HydrophobicContact CG1-CD1 3.82Å; V665-L669 HydrophobicContact CG1-CG 4.37Å; V665-L669 WeakPolarHBondContact O-CB 3.41Å; V665-L669 VanDerWaalsContact O-CG 3.23Å; V665-L669 WeakPolarHBondContact O-CG 3.24Å; V665-L669 PolarHBondContact O-N 3.07Å
666	A	97.9	Very high	96.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-40.6	178.3	0	0	0	0	0	111.3	L654 A657 H662 Y663 V670 L701	L654-A666 HydrophobicContact CD1-CB 4Å; A657-A666 HydrophobicContact CB-CB 4.05Å; H662-A666 WeakPolarHBondContact O-CB 3.42Å; H662-A666 PolarHBondContact O-N 3.48Å; Y663-A666 PolarHBondContact O-N 3.08Å; Y663-A666 VanDerWaalsContact O-N 3.13Å; A666-V670 VanDerWaalsContact O-CG2 3.3Å; A666-V670 WeakPolarHBondContact O-CG2 3.46Å; A666-V670 PolarHBondContact O-N 2.97Å; A666-L701 HydrophobicContact CB-CD2 4.21Å
667	E	97.5	Very high	96.4	Very high	42 Å²	42	44.6 Å²	44.6	20%	0.196	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-45.9	175.3	-170.2	178.3	-163.3	0	0	112	Y663 E664 V665 L669 V670 R671 L701	Y663-E667 HydrophobicContact CE1-CB 4.5Å; Y663-E667 PolarHBondContact O-N 3.01Å; E664-E667 PolarHBondContact O-N 3.39Å; V665-E667 VanDerWaalsContact C-N 3.31Å; V665-E667 PolarHBondContact O-N 2.93Å; E667-L669 PolarHBondContact O-N 2.97Å; E667-V670 PolarHBondContact O-N 3.45Å; E667-R671 HydrophobicContact CG-CG 4.38Å; E667-R671 WeakPolarHBondContact O-CB 3.46Å; E667-R671 VanDerWaalsContact O-CG 3.31Å; E667-R671 WeakPolarHBondContact O-CG 3.29Å; E667-R671 PolarHBondContact O-N 2.86Å; E667-R671 IonicContact OE1-CZ 3.94Å; E667-R671 IonicContact OE1-NE 3.37Å; E667-R671 PolarHBondContact OE1-NE 2.74Å; E667-R671 IonicContact OE1-NH2 3.31Å; E667-R671 PolarHBondContact OE1-NH2 2.97Å; E667-R671 IonicContact OE2-CZ 3.8Å; E667-R671 IonicContact OE2-NH2 3.49Å; E667-R671 PolarHBondContact OE2-NH2 3.49Å; E667-L701 HydrophobicContact CB-CD1 4.48Å; E667-L701 HydrophobicContact CB-CD2 3.97Å; E667-L701 HydrophobicContact CG-CD1 4.25Å
668	L	97.3	Very high	96.3	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.131	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-48.7	174.2	-87.7	161.4	0	0	0	112	V630 E664 V665 V670 R671 H672	V630-L668 HydrophobicContact CG1-CD1 3.71Å; E664-L668 WeakPolarHBondContact O-CB 3.29Å; E664-L668 PolarHBondContact O-N 3.16Å; V665-L668 PolarHBondContact O-N 3.42Å; L668-V670 PolarHBondContact O-N 2.94Å; L668-R671 PolarHBondContact O-N 3.11Å; L668-H672 PolarHBondContact O-CD2 3.21Å; L668-H672 VanDerWaalsContact O-CD2 3.31Å; L668-H672 PolarHBondContact O-N 3.05Å
669	L	98	Very high	96.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.3	-44.5	178.3	-69.8	168.1	0	0	0	111.4	L621 A625 V633 L637 V643 P653 L654 A657 V665 E667 H672 G673 A674	L621-L669 HydrophobicContact CD1-CD2 4.23Å; L621-L669 HydrophobicContact CD2-CD2 4.26Å; L621-L669 HydrophobicContact CG-CD2 4.37Å; A625-L669 HydrophobicContact CB-CD1 4.02Å; V633-L669 HydrophobicContact CG1-CD2 4.36Å; L637-L669 HydrophobicContact CD1-CD2 4.27Å; L637-L669 HydrophobicContact CD2-CD2 4.38Å; V643-L669 HydrophobicContact CG2-CB 4.41Å; V643-L669 HydrophobicContact CG2-CD2 3.82Å; P653-L669 HydrophobicContact CB-CD1 4.17Å; P653-L669 HydrophobicContact CB-CD2 4.21Å; L654-L669 HydrophobicContact CB-CD1 4.36Å; L654-L669 HydrophobicContact CD1-CB 4.21Å; L654-L669 HydrophobicContact CD1-CD1 4.39Å; A657-L669 HydrophobicContact CB-CD1 4.09Å; V665-L669 HydrophobicContact CG1-CD1 3.82Å; V665-L669 HydrophobicContact CG1-CG 4.37Å; V665-L669 WeakPolarHBondContact O-CB 3.41Å; V665-L669 VanDerWaalsContact O-CG 3.23Å; V665-L669 WeakPolarHBondContact O-CG 3.24Å; V665-L669 PolarHBondContact O-N 3.07Å; E667-L669 PolarHBondContact O-N 2.97Å; L669-H672 CarbonylContact O-C 3.54Å; L669-H672 PolarHBondContact O-N 3.31Å; L669-G673 PolarHBondContact O-N 3.27Å; L669-A674 VanDerWaalsContact C-CB 3.45Å; L669-A674 HydrophobicContact CB-CB 4Å; L669-A674 WeakPolarHBondContact O-CB 3.37Å; L669-A674 PolarHBondContact O-N 3.46Å
670	V	97.2	Very high	96	Very high	15 Å²	15	46.8 Å²	46.8	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-40.6	177.3	170.7	0	0	0	0	111.9	L654 A666 E667 L668 H672 G673 V676 H705	L654-V670 HydrophobicContact CD1-CG2 4.04Å; L654-V670 HydrophobicContact CD2-CG2 3.98Å; A666-V670 VanDerWaalsContact O-CG2 3.3Å; A666-V670 WeakPolarHBondContact O-CG2 3.46Å; A666-V670 PolarHBondContact O-N 2.97Å; E667-V670 PolarHBondContact O-N 3.45Å; L668-V670 PolarHBondContact O-N 2.94Å; V670-H672 VanDerWaalsContact C-N 3.3Å; V670-H672 PolarHBondContact O-N 3.03Å; V670-G673 PolarHBondContact O-N 2.95Å; V670-V676 HydrophobicContact CG1-CG1 4.36Å; V670-V676 HydrophobicContact CG2-CG1 3.8Å; V670-H705 HydrophobicContact CG1-CB 3.87Å; V670-H705 VanDerWaalsContact CG1-CG 3.5Å
671	R	96.3	Very high	95.8	Very high	167 Å²	167	43 Å²	43	63%	0.63	23%	0.229	S	C	*	.	H	α-helix	trans	-62	-36.4	173.9	-72.6	176	-175.8	-177.3	5.6	112.3	E667 L668 G673	E667-R671 HydrophobicContact CG-CG 4.38Å; E667-R671 WeakPolarHBondContact O-CB 3.46Å; E667-R671 VanDerWaalsContact O-CG 3.31Å; E667-R671 WeakPolarHBondContact O-CG 3.29Å; E667-R671 PolarHBondContact O-N 2.86Å; E667-R671 IonicContact OE1-CZ 3.94Å; E667-R671 IonicContact OE1-NE 3.37Å; E667-R671 PolarHBondContact OE1-NE 2.74Å; E667-R671 IonicContact OE1-NH2 3.31Å; E667-R671 PolarHBondContact OE1-NH2 2.97Å; E667-R671 IonicContact OE2-CZ 3.8Å; E667-R671 IonicContact OE2-NH2 3.49Å; E667-R671 PolarHBondContact OE2-NH2 3.49Å; L668-R671 PolarHBondContact O-N 3.11Å; R671-G673 PolarHBondContact O-N 2.88Å
672	H	96.3	Very high	95.6	Very high	76 Å²	76	48 Å²	48	35%	0.352	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	17.4	172.7	-76.4	-99.6	0	0	0	113.8	L637 L668 L669 V670	L637-H672 HydrophobicContact CD1-CB 4.06Å; L637-H672 HydrophobicContact CD2-CB 4.1Å; L668-H672 PolarHBondContact O-CD2 3.21Å; L668-H672 VanDerWaalsContact O-CD2 3.31Å; L668-H672 PolarHBondContact O-N 3.05Å; L669-H672 CarbonylContact O-C 3.54Å; L669-H672 PolarHBondContact O-N 3.31Å; V670-H672 VanDerWaalsContact C-N 3.3Å; V670-H672 PolarHBondContact O-N 3.03Å
673	G	92.4	Very high	95.4	Very high	45 Å²	45	51.7 Å²	51.7	46%	0.464	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	9.1	168.2	0	0	0	0	0	116	H644 L669 V670 R671 S675	H644-G673 PolarHBondContact CE1-O 3.2Å; L669-G673 PolarHBondContact O-N 3.27Å; V670-G673 PolarHBondContact O-N 2.95Å; R671-G673 PolarHBondContact O-N 2.88Å; G673-S675 PolarHBondContact O-N 3.47Å
674	A	96	Very high	95.4	Very high	7 Å²	7	49 Å²	49	6%	0.058	25%	0.246	C	C	.	.			trans	-54.8	126.2	176.4	0	0	0	0	0	111.8	V643 L654 L669 V676	V643-A674 HydrophobicContact CG2-CB 3.68Å; L654-A674 HydrophobicContact CB-CB 4.26Å; L654-A674 HydrophobicContact CD2-CB 3.85Å; L669-A674 VanDerWaalsContact C-CB 3.45Å; L669-A674 HydrophobicContact CB-CB 4Å; L669-A674 WeakPolarHBondContact O-CB 3.37Å; L669-A674 PolarHBondContact O-N 3.46Å; A674-V676 PolarHBondContact O-N 2.85Å
675	S	94.8	Very high	95.5	Very high	55 Å²	55	43.3 Å²	43.3	39%	0.385	22%	0.22	S	C	.	.			trans	-73.6	110.8	-179.8	-176.4	0	0	0	0	110.6	G673 N677 V678	G673-S675 PolarHBondContact O-N 3.47Å; S675-N677 PolarHBondContact O-N 3.36Å; S675-V678 WeakPolarHBondContact O-CB 3.48Å; S675-V678 WeakPolarHBondContact O-CG1 3.46Å; S675-V678 PolarHBondContact O-N 3.33Å
676	V	96.4	Very high	95.4	Very high	12 Å²	12	43.3 Å²	43.3	7%	0.073	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.8	179.9	-60.9	0	0	0	0	114.3	L654 V670 A674 L702 H705 A707	L654-V676 HydrophobicContact CD2-CG1 4.38Å; V670-V676 HydrophobicContact CG1-CG1 4.36Å; V670-V676 HydrophobicContact CG2-CG1 3.8Å; A674-V676 PolarHBondContact O-N 2.85Å; V676-L702 HydrophobicContact CB-CD2 4Å; V676-L702 HydrophobicContact CG1-CD2 3.74Å; V676-H705 HydrophobicContact CG1-CB 4.08Å; V676-H705 WeakPolarHBondContact CG2-O 3.44Å; V676-A707 HydrophobicContact CB-CB 4.18Å; V676-A707 HydrophobicContact CG2-CB 4.05Å
677	N	96.4	Very high	95.4	Very high	46 Å²	46	43.3 Å²	43.3	25%	0.246	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	11.4	-179.8	-74.4	-45.5	0	0	0	113.6	S675 G706 A707 D708	S675-N677 PolarHBondContact O-N 3.36Å; N677-G706 PolarHBondContact ND2-O 3.43Å; N677-A707 WeakPolarHBondContact OD1-CA 3.45Å; N677-D708 PolarHBondContact OD1-N 3.28Å
678	V	95.1	Very high	95.5	Very high	22 Å²	22	41.3 Å²	41.3	13%	0.133	21%	0.21	C	C	.	.			trans	-57.7	146.3	168.6	67.8	0	0	0	0	109.9	V652 S675 T685 P686	V652-V678 HydrophobicContact CG1-CG2 3.92Å; V652-V678 HydrophobicContact CG2-CG1 3.6Å; S675-V678 WeakPolarHBondContact O-CB 3.48Å; S675-V678 WeakPolarHBondContact O-CG1 3.46Å; S675-V678 PolarHBondContact O-N 3.33Å; V678-T685 WeakPolarHBondContact O-CA 3.1Å; V678-T685 WeakPolarHBondContact O-CB 3.44Å; V678-T685 WeakPolarHBondContact O-CG2 3.43Å; V678-P686 HydrophobicContact CG1-CG 3.92Å; V678-P686 WeakPolarHBondContact O-CD 3.49Å
679	A	93.9	Very high	95.4	Very high	30 Å²	30	41.6 Å²	41.6	25%	0.248	21%	0.211	C	C	.	.			trans	-123.6	140.2	-179.9	0	0	0	0	0	110.7	K646 F684	K646-A679 PolarHBondContact NZ-O 3.32Å; A679-F684 VanDerWaalsContact CA-O 3.27Å; A679-F684 WeakPolarHBondContact CA-O 3.44Å
680	D	92.5	Very high	95.4	Very high	16 Å²	16	41.6 Å²	41.6	9%	0.086	21%	0.211	C	C	.	.			trans	-79	-169.8	173.5	83.7	-14.8	0	0	0	112.2	L651 W682 K683 F684	L651-D680 HydrophobicContact CD2-CB 3.84Å; L651-D680 HydrophobicContact CG-CB 4.16Å; D680-W682 VanDerWaalsContact C-N 3.27Å; D680-W682 PolarHBondContact O-N 3.49Å; D680-W682 VanDerWaalsContact OD1-CA 3.31Å; D680-W682 WeakPolarHBondContact OD1-CA 3.37Å; D680-W682 PolarHBondContact OD1-N 2.83Å; D680-K683 PolarHBondContact O-N 3.18Å; D680-K683 VanDerWaalsContact O-N 3.16Å; D680-K683 PolarHBondContact OD1-N 3.46Å; D680-F684 PolarHBondContact N-O 3.29Å; D680-F684 PolarHBondContact OD1-N 2.8Å
681	L	89.7	Confident	95.3	Very high	69 Å²	69	40.9 Å²	40.9	36%	0.361	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-19.3	178.9	-63.7	-178.7	0	0	0	114.1	L555 K648 G649	L555-L681 HydrophobicContact CD2-CB 4.23Å; L555-L681 HydrophobicContact CD2-CD1 4.01Å; L555-L681 HydrophobicContact CD2-CD2 3.74Å; L555-L681 HydrophobicContact CD2-CG 4.19Å; K648-L681 WeakPolarHBondContact O-CD1 3.46Å; G649-L681 WeakPolarHBondContact O-CB 3.29Å; G649-L681 VanDerWaalsContact O-CG 3.31Å; G649-L681 WeakPolarHBondContact O-CG 3.34Å; G649-L681 PolarHBondContact O-N 2.8Å
682	W	90.6	Very high	95.3	Very high	131 Å²	131	34 Å²	34	50%	0.496	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10	172	-64.2	-93.4	0	0	0	112.5	D680 F684 R714	D680-W682 VanDerWaalsContact C-N 3.27Å; D680-W682 PolarHBondContact O-N 3.49Å; D680-W682 VanDerWaalsContact OD1-CA 3.31Å; D680-W682 WeakPolarHBondContact OD1-CA 3.37Å; D680-W682 PolarHBondContact OD1-N 2.83Å; W682-F684 HydrophobicContact CB-CD2 3.75Å; W682-F684 HydrophobicContact CB-CE2 4.13Å; W682-F684 PolarHBondContact O-N 3.12Å; W682-R714 WeakPolarHBondContact O-CB 3.17Å; W682-R714 PolarHBondContact O-N 3.35Å
683	K	93.9	Very high	95.2	Very high	118 Å²	118	35.4 Å²	35.4	51%	0.513	19%	0.19	S	C	.	.			trans	59.5	17.6	-175	-54.4	178.4	-179	175.5	0	115.1	D680	D680-K683 PolarHBondContact O-N 3.18Å; D680-K683 VanDerWaalsContact O-N 3.16Å; D680-K683 PolarHBondContact OD1-N 3.46Å
684	F	96.6	Very high	95.2	Very high	34 Å²	34	34.7 Å²	34.7	15%	0.149	18%	0.183	C	C	.	.			trans	-64.7	140.1	167.6	-80.6	-110.7	0	0	0	108.9	H655 A679 D680 W682 H688 N713 M722	H655-F684 PolarHBondContact NE2-O 2.76Å; A679-F684 VanDerWaalsContact CA-O 3.27Å; A679-F684 WeakPolarHBondContact CA-O 3.44Å; D680-F684 PolarHBondContact N-O 3.29Å; D680-F684 PolarHBondContact OD1-N 2.8Å; W682-F684 HydrophobicContact CB-CD2 3.75Å; W682-F684 HydrophobicContact CB-CE2 4.13Å; W682-F684 PolarHBondContact O-N 3.12Å; F684-H688 HydrophobicContact CB-CB 4.32Å; F684-H688 HydrophobicContact CD1-CB 3.58Å; F684-H688 HydrophobicContact CE1-CB 4.27Å; F684-H688 HydrophobicContact CG-CB 4.27Å; F684-N713 HydrophobicContact CD2-CB 4.04Å; F684-N713 HydrophobicContact CE2-CB 4.06Å; F684-N713 WeakPolarHBondContact CE2-ND2 3.34Å; F684-N713 VanDerWaalsContact CZ-ND2 3.26Å; F684-N713 WeakPolarHBondContact CZ-ND2 3.21Å; F684-M722 HydrophobicContact CE1-SD 3.61Å; F684-M722 HydrophobicContact CZ-SD 3.77Å
685	T	97.9	Very high	95.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.			trans	-106.1	165.2	171.2	68.2	0	0	0	0	109.7	V678 L687 H688 E689 K711	V678-T685 WeakPolarHBondContact O-CA 3.1Å; V678-T685 WeakPolarHBondContact O-CB 3.44Å; V678-T685 WeakPolarHBondContact O-CG2 3.43Å; T685-L687 PolarHBondContact O-N 2.85Å; T685-L687 PolarHBondContact OG1-N 2.95Å; T685-H688 PolarHBondContact N-ND1 3.49Å; T685-H688 WeakPolarHBondContact O-CB 3.29Å; T685-H688 PolarHBondContact O-N 3Å; T685-H688 PolarHBondContact OG1-N 3.28Å; T685-H688 PolarHBondContact OG1-ND1 3.4Å; T685-E689 PolarHBondContact O-N 3.36Å; T685-K711 HydrophobicContact CG2-CB 4.44Å; T685-K711 HydrophobicContact CG2-CG 3.89Å
686	P	97.8	Very high	95.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-52.5	-28.8	172	-28.5	35.9	0	0	0	113.9	L654 H655 C658 V678 A690 L702	L654-P686 HydrophobicContact CB-CG 4.42Å; L654-P686 HydrophobicContact CD2-CB 4.11Å; L654-P686 HydrophobicContact CD2-CG 3.87Å; L654-P686 HydrophobicContact CG-CB 3.99Å; L654-P686 HydrophobicContact CG-CG 3.97Å; H655-P686 WeakPolarHBondContact NE2-CD 3.47Å; C658-P686 HydrophobicContact CB-CB 4.35Å; C658-P686 WeakPolarHBondContact CB-O 3.33Å; V678-P686 HydrophobicContact CG1-CG 3.92Å; V678-P686 WeakPolarHBondContact O-CD 3.49Å; P686-A690 WeakPolarHBondContact O-CB 3.3Å; P686-A690 PolarHBondContact O-N 3.44Å; P686-L702 HydrophobicContact CB-CD1 4.04Å; P686-L702 HydrophobicContact CB-CD2 4.18Å; P686-L702 WeakPolarHBondContact O-CD1 3.3Å
687	L	97.8	Very high	95	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-35.2	175.7	-173.7	62	0	0	0	112.8	T685 A691 C699 L702 L703 A707 P709 P719 L734	T685-L687 PolarHBondContact O-N 2.85Å; T685-L687 PolarHBondContact OG1-N 2.95Å; L687-A691 VanDerWaalsContact O-CB 3.24Å; L687-A691 WeakPolarHBondContact O-CB 3.47Å; L687-A691 PolarHBondContact O-N 2.98Å; L687-C699 HydrophobicContact CD1-CB 4.02Å; L687-L702 HydrophobicContact CB-CD1 4.13Å; L687-L702 HydrophobicContact CD1-CB 4.18Å; L687-L702 HydrophobicContact CD1-CD1 4.19Å; L687-L703 HydrophobicContact CD1-CG 4.36Å; L687-L703 HydrophobicContact CD2-CD2 3.9Å; L687-L703 HydrophobicContact CD2-CG 4.45Å; L687-A707 HydrophobicContact CB-CB 4.27Å; L687-A707 HydrophobicContact CD2-CB 3.91Å; L687-P709 HydrophobicContact CD2-CB 4.3Å; L687-P719 HydrophobicContact CB-CG 4.38Å; L687-P719 HydrophobicContact CD2-CB 4.37Å; L687-P719 HydrophobicContact CD2-CG 4.06Å; L687-P719 HydrophobicContact CG-CB 4.04Å; L687-P719 HydrophobicContact CG-CG 4.01Å; L687-L734 HydrophobicContact CD1-CD2 4.03Å; L687-L734 HydrophobicContact CD2-CD2 4.02Å; L687-L734 HydrophobicContact CG-CD2 4.15Å
688	H	97.7	Very high	95	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-45.4	171.7	-69.4	81.4	0	0	0	110.8	F684 T685 A691 A692 K711 N717 P719	F684-H688 HydrophobicContact CB-CB 4.32Å; F684-H688 HydrophobicContact CD1-CB 3.58Å; F684-H688 HydrophobicContact CE1-CB 4.27Å; F684-H688 HydrophobicContact CG-CB 4.27Å; T685-H688 PolarHBondContact N-ND1 3.49Å; T685-H688 WeakPolarHBondContact O-CB 3.29Å; T685-H688 PolarHBondContact O-N 3Å; T685-H688 PolarHBondContact OG1-N 3.28Å; T685-H688 PolarHBondContact OG1-ND1 3.4Å; H688-A691 PolarHBondContact O-N 3.25Å; H688-A692 VanDerWaalsContact O-CB 3.28Å; H688-A692 WeakPolarHBondContact O-CB 3.31Å; H688-A692 PolarHBondContact O-N 3.45Å; H688-K711 PolarHBondContact CE1-O 2.76Å; H688-K711 PolarHBondContact NE2-O 2.89Å; H688-N717 PolarHBondContact NE2-O 2.98Å; H688-P719 WeakPolarHBondContact NE2-CD 3.18Å
689	E	96.5	Very high	95.1	Very high	31 Å²	31	39.2 Å²	39.2	15%	0.145	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-48.7	176.9	-76.6	-61.9	147.4	0	0	111.7	H655 C658 S659 T685 A691 A692 K693	H655-E689 HydrophobicContact CB-CG 4.45Å; C658-E689 HydrophobicContact CB-CB 4.44Å; S659-E689 WeakPolarHBondContact CB-OE2 3.36Å; S659-E689 PolarHBondContact OG-OE2 3.48Å; T685-E689 PolarHBondContact O-N 3.36Å; E689-A691 VanDerWaalsContact C-N 3.33Å; E689-A691 PolarHBondContact O-N 2.74Å; E689-A692 PolarHBondContact O-N 3.09Å; E689-K693 WeakPolarHBondContact O-CB 3.47Å; E689-K693 WeakPolarHBondContact O-CG 3.46Å; E689-K693 PolarHBondContact O-N 3.48Å; E689-K693 VanDerWaalsContact O-N 3.12Å
690	A	96.8	Very high	95.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.7	-42.7	177.3	0	0	0	0	0	112.2	C658 P686 K693 G694 K695 I698 C699 L702	C658-A690 HydrophobicContact CB-CB 4.28Å; P686-A690 WeakPolarHBondContact O-CB 3.3Å; P686-A690 PolarHBondContact O-N 3.44Å; A690-K693 PolarHBondContact O-N 3.37Å; A690-G694 PolarHBondContact O-N 3.46Å; A690-K695 HydrophobicContact CB-CB 4.24Å; A690-K695 PolarHBondContact O-N 3.37Å; A690-I698 HydrophobicContact CB-CB 4.24Å; A690-I698 HydrophobicContact CB-CG2 3.81Å; A690-C699 VanDerWaalsContact C-SG 3.57Å; A690-C699 VanDerWaalsContact CB-SG 3.55Å; A690-L702 HydrophobicContact CB-CD1 4.12Å
691	A	96.2	Very high	95.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-49	178.8	0	0	0	0	0	112.2	L687 H688 E689 K693 G694 P719 V723 I730 L734	L687-A691 VanDerWaalsContact O-CB 3.24Å; L687-A691 WeakPolarHBondContact O-CB 3.47Å; L687-A691 PolarHBondContact O-N 2.98Å; H688-A691 PolarHBondContact O-N 3.25Å; E689-A691 VanDerWaalsContact C-N 3.33Å; E689-A691 PolarHBondContact O-N 2.74Å; A691-K693 PolarHBondContact O-N 3Å; A691-G694 PolarHBondContact O-N 2.93Å; A691-G694 VanDerWaalsContact O-N 3.16Å; A691-P719 HydrophobicContact CB-CB 4.19Å; A691-P719 WeakPolarHBondContact CB-O 3.37Å; A691-V723 HydrophobicContact CB-CG2 4.08Å; A691-I730 HydrophobicContact CB-CG2 4.46Å; A691-L734 HydrophobicContact CB-CD1 3.99Å
692	A	95	Very high	95.7	Very high	23 Å²	23	38.4 Å²	38.4	19%	0.19	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-27.2	179.2	0	0	0	0	0	113.7	H688 E689 M722 K724	H688-A692 VanDerWaalsContact O-CB 3.28Å; H688-A692 WeakPolarHBondContact O-CB 3.31Å; H688-A692 PolarHBondContact O-N 3.45Å; E689-A692 PolarHBondContact O-N 3.09Å; A692-M722 WeakPolarHBondContact CA-O 3.28Å; A692-M722 HydrophobicContact CB-CB 4.1Å; A692-K724 WeakPolarHBondContact O-CE 3.44Å
693	K	94.3	Very high	95.9	Very high	104 Å²	104	34.2 Å²	34.2	45%	0.452	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	6.8	-178.7	-54.3	-62.5	-174	-167.6	0	113.6	S659 E689 A690 A691 K695	S659-K693 WeakPolarHBondContact O-CB 3.32Å; S659-K693 WeakPolarHBondContact O-CG 3.37Å; S659-K693 WeakPolarHBondContact OG-CE 3.41Å; E689-K693 WeakPolarHBondContact O-CB 3.47Å; E689-K693 WeakPolarHBondContact O-CG 3.46Å; E689-K693 PolarHBondContact O-N 3.48Å; E689-K693 VanDerWaalsContact O-N 3.12Å; A690-K693 PolarHBondContact O-N 3.37Å; A691-K693 PolarHBondContact O-N 3Å; K693-K695 HydrophobicContact CB-CD 4.49Å; K693-K695 HydrophobicContact CB-CG 3.97Å; K693-K695 WeakPolarHBondContact O-CE 3.47Å
694	G	93.5	Very high	95.8	Very high	30 Å²	30	36.8 Å²	36.8	31%	0.309	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	28.3	174.6	0	0	0	0	0	114.5	A690 A691 Y696 I730	A690-G694 PolarHBondContact O-N 3.46Å; A691-G694 PolarHBondContact O-N 2.93Å; A691-G694 VanDerWaalsContact O-N 3.16Å; G694-Y696 PolarHBondContact O-N 3.49Å; G694-I730 VanDerWaalsContact CA-CD1 3.49Å
695	K	94.6	Very high	95.8	Very high	66 Å²	66	39.3 Å²	39.3	29%	0.287	19%	0.187	S	C	.	.			trans	-94.1	68.3	-169.8	-52.8	-57.6	-172.2	166.9	0	112.5	C658 Y660 A690 K693 E697 I698 C699	C658-K695 WeakPolarHBondContact O-CG 3.02Å; Y660-K695 WeakPolarHBondContact O-CE 3.27Å; Y660-K695 PolarHBondContact O-NZ 2.91Å; A690-K695 HydrophobicContact CB-CB 4.24Å; A690-K695 PolarHBondContact O-N 3.37Å; K693-K695 HydrophobicContact CB-CD 4.49Å; K693-K695 HydrophobicContact CB-CG 3.97Å; K693-K695 WeakPolarHBondContact O-CE 3.47Å; K695-E697 PolarHBondContact O-N 2.8Å; K695-I698 HydrophobicContact CB-CB 4.06Å; K695-I698 HydrophobicContact CB-CD1 4.35Å; K695-I698 HydrophobicContact CB-CG1 4.37Å; K695-I698 PolarHBondContact O-N 3.45Å; K695-C699 PolarHBondContact O-N 3.09Å
696	Y	93.4	Very high	95.6	Very high	72 Å²	72	41.6 Å²	41.6	28%	0.282	21%	0.211	S	C	.	.	H	α-helix	trans	-45.3	-55.2	-174.4	177.4	-94.8	0	0	0	114.9	G694 I698 C699 K700 D729 I730 L733	G694-Y696 PolarHBondContact O-N 3.49Å; Y696-I698 VanDerWaalsContact C-N 3.25Å; Y696-I698 PolarHBondContact O-N 3.24Å; Y696-C699 WeakPolarHBondContact O-CB 3.21Å; Y696-C699 PolarHBondContact O-N 3.16Å; Y696-C699 VanDerWaalsContact O-N 3.17Å; Y696-K700 HydrophobicContact CE1-CD 4.11Å; Y696-K700 WeakPolarHBondContact O-CB 3.41Å; Y696-K700 PolarHBondContact O-N 3.49Å; Y696-D729 HydrophobicContact CD2-CB 4.08Å; Y696-D729 HydrophobicContact CE2-CB 4.14Å; Y696-I730 HydrophobicContact CD2-CG1 4Å; Y696-L733 HydrophobicContact CD2-CD2 3.96Å; Y696-L733 HydrophobicContact CE2-CB 4.14Å; Y696-L733 HydrophobicContact CE2-CD2 3.79Å; Y696-L733 HydrophobicContact CE2-CG 4.45Å
697	E	95	Very high	95.5	Very high	95 Å²	95	41.9 Å²	41.9	44%	0.444	21%	0.214	S	C	.	.	H	α-helix	trans	-65.7	-27.4	-178.1	-65.7	-58.4	153.4	0	0	113	Y663 K695 K700 L701	Y663-E697 HydrophobicContact CD2-CB 4.04Å; Y663-E697 HydrophobicContact CE2-CB 4.23Å; K695-E697 PolarHBondContact O-N 2.8Å; E697-K700 WeakPolarHBondContact OE2-CD 3.26Å; E697-K700 IonicContact OE2-NZ 3.4Å; E697-L701 WeakPolarHBondContact O-CB 3.45Å; E697-L701 PolarHBondContact O-N 3.04Å
698	I	96.7	Very high	95.3	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-76.1	-41.3	173.9	-62.1	-173.2	0	0	0	110.7	C658 Y663 A690 K695 Y696 K700 L701 L702	C658-I698 HydrophobicContact CB-CG2 4.01Å; C658-I698 VanDerWaalsContact SG-CG2 3.51Å; Y663-I698 HydrophobicContact CD2-CG1 4.29Å; A690-I698 HydrophobicContact CB-CB 4.24Å; A690-I698 HydrophobicContact CB-CG2 3.81Å; K695-I698 HydrophobicContact CB-CB 4.06Å; K695-I698 HydrophobicContact CB-CD1 4.35Å; K695-I698 HydrophobicContact CB-CG1 4.37Å; K695-I698 PolarHBondContact O-N 3.45Å; Y696-I698 VanDerWaalsContact C-N 3.25Å; Y696-I698 PolarHBondContact O-N 3.24Å; I698-K700 PolarHBondContact O-N 3.12Å; I698-L701 PolarHBondContact O-N 3.03Å; I698-L702 HydrophobicContact CG2-CD1 3.94Å; I698-L702 HydrophobicContact CG2-CG 4.18Å; I698-L702 WeakPolarHBondContact O-CB 3.32Å; I698-L702 VanDerWaalsContact O-CG 3.24Å; I698-L702 WeakPolarHBondContact O-CG 3.5Å; I698-L702 PolarHBondContact O-N 3.13Å
699	C	96.4	Very high	95.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-54.8	-45	171.3	-65.6	0	0	0	0	110.7	L687 A690 K695 Y696 L702 L703 L733	L687-C699 HydrophobicContact CD1-CB 4.02Å; A690-C699 VanDerWaalsContact C-SG 3.57Å; A690-C699 VanDerWaalsContact CB-SG 3.55Å; K695-C699 PolarHBondContact O-N 3.09Å; Y696-C699 WeakPolarHBondContact O-CB 3.21Å; Y696-C699 PolarHBondContact O-N 3.16Å; Y696-C699 VanDerWaalsContact O-N 3.17Å; C699-L702 PolarHBondContact O-N 2.9Å; C699-L703 WeakPolarHBondContact O-CB 3.41Å; C699-L703 VanDerWaalsContact O-CG 3.23Å; C699-L703 WeakPolarHBondContact O-CG 3.32Å; C699-L703 PolarHBondContact O-N 3.07Å; C699-L733 HydrophobicContact CB-CD2 3.8Å
700	K	94.4	Very high	94.9	Very high	93 Å²	93	49.3 Å²	49.3	40%	0.404	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-44.1	178.1	-173.1	177.6	172.5	-171.3	0	112.7	Y696 E697 I698 K704 L733	Y696-K700 HydrophobicContact CE1-CD 4.11Å; Y696-K700 WeakPolarHBondContact O-CB 3.41Å; Y696-K700 PolarHBondContact O-N 3.49Å; E697-K700 WeakPolarHBondContact OE2-CD 3.26Å; E697-K700 IonicContact OE2-NZ 3.4Å; I698-K700 PolarHBondContact O-N 3.12Å; K700-K704 VanDerWaalsContact O-CB 3.32Å; K700-K704 WeakPolarHBondContact O-CB 3.49Å; K700-K704 PolarHBondContact O-N 3.32Å; K700-L733 HydrophobicContact CB-CD2 4.03Å
701	L	96.8	Very high	94.8	Very high	6 Å²	6	53 Å²	53	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-58.5	-49.2	173.1	177.2	68.7	0	0	0	111.5	Y663 A666 E667 E697 I698 K704 H705	Y663-L701 HydrophobicContact CD2-CD2 4.37Å; Y663-L701 HydrophobicContact CE2-CB 4.09Å; Y663-L701 HydrophobicContact CE2-CD2 4.08Å; Y663-L701 HydrophobicContact CE2-CG 4.48Å; A666-L701 HydrophobicContact CB-CD2 4.21Å; E667-L701 HydrophobicContact CB-CD1 4.48Å; E667-L701 HydrophobicContact CB-CD2 3.97Å; E667-L701 HydrophobicContact CG-CD1 4.25Å; E697-L701 WeakPolarHBondContact O-CB 3.45Å; E697-L701 PolarHBondContact O-N 3.04Å; I698-L701 PolarHBondContact O-N 3.03Å; L701-K704 WeakPolarHBondContact O-CB 3.39Å; L701-K704 PolarHBondContact O-N 2.82Å; L701-H705 PolarHBondContact O-CD2 3.2Å; L701-H705 VanDerWaalsContact O-CD2 3.31Å; L701-H705 PolarHBondContact O-N 3.47Å; L701-H705 VanDerWaalsContact O-N 3.1Å
702	L	97.3	Very high	94.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-45.6	-179	-70.3	173	0	0	0	111.8	L654 V676 P686 L687 A690 I698 C699 K704 H705 G706 A707	L654-L702 HydrophobicContact CD2-CD2 4.22Å; V676-L702 HydrophobicContact CB-CD2 4Å; V676-L702 HydrophobicContact CG1-CD2 3.74Å; P686-L702 HydrophobicContact CB-CD1 4.04Å; P686-L702 HydrophobicContact CB-CD2 4.18Å; P686-L702 WeakPolarHBondContact O-CD1 3.3Å; L687-L702 HydrophobicContact CB-CD1 4.13Å; L687-L702 HydrophobicContact CD1-CB 4.18Å; L687-L702 HydrophobicContact CD1-CD1 4.19Å; A690-L702 HydrophobicContact CB-CD1 4.12Å; I698-L702 HydrophobicContact CG2-CD1 3.94Å; I698-L702 HydrophobicContact CG2-CG 4.18Å; I698-L702 WeakPolarHBondContact O-CB 3.32Å; I698-L702 VanDerWaalsContact O-CG 3.24Å; I698-L702 WeakPolarHBondContact O-CG 3.5Å; I698-L702 PolarHBondContact O-N 3.13Å; C699-L702 PolarHBondContact O-N 2.9Å; L702-K704 PolarHBondContact O-N 3.16Å; L702-H705 CarbonylContact O-C 3.43Å; L702-H705 PolarHBondContact O-N 3.01Å; L702-H705 VanDerWaalsContact O-N 3.13Å; L702-G706 PolarHBondContact O-N 3.02Å; L702-A707 VanDerWaalsContact C-CB 3.46Å; L702-A707 HydrophobicContact CB-CB 3.82Å; L702-A707 WeakPolarHBondContact O-CB 3.33Å; L702-A707 PolarHBondContact O-N 3.28Å
703	L	94.6	Very high	94.5	Very high	42 Å²	42	58.5 Å²	58.5	22%	0.22	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-44	175.9	-71.2	168	0	0	0	111.6	L687 C699 H705 G706 P709 L733 L734	L687-L703 HydrophobicContact CD1-CG 4.36Å; L687-L703 HydrophobicContact CD2-CD2 3.9Å; L687-L703 HydrophobicContact CD2-CG 4.45Å; C699-L703 WeakPolarHBondContact O-CB 3.41Å; C699-L703 VanDerWaalsContact O-CG 3.23Å; C699-L703 WeakPolarHBondContact O-CG 3.32Å; C699-L703 PolarHBondContact O-N 3.07Å; L703-H705 PolarHBondContact O-N 3.45Å; L703-G706 PolarHBondContact O-N 3.14Å; L703-P709 HydrophobicContact CD2-CB 4.12Å; L703-P709 HydrophobicContact CD2-CG 4.15Å; L703-L733 HydrophobicContact CD1-CD1 3.96Å; L703-L733 HydrophobicContact CD1-CD2 4.2Å; L703-L733 HydrophobicContact CD1-CG 3.72Å; L703-L734 HydrophobicContact CD1-CD2 4.32Å
704	K	93.5	Very high	94.4	Very high	172 Å²	172	60.3 Å²	60.3	75%	0.748	30%	0.3	S	S	*	.	H	α-helix	trans	-57.6	-32.5	174.6	-177.9	-174	176.5	-170.3	0	112.7	K700 L701 L702	K700-K704 VanDerWaalsContact O-CB 3.32Å; K700-K704 WeakPolarHBondContact O-CB 3.49Å; K700-K704 PolarHBondContact O-N 3.32Å; L701-K704 WeakPolarHBondContact O-CB 3.39Å; L701-K704 PolarHBondContact O-N 2.82Å; L702-K704 PolarHBondContact O-N 3.16Å
705	H	95.3	Very high	94.3	Very high	87 Å²	87	64.1 Å²	64.1	40%	0.403	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	17.1	176	-75	-85	0	0	0	114	V670 V676 L701 L702 L703	V670-H705 HydrophobicContact CG1-CB 3.87Å; V670-H705 VanDerWaalsContact CG1-CG 3.5Å; V676-H705 HydrophobicContact CG1-CB 4.08Å; V676-H705 WeakPolarHBondContact CG2-O 3.44Å; L701-H705 PolarHBondContact O-CD2 3.2Å; L701-H705 VanDerWaalsContact O-CD2 3.31Å; L701-H705 PolarHBondContact O-N 3.47Å; L701-H705 VanDerWaalsContact O-N 3.1Å; L702-H705 CarbonylContact O-C 3.43Å; L702-H705 PolarHBondContact O-N 3.01Å; L702-H705 VanDerWaalsContact O-N 3.13Å; L703-H705 PolarHBondContact O-N 3.45Å
706	G	93.4	Very high	94.1	Very high	48 Å²	48	62.4 Å²	62.4	50%	0.495	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	23	170.3	0	0	0	0	0	115.5	N677 L702 L703	N677-G706 PolarHBondContact ND2-O 3.43Å; L702-G706 PolarHBondContact O-N 3.02Å; L703-G706 PolarHBondContact O-N 3.14Å
707	A	96.4	Very high	94.2	Very high	7 Å²	7	61.5 Å²	61.5	6%	0.058	31%	0.314	C	S	.	.			trans	-64	139.4	170.6	0	0	0	0	0	111.3	V676 N677 L687 L702 P709	V676-A707 HydrophobicContact CB-CB 4.18Å; V676-A707 HydrophobicContact CG2-CB 4.05Å; N677-A707 WeakPolarHBondContact OD1-CA 3.45Å; L687-A707 HydrophobicContact CB-CB 4.27Å; L687-A707 HydrophobicContact CD2-CB 3.91Å; L702-A707 VanDerWaalsContact C-CB 3.46Å; L702-A707 HydrophobicContact CB-CB 3.82Å; L702-A707 WeakPolarHBondContact O-CB 3.33Å; L702-A707 PolarHBondContact O-N 3.28Å; A707-P709 VanDerWaalsContact O-CD 3.3Å; A707-P709 WeakPolarHBondContact O-CD 3.24Å
708	D	93	Very high	94.3	Very high	49 Å²	49	58.6 Å²	58.6	26%	0.262	30%	0.302	S	S	.	.			trans	-90.6	108.3	-176.6	173.4	7.7	0	0	0	110.7	N677 T710 K711	N677-D708 PolarHBondContact OD1-N 3.28Å; D708-T710 PolarHBondContact O-N 3.03Å; D708-T710 WeakPolarHBondContact OD1-CA 3.43Å; D708-T710 WeakPolarHBondContact OD1-CB 3.24Å; D708-T710 PolarHBondContact OD1-N 2.82Å; D708-T710 PolarHBondContact OD1-OG1 2.86Å; D708-K711 HydrophobicContact CB-CB 4.25Å; D708-K711 HydrophobicContact CB-CD 4.37Å; D708-K711 WeakPolarHBondContact O-CB 3.5Å; D708-K711 PolarHBondContact O-N 3.48Å; D708-K711 PolarHBondContact OD1-N 2.8Å; D708-K711 WeakPolarHBondContact OD2-CD 3.33Å
709	P	93.6	Very high	94.2	Very high	39 Å²	39	58.4 Å²	58.4	25%	0.253	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-4.6	178.7	32.5	-36.1	0	0	0	113.4	L687 L703 A707 P719 L734	L687-P709 HydrophobicContact CD2-CB 4.3Å; L703-P709 HydrophobicContact CD2-CB 4.12Å; L703-P709 HydrophobicContact CD2-CG 4.15Å; A707-P709 VanDerWaalsContact O-CD 3.3Å; A707-P709 WeakPolarHBondContact O-CD 3.24Å; P709-P719 WeakPolarHBondContact O-CD 3.24Å; P709-L734 HydrophobicContact CB-CD2 4.17Å
710	T	93.6	Very high	94.1	Very high	98 Å²	98	60 Å²	60	60%	0.601	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-4.2	178.5	74.6	0	0	0	0	113.1	D708 K712 I718	D708-T710 PolarHBondContact O-N 3.03Å; D708-T710 WeakPolarHBondContact OD1-CA 3.43Å; D708-T710 WeakPolarHBondContact OD1-CB 3.24Å; D708-T710 PolarHBondContact OD1-N 2.82Å; D708-T710 PolarHBondContact OD1-OG1 2.86Å; T710-K712 PolarHBondContact O-N 2.87Å; T710-I718 WeakPolarHBondContact O-CG2 3.48Å
711	K	93	Very high	94.1	Very high	79 Å²	79	59.8 Å²	59.8	34%	0.343	31%	0.312	S	S	.	.			trans	-60.1	127.1	178.5	-158.4	92.7	176.4	-168.8	0	110.4	T685 H688 D708 P719	T685-K711 HydrophobicContact CG2-CB 4.44Å; T685-K711 HydrophobicContact CG2-CG 3.89Å; H688-K711 PolarHBondContact CE1-O 2.76Å; H688-K711 PolarHBondContact NE2-O 2.89Å; D708-K711 HydrophobicContact CB-CB 4.25Å; D708-K711 HydrophobicContact CB-CD 4.37Å; D708-K711 WeakPolarHBondContact O-CB 3.5Å; D708-K711 PolarHBondContact O-N 3.48Å; D708-K711 PolarHBondContact OD1-N 2.8Å; D708-K711 WeakPolarHBondContact OD2-CD 3.33Å; K711-P719 WeakPolarHBondContact O-CD 3.13Å
712	K	94.7	Very high	93.9	Very high	133 Å²	133	61.9 Å²	61.9	58%	0.578	32%	0.323	S	S	*	.			trans	-94.7	135.1	177.4	-68.2	-175.1	171.9	-142.6	0	112.9	T710 G716 N717 I718	T710-K712 PolarHBondContact O-N 2.87Å; K712-G716 VanDerWaalsContact CD-O 3.28Å; K712-G716 WeakPolarHBondContact CD-O 3.44Å; K712-G716 WeakPolarHBondContact CG-O 3.38Å; K712-G716 PolarHBondContact NZ-O 3.48Å; K712-N717 CarbonylContact C-O 3.58Å; K712-N717 VanDerWaalsContact CA-O 3.32Å; K712-N717 WeakPolarHBondContact CA-O 3.4Å; K712-I718 HydrophobicContact CG-CG2 3.61Å
713	N	91.8	Very high	93.8	Very high	5 Å²	5	62.6 Å²	62.6	3%	0.027	33%	0.327	C	S	.	.			trans	-71.2	-172.8	168.3	85.8	-14.3	0	0	0	111.5	F684 D715 G716 N717	F684-N713 HydrophobicContact CD2-CB 4.04Å; F684-N713 HydrophobicContact CE2-CB 4.06Å; F684-N713 WeakPolarHBondContact CE2-ND2 3.34Å; F684-N713 VanDerWaalsContact CZ-ND2 3.26Å; F684-N713 WeakPolarHBondContact CZ-ND2 3.21Å; N713-D715 VanDerWaalsContact C-N 3.32Å; N713-D715 PolarHBondContact ND2-OD2 3.01Å; N713-D715 PolarHBondContact O-N 2.67Å; N713-D715 WeakPolarHBondContact OD1-CA 3.16Å; N713-D715 WeakPolarHBondContact OD1-CB 3.36Å; N713-D715 PolarHBondContact OD1-N 3.23Å; N713-G716 PolarHBondContact O-N 2.66Å; N713-G716 PolarHBondContact OD1-N 2.9Å; N713-N717 PolarHBondContact N-O 3.49Å; N713-N717 PolarHBondContact OD1-N 3.26Å; N713-N717 PolarHBondContact OD1-O 3.49Å
714	R	92.5	Very high	93.5	Very high	141 Å²	141	66.5 Å²	66.5	53%	0.532	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-31.3	178.8	-179.5	173.6	179.4	162.4	0.2	113.5	W682 G716	W682-R714 WeakPolarHBondContact O-CB 3.17Å; W682-R714 PolarHBondContact O-N 3.35Å; R714-G716 VanDerWaalsContact C-N 3.28Å
715	D	90.3	Very high	92.8	Very high	110 Å²	110	66.4 Å²	66.4	59%	0.588	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-9.7	-179.5	-44.6	-55.9	0	0	0	112.3	N713	N713-D715 VanDerWaalsContact C-N 3.32Å; N713-D715 PolarHBondContact ND2-OD2 3.01Å; N713-D715 PolarHBondContact O-N 2.67Å; N713-D715 WeakPolarHBondContact OD1-CA 3.16Å; N713-D715 WeakPolarHBondContact OD1-CB 3.36Å; N713-D715 PolarHBondContact OD1-N 3.23Å
716	G	91.3	Very high	92.1	Very high	30 Å²	30	65 Å²	65	31%	0.309	36%	0.359	S	S	.	.	S	Bend	trans	95.1	-0	-179.7	0	0	0	0	0	114.6	K712 N713 R714	K712-G716 VanDerWaalsContact CD-O 3.28Å; K712-G716 WeakPolarHBondContact CD-O 3.44Å; K712-G716 WeakPolarHBondContact CG-O 3.38Å; K712-G716 PolarHBondContact NZ-O 3.48Å; N713-G716 PolarHBondContact O-N 2.66Å; N713-G716 PolarHBondContact OD1-N 2.9Å; R714-G716 VanDerWaalsContact C-N 3.28Å
717	N	95.2	Very high	91.8	Very high	53 Å²	53	65.6 Å²	65.6	28%	0.283	35%	0.351	S	S	.	.			trans	-73.7	140.4	177.9	-62.7	-18.8	0	0	0	110.6	H688 K712 N713 D721 M722	H688-N717 PolarHBondContact NE2-O 2.98Å; K712-N717 CarbonylContact C-O 3.58Å; K712-N717 VanDerWaalsContact CA-O 3.32Å; K712-N717 WeakPolarHBondContact CA-O 3.4Å; N713-N717 PolarHBondContact N-O 3.49Å; N713-N717 PolarHBondContact OD1-N 3.26Å; N713-N717 PolarHBondContact OD1-O 3.49Å; N717-D721 WeakPolarHBondContact CA-OD2 3.48Å; N717-D721 HydrophobicContact CB-CB 4.03Å; N717-M722 HydrophobicContact CB-SD 4.48Å
718	I	96.3	Very high	91.3	Very high	35 Å²	35	68.9 Å²	68.9	18%	0.179	37%	0.371	C	S	.	.			trans	-92	167.4	165	58.8	162.9	0	0	0	110.3	T710 K712 L720 D721	T710-I718 WeakPolarHBondContact O-CG2 3.48Å; K712-I718 HydrophobicContact CG-CG2 3.61Å; I718-L720 HydrophobicContact CD1-CB 3.78Å; I718-L720 HydrophobicContact CD1-CD2 4.32Å; I718-L720 HydrophobicContact CG1-CB 4.03Å; I718-L720 PolarHBondContact O-N 2.9Å; I718-L720 VanDerWaalsContact O-N 3.07Å; I718-D721 VanDerWaalsContact CG1-OD2 3.23Å; I718-D721 WeakPolarHBondContact CG1-OD2 3.48Å; I718-D721 PolarHBondContact N-OD2 3.25Å; I718-D721 PolarHBondContact O-N 3.45Å
719	P	95.3	Very high	91.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-52.4	-32.6	177.3	-29.1	34.9	0	0	0	114.3	L687 H688 A691 P709 K711 D721 M722 L734	L687-P719 HydrophobicContact CB-CG 4.38Å; L687-P719 HydrophobicContact CD2-CB 4.37Å; L687-P719 HydrophobicContact CD2-CG 4.06Å; L687-P719 HydrophobicContact CG-CB 4.04Å; L687-P719 HydrophobicContact CG-CG 4.01Å; H688-P719 WeakPolarHBondContact NE2-CD 3.18Å; A691-P719 HydrophobicContact CB-CB 4.19Å; A691-P719 WeakPolarHBondContact CB-O 3.37Å; P709-P719 WeakPolarHBondContact O-CD 3.24Å; K711-P719 WeakPolarHBondContact O-CD 3.13Å; P719-D721 VanDerWaalsContact C-N 3.35Å; P719-D721 PolarHBondContact O-N 2.96Å; P719-M722 PolarHBondContact O-N 3.25Å; P719-L734 HydrophobicContact CB-CD1 4.17Å; P719-L734 HydrophobicContact CB-CD2 4.25Å
720	L	94.9	Very high	91	Very high	32 Å²	32	68.1 Å²	68.1	17%	0.168	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-63.4	-37.3	176.8	177.4	64.4	0	0	0	112.8	I718 M722 V723 Q731 L734 R735	I718-L720 HydrophobicContact CD1-CB 3.78Å; I718-L720 HydrophobicContact CD1-CD2 4.32Å; I718-L720 HydrophobicContact CG1-CB 4.03Å; I718-L720 PolarHBondContact O-N 2.9Å; I718-L720 VanDerWaalsContact O-N 3.07Å; L720-M722 PolarHBondContact O-N 3.43Å; L720-V723 WeakPolarHBondContact O-CB 3.27Å; L720-V723 WeakPolarHBondContact O-CG2 3.45Å; L720-V723 PolarHBondContact O-N 2.85Å; L720-Q731 HydrophobicContact CD1-CB 3.98Å; L720-Q731 HydrophobicContact CD1-CG 4.19Å; L720-L734 HydrophobicContact CB-CB 4.34Å; L720-L734 HydrophobicContact CB-CD1 4.37Å; L720-L734 HydrophobicContact CD1-CB 4.23Å; L720-R735 HydrophobicContact CD1-CG 4.25Å; L720-R735 HydrophobicContact CD2-CG 3.74Å
721	D	93.9	Very high	90.9	Very high	90 Å²	90	65.6 Å²	65.6	48%	0.481	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-72.9	-12.1	-179.7	-52.1	-34.6	0	0	0	112	N717 I718 P719	N717-D721 WeakPolarHBondContact CA-OD2 3.48Å; N717-D721 HydrophobicContact CB-CB 4.03Å; I718-D721 VanDerWaalsContact CG1-OD2 3.23Å; I718-D721 WeakPolarHBondContact CG1-OD2 3.48Å; I718-D721 PolarHBondContact N-OD2 3.25Å; I718-D721 PolarHBondContact O-N 3.45Å; P719-D721 VanDerWaalsContact C-N 3.35Å; P719-D721 PolarHBondContact O-N 2.96Å
722	M	92.9	Very high	90.8	Very high	50 Å²	50	62.3 Å²	62.3	25%	0.246	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-94.8	-9.4	178	-55.7	-90.3	56.4	0	0	112.8	F684 A692 N717 P719 L720	F684-M722 HydrophobicContact CE1-SD 3.61Å; F684-M722 HydrophobicContact CZ-SD 3.77Å; A692-M722 WeakPolarHBondContact CA-O 3.28Å; A692-M722 HydrophobicContact CB-CB 4.1Å; N717-M722 HydrophobicContact CB-SD 4.48Å; P719-M722 PolarHBondContact O-N 3.25Å; L720-M722 PolarHBondContact O-N 3.43Å
723	V	94.4	Very high	90.6	Very high	14 Å²	14	57.9 Å²	57.9	9%	0.085	31%	0.314	C	S	.	.	S	Bend	trans	-69.5	136.6	177.7	-175.9	0	0	0	0	109.7	A691 L720 D727 I730 Q731 L734	A691-V723 HydrophobicContact CB-CG2 4.08Å; L720-V723 WeakPolarHBondContact O-CB 3.27Å; L720-V723 WeakPolarHBondContact O-CG2 3.45Å; L720-V723 PolarHBondContact O-N 2.85Å; V723-D727 HydrophobicContact CG1-CB 3.59Å; V723-I730 HydrophobicContact CG1-CB 4.04Å; V723-I730 HydrophobicContact CG1-CG2 4.18Å; V723-I730 HydrophobicContact CG2-CB 4.37Å; V723-I730 HydrophobicContact CG2-CG2 3.64Å; V723-Q731 HydrophobicContact CB-CG 4.1Å; V723-Q731 HydrophobicContact CG1-CG 3.64Å; V723-L734 HydrophobicContact CG2-CD1 3.63Å
724	K	88.4	Confident	90.6	Very high	124 Å²	124	58.3 Å²	58.3	54%	0.539	32%	0.317	S	S	.	.			trans	-69.7	150.4	-179.2	-62.3	176.1	-176.7	172.9	0	111.7	A692 G726 D727	A692-K724 WeakPolarHBondContact O-CE 3.44Å; K724-G726 PolarHBondContact O-N 3.46Å; K724-D727 PolarHBondContact O-N 2.67Å; K724-D727 VanDerWaalsContact O-N 3.14Å
725	D	79.1	Confident	90.5	Very high	170 Å²	170	56.7 Å²	56.7	91%	0.909	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	111.1	170.7	-69.6	-45.7	0	0	0	110.3
726	G	80.1	Confident	90.4	Very high	59 Å²	59	53.1 Å²	53.1	61%	0.608	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.9	-22.1	-178.5	0	0	0	0	0	115	K724 T728	K724-G726 PolarHBondContact O-N 3.46Å; G726-T728 PolarHBondContact O-N 3Å
727	D	86.6	Confident	90.4	Very high	59 Å²	59	55.1 Å²	55.1	32%	0.316	30%	0.303	S	S	.	.			trans	-79.8	58.2	-179	-74	-26.2	0	0	0	111.9	V723 K724 D729 I730 Q731	V723-D727 HydrophobicContact CG1-CB 3.59Å; K724-D727 PolarHBondContact O-N 2.67Å; K724-D727 VanDerWaalsContact O-N 3.14Å; D727-D729 PolarHBondContact O-N 2.94Å; D727-D729 VanDerWaalsContact O-N 3.1Å; D727-I730 HydrophobicContact CB-CD1 4.48Å; D727-I730 PolarHBondContact O-N 2.99Å; D727-I730 VanDerWaalsContact O-N 3.08Å; D727-Q731 PolarHBondContact O-N 3.48Å; D727-Q731 VanDerWaalsContact O-N 3.15Å
728	T	86.9	Confident	90.2	Very high	77 Å²	77	55.2 Å²	55.2	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-53.9	-34	-174.1	54.3	0	0	0	0	113.6	G726 I730 Q731 D732	G726-T728 PolarHBondContact O-N 3Å; T728-I730 VanDerWaalsContact C-N 3.35Å; T728-I730 PolarHBondContact O-N 3.29Å; T728-Q731 PolarHBondContact O-N 3.18Å; T728-D732 WeakPolarHBondContact O-CB 3.33Å; T728-D732 PolarHBondContact O-N 3.14Å
729	D	87.6	Confident	89.9	Confident	67 Å²	67	53.6 Å²	53.6	36%	0.358	30%	0.303	S	S	.	.	H	α-helix	trans	-68.3	-34	-177.7	-75.1	10	0	0	0	112.7	Y696 D727 L733 K754	Y696-D729 HydrophobicContact CD2-CB 4.08Å; Y696-D729 HydrophobicContact CE2-CB 4.14Å; D727-D729 PolarHBondContact O-N 2.94Å; D727-D729 VanDerWaalsContact O-N 3.1Å; D729-L733 WeakPolarHBondContact O-CB 3.36Å; D729-L733 PolarHBondContact O-N 3.04Å; D729-L733 VanDerWaalsContact O-N 3.09Å; D729-K754 IonicContact OD1-NZ 3.31Å; D729-K754 PolarHBondContact OD1-NZ 3.27Å; D729-K754 IonicContact OD2-NZ 2.7Å; D729-K754 PolarHBondContact OD2-NZ 3.37Å
730	I	91.7	Very high	89.8	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-80	-36.5	175.3	-59.3	175.7	0	0	0	109.8	A691 G694 Y696 V723 D727 T728 L733 L734	A691-I730 HydrophobicContact CB-CG2 4.46Å; G694-I730 VanDerWaalsContact CA-CD1 3.49Å; Y696-I730 HydrophobicContact CD2-CG1 4Å; V723-I730 HydrophobicContact CG1-CB 4.04Å; V723-I730 HydrophobicContact CG1-CG2 4.18Å; V723-I730 HydrophobicContact CG2-CB 4.37Å; V723-I730 HydrophobicContact CG2-CG2 3.64Å; D727-I730 HydrophobicContact CB-CD1 4.48Å; D727-I730 PolarHBondContact O-N 2.99Å; D727-I730 VanDerWaalsContact O-N 3.08Å; T728-I730 VanDerWaalsContact C-N 3.35Å; T728-I730 PolarHBondContact O-N 3.29Å; I730-L733 PolarHBondContact O-N 3.38Å; I730-L734 HydrophobicContact CG2-CD1 3.78Å; I730-L734 HydrophobicContact CG2-CG 4.26Å; I730-L734 WeakPolarHBondContact O-CB 3.45Å; I730-L734 WeakPolarHBondContact O-CG 3.3Å; I730-L734 PolarHBondContact O-N 2.78Å
731	Q	91.8	Very high	89.8	Confident	44 Å²	44	52.8 Å²	52.8	21%	0.206	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-46	173.8	-63	-176	8.1	0	0	111.7	L720 V723 D727 T728 R735	L720-Q731 HydrophobicContact CD1-CB 3.98Å; L720-Q731 HydrophobicContact CD1-CG 4.19Å; V723-Q731 HydrophobicContact CB-CG 4.1Å; V723-Q731 HydrophobicContact CG1-CG 3.64Å; D727-Q731 PolarHBondContact O-N 3.48Å; D727-Q731 VanDerWaalsContact O-N 3.15Å; T728-Q731 PolarHBondContact O-N 3.18Å; Q731-R735 WeakPolarHBondContact O-CB 3.13Å; Q731-R735 WeakPolarHBondContact O-CD 3.49Å; Q731-R735 WeakPolarHBondContact O-CG 3.3Å; Q731-R735 PolarHBondContact O-N 3.37Å; Q731-R735 VanDerWaalsContact O-N 3.12Å
732	D	90.8	Very high	89.7	Confident	10 Å²	10	50.3 Å²	50.3	5%	0.053	29%	0.285	C	S	.	.	H	α-helix	trans	-70.5	-40.2	179.1	-75.4	-12.5	0	0	0	111.4	T728 L734 R735 G736 A739 R751 L755	T728-D732 WeakPolarHBondContact O-CB 3.33Å; T728-D732 PolarHBondContact O-N 3.14Å; D732-L734 PolarHBondContact O-N 3.04Å; D732-R735 PolarHBondContact O-N 3.33Å; D732-G736 PolarHBondContact O-N 3.01Å; D732-A739 HydrophobicContact CB-CB 3.92Å; D732-A739 WeakPolarHBondContact OD1-CB 3.35Å; D732-R751 VanDerWaalsContact CG-NH2 3.31Å; D732-R751 IonicContact OD1-CZ 2.67Å; D732-R751 IonicContact OD1-NE 3.85Å; D732-R751 IonicContact OD1-NH2 3.64Å; D732-R751 PolarHBondContact OD1-NH2 2.92Å; D732-R751 IonicContact OD2-CZ 3.55Å; D732-R751 IonicContact OD2-NE 2.67Å; D732-R751 PolarHBondContact OD2-NE 3.04Å; D732-R751 IonicContact OD2-NH2 2.69Å; D732-R751 PolarHBondContact OD2-NH2 3.36Å; D732-R751 VanDerWaalsContact OD2-NH2 3.16Å; D732-L755 HydrophobicContact CB-CD1 4.14Å; D732-L755 HydrophobicContact CB-CD2 3.78Å
733	L	90.3	Very high	89.7	Confident	41 Å²	41	48 Å²	48	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-43.7	174.2	176.8	65.8	0	0	0	112.9	Y696 C699 K700 L703 D729 I730	Y696-L733 HydrophobicContact CD2-CD2 3.96Å; Y696-L733 HydrophobicContact CE2-CB 4.14Å; Y696-L733 HydrophobicContact CE2-CD2 3.79Å; Y696-L733 HydrophobicContact CE2-CG 4.45Å; C699-L733 HydrophobicContact CB-CD2 3.8Å; K700-L733 HydrophobicContact CB-CD2 4.03Å; L703-L733 HydrophobicContact CD1-CD1 3.96Å; L703-L733 HydrophobicContact CD1-CD2 4.2Å; L703-L733 HydrophobicContact CD1-CG 3.72Å; D729-L733 WeakPolarHBondContact O-CB 3.36Å; D729-L733 PolarHBondContact O-N 3.04Å; D729-L733 VanDerWaalsContact O-N 3.09Å; I730-L733 PolarHBondContact O-N 3.38Å
734	L	92.3	Very high	89.7	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-75.7	-23.3	-179.9	-70.9	171.2	0	0	0	113.3	L687 A691 L703 P709 P719 L720 V723 I730 D732	L687-L734 HydrophobicContact CD1-CD2 4.03Å; L687-L734 HydrophobicContact CD2-CD2 4.02Å; L687-L734 HydrophobicContact CG-CD2 4.15Å; A691-L734 HydrophobicContact CB-CD1 3.99Å; L703-L734 HydrophobicContact CD1-CD2 4.32Å; P709-L734 HydrophobicContact CB-CD2 4.17Å; P719-L734 HydrophobicContact CB-CD1 4.17Å; P719-L734 HydrophobicContact CB-CD2 4.25Å; L720-L734 HydrophobicContact CB-CB 4.34Å; L720-L734 HydrophobicContact CB-CD1 4.37Å; L720-L734 HydrophobicContact CD1-CB 4.23Å; V723-L734 HydrophobicContact CG2-CD1 3.63Å; I730-L734 HydrophobicContact CG2-CD1 3.78Å; I730-L734 HydrophobicContact CG2-CG 4.26Å; I730-L734 WeakPolarHBondContact O-CB 3.45Å; I730-L734 WeakPolarHBondContact O-CG 3.3Å; I730-L734 PolarHBondContact O-N 2.78Å; D732-L734 PolarHBondContact O-N 3.04Å
735	R	90.4	Very high	90	Very high	107 Å²	107	45.6 Å²	45.6	40%	0.404	26%	0.262	S	S	.	.	H	α-helix	trans	-81.9	-25.3	174.2	-77.1	174.4	179.1	-175.9	2.7	113.3	L720 Q731 D732 D737 A738 A739	L720-R735 HydrophobicContact CD1-CG 4.25Å; L720-R735 HydrophobicContact CD2-CG 3.74Å; Q731-R735 WeakPolarHBondContact O-CB 3.13Å; Q731-R735 WeakPolarHBondContact O-CD 3.49Å; Q731-R735 WeakPolarHBondContact O-CG 3.3Å; Q731-R735 PolarHBondContact O-N 3.37Å; Q731-R735 VanDerWaalsContact O-N 3.12Å; D732-R735 PolarHBondContact O-N 3.33Å; R735-D737 PolarHBondContact O-N 2.97Å; R735-A738 HydrophobicContact CB-CB 4.43Å; R735-A738 WeakPolarHBondContact O-CB 3.49Å; R735-A738 PolarHBondContact O-N 3.47Å; R735-A739 HydrophobicContact CB-CB 3.86Å
736	G	88.6	Confident	90.6	Very high	34 Å²	34	43.9 Å²	43.9	35%	0.351	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	-132.3	-177.4	0	0	0	0	0	111.9	D732 A738 A739	D732-G736 PolarHBondContact O-N 3.01Å; G736-A738 PolarHBondContact O-N 2.91Å; G736-A739 WeakPolarHBondContact O-CB 3.26Å; G736-A739 PolarHBondContact O-N 3.16Å
737	D	90.2	Very high	91.2	Very high	73 Å²	73	42.3 Å²	42.3	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-48.2	-33.4	178.9	-64.3	4.9	0	0	0	114.1	R735 A739 L740 L741 N760 C763	R735-D737 PolarHBondContact O-N 2.97Å; D737-A739 VanDerWaalsContact C-N 3.26Å; D737-A739 PolarHBondContact O-N 2.92Å; D737-L740 PolarHBondContact O-N 2.91Å; D737-L741 WeakPolarHBondContact O-CG 3.27Å; D737-L741 PolarHBondContact O-N 3.07Å; D737-N760 WeakPolarHBondContact OD1-CB 3.26Å; D737-C763 HydrophobicContact CB-CB 3.69Å; D737-C763 VanDerWaalsContact CG-CB 3.42Å; D737-C763 WeakPolarHBondContact OD2-CB 3.45Å
738	A	90.9	Very high	91.5	Very high	55 Å²	55	41.8 Å²	41.8	46%	0.455	23%	0.231	S	C	.	.	H	α-helix	trans	-64.7	-29.7	178	0	0	0	0	0	112.9	R735 G736 D742	R735-A738 HydrophobicContact CB-CB 4.43Å; R735-A738 WeakPolarHBondContact O-CB 3.49Å; R735-A738 PolarHBondContact O-N 3.47Å; G736-A738 PolarHBondContact O-N 2.91Å; A738-D742 WeakPolarHBondContact O-CB 3.35Å; A738-D742 PolarHBondContact O-N 3.3Å
739	A	91.4	Very high	91.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-72.7	-37.7	173.7	0	0	0	0	0	112.1	D732 R735 G736 D737 D742 A743 L755	D732-A739 HydrophobicContact CB-CB 3.92Å; D732-A739 WeakPolarHBondContact OD1-CB 3.35Å; R735-A739 HydrophobicContact CB-CB 3.86Å; G736-A739 WeakPolarHBondContact O-CB 3.26Å; G736-A739 PolarHBondContact O-N 3.16Å; D737-A739 VanDerWaalsContact C-N 3.26Å; D737-A739 PolarHBondContact O-N 2.92Å; A739-D742 PolarHBondContact O-N 3.23Å; A739-A743 VanDerWaalsContact O-CB 3.28Å; A739-A743 WeakPolarHBondContact O-CB 3.16Å; A739-A743 PolarHBondContact O-N 3.39Å; A739-L755 HydrophobicContact CB-CD1 3.73Å
740	L	93.8	Very high	91.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-44.7	174.4	178.8	59.5	0	0	0	111.2	D737 A743 A744 V752 L755 C756 N760 P773	D737-L740 PolarHBondContact O-N 2.91Å; L740-A743 PolarHBondContact O-N 3.28Å; L740-A744 WeakPolarHBondContact O-CB 3.31Å; L740-A744 PolarHBondContact O-N 2.92Å; L740-V752 HydrophobicContact CD1-CB 4.38Å; L740-V752 HydrophobicContact CD1-CG1 3.99Å; L740-V752 HydrophobicContact CD1-CG2 4.39Å; L740-L755 HydrophobicContact CB-CB 4.35Å; L740-L755 HydrophobicContact CD1-CB 4.31Å; L740-C756 HydrophobicContact CD1-CB 4.04Å; L740-C756 HydrophobicContact CD2-CB 4.46Å; L740-N760 HydrophobicContact CD2-CB 4.47Å; L740-N760 VanDerWaalsContact CD2-OD1 3.31Å; L740-N760 WeakPolarHBondContact CD2-OD1 3.3Å; L740-P773 HydrophobicContact CD2-CG 4.08Å; L740-P773 HydrophobicContact CG-CG 3.97Å
741	L	93.3	Very high	91.8	Very high	16 Å²	16	42.7 Å²	42.7	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-43.7	175.1	-69.4	162.7	0	0	0	112	D737 A744 K745 D765 P773 L776	D737-L741 WeakPolarHBondContact O-CG 3.27Å; D737-L741 PolarHBondContact O-N 3.07Å; L741-A744 PolarHBondContact O-N 3.09Å; L741-K745 WeakPolarHBondContact O-CB 3.45Å; L741-K745 PolarHBondContact O-N 2.87Å; L741-D765 HydrophobicContact CD1-CB 4.13Å; L741-P773 HydrophobicContact CD2-CG 3.9Å; L741-P773 HydrophobicContact CG-CG 4.5Å; L741-L776 HydrophobicContact CB-CD1 3.86Å; L741-L776 HydrophobicContact CD2-CD1 3.68Å; L741-L776 HydrophobicContact CG-CD1 4.4Å; L741-L776 WeakPolarHBondContact O-CD1 3.21Å
742	D	92.8	Very high	91.9	Very high	38 Å²	38	40.6 Å²	40.6	20%	0.203	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-44.6	174.7	177	72.4	0	0	0	112.6	A738 A739 A744 K745 K746 R751	A738-D742 WeakPolarHBondContact O-CB 3.35Å; A738-D742 PolarHBondContact O-N 3.3Å; A739-D742 PolarHBondContact O-N 3.23Å; D742-A744 VanDerWaalsContact C-N 3.33Å; D742-A744 PolarHBondContact O-N 3.05Å; D742-K745 PolarHBondContact O-N 3.47Å; D742-K746 WeakPolarHBondContact O-CB 3.43Å; D742-K746 WeakPolarHBondContact O-CG 3.44Å; D742-K746 PolarHBondContact O-N 3.33Å; D742-K746 WeakPolarHBondContact OD1-CE 3.4Å; D742-K746 IonicContact OD1-NZ 3.7Å; D742-K746 PolarHBondContact OD1-NZ 3.31Å; D742-K746 IonicContact OD2-NZ 3.63Å; D742-K746 PolarHBondContact OD2-NZ 3.15Å; D742-R751 IonicContact OD2-CZ 2.66Å; D742-R751 IonicContact OD2-NH1 3.32Å; D742-R751 PolarHBondContact OD2-NH1 3.47Å; D742-R751 IonicContact OD2-NH2 3.17Å
743	A	93.1	Very high	91.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-41.9	177.1	0	0	0	0	0	111.5	A739 L740 K746 G747 C748 R751 V752	A739-A743 VanDerWaalsContact O-CB 3.28Å; A739-A743 WeakPolarHBondContact O-CB 3.16Å; A739-A743 PolarHBondContact O-N 3.39Å; L740-A743 PolarHBondContact O-N 3.28Å; A743-K746 PolarHBondContact O-N 3.47Å; A743-G747 PolarHBondContact O-N 3.32Å; A743-G747 VanDerWaalsContact O-N 3.09Å; A743-C748 PolarHBondContact O-N 3.11Å; A743-R751 HydrophobicContact CB-CB 3.77Å; A743-V752 HydrophobicContact CB-CG2 3.75Å
744	A	94.6	Very high	91.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.5	-36.4	178.4	0	0	0	0	0	113.1	L740 L741 D742 V752 P773 N782 V785 L789	L740-A744 WeakPolarHBondContact O-CB 3.31Å; L740-A744 PolarHBondContact O-N 2.92Å; L741-A744 PolarHBondContact O-N 3.09Å; D742-A744 VanDerWaalsContact C-N 3.33Å; D742-A744 PolarHBondContact O-N 3.05Å; A744-V752 HydrophobicContact CB-CG2 4.31Å; A744-P773 HydrophobicContact CB-CB 3.77Å; A744-N782 PolarHBondContact O-ND2 3.44Å; A744-V785 HydrophobicContact CB-CG1 4.07Å; A744-L789 HydrophobicContact CB-CD1 4.4Å
745	K	94	Very high	91.7	Very high	88 Å²	88	49.5 Å²	49.5	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-65.5	-36.8	171.8	176.2	173.4	170.5	170.4	0	112.9	L741 D742 L776 Y780 N782	L741-K745 WeakPolarHBondContact O-CB 3.45Å; L741-K745 PolarHBondContact O-N 2.87Å; D742-K745 PolarHBondContact O-N 3.47Å; K745-L776 HydrophobicContact CB-CB 4.12Å; K745-L776 HydrophobicContact CB-CD1 4.32Å; K745-Y780 HydrophobicContact CD-CE1 4.46Å; K745-Y780 HydrophobicContact CD-CE2 4.2Å; K745-Y780 VanDerWaalsContact CE-CZ 3.45Å; K745-Y780 VanDerWaalsContact CE-OH 3.29Å; K745-Y780 WeakPolarHBondContact CE-OH 3.49Å; K745-Y780 HydrophobicContact CG-CD1 4.22Å; K745-Y780 HydrophobicContact CG-CD2 4.03Å; K745-Y780 HydrophobicContact CG-CE1 4.14Å; K745-Y780 HydrophobicContact CG-CE2 3.96Å; K745-Y780 HydrophobicContact CG-CG 4.17Å; K745-Y780 PolarHBondContact NZ-OH 3.03Å; K745-N782 VanDerWaalsContact C-ND2 3.33Å; K745-N782 PolarHBondContact O-ND2 3.09Å
746	K	91.6	Very high	91.7	Very high	135 Å²	135	45.5 Å²	45.5	59%	0.587	26%	0.255	S	S	*	.	H	α-helix	trans	-86.7	-5.1	-179	-73	173.6	178.1	157.6	0	114.7	D742 A743 C748	D742-K746 WeakPolarHBondContact O-CB 3.43Å; D742-K746 WeakPolarHBondContact O-CG 3.44Å; D742-K746 PolarHBondContact O-N 3.33Å; D742-K746 WeakPolarHBondContact OD1-CE 3.4Å; D742-K746 IonicContact OD1-NZ 3.7Å; D742-K746 PolarHBondContact OD1-NZ 3.31Å; D742-K746 IonicContact OD2-NZ 3.63Å; D742-K746 PolarHBondContact OD2-NZ 3.15Å; A743-K746 PolarHBondContact O-N 3.47Å; K746-C748 VanDerWaalsContact C-N 3.32Å; K746-C748 PolarHBondContact O-N 3.06Å
747	G	92.5	Very high	91.8	Very high	26 Å²	26	45.7 Å²	45.7	27%	0.268	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	22.2	-177.2	0	0	0	0	0	114.2	A743 L749 N782	A743-G747 PolarHBondContact O-N 3.32Å; A743-G747 VanDerWaalsContact O-N 3.09Å; G747-L749 PolarHBondContact O-N 3.31Å; G747-L749 VanDerWaalsContact O-N 3.08Å; G747-N782 WeakPolarHBondContact CA-OD1 3.35Å; G747-N782 PolarHBondContact N-ND2 3.35Å
748	C	92.5	Very high	91.7	Very high	48 Å²	48	47.6 Å²	47.6	32%	0.324	27%	0.268	S	S	.	.			trans	-86.8	78.7	-174.9	-167.8	0	0	0	0	111.4	A743 K746 A750 R751 V752	A743-C748 PolarHBondContact O-N 3.11Å; K746-C748 VanDerWaalsContact C-N 3.32Å; K746-C748 PolarHBondContact O-N 3.06Å; C748-A750 VanDerWaalsContact C-N 3.33Å; C748-A750 PolarHBondContact O-N 2.86Å; C748-R751 HydrophobicContact CB-CB 4.27Å; C748-R751 PolarHBondContact O-N 3.1Å; C748-V752 PolarHBondContact O-N 3.32Å
749	L	92.5	Very high	91.5	Very high	42 Å²	42	52.5 Å²	52.5	22%	0.22	28%	0.282	C	S	.	.	H	α-helix	trans	-50.4	-47	-175	-179.2	62.3	0	0	0	113.4	G747 R751 V752 Q753 E784 V785 Y788	G747-L749 PolarHBondContact O-N 3.31Å; G747-L749 VanDerWaalsContact O-N 3.08Å; L749-R751 VanDerWaalsContact C-N 3.29Å; L749-R751 PolarHBondContact O-N 3.03Å; L749-V752 PolarHBondContact O-N 3.42Å; L749-V752 VanDerWaalsContact O-N 3.08Å; L749-Q753 HydrophobicContact CD1-CG 4.18Å; L749-Q753 HydrophobicContact CG-CG 4.34Å; L749-Q753 WeakPolarHBondContact O-CB 3.42Å; L749-Q753 WeakPolarHBondContact O-CG 3.34Å; L749-Q753 PolarHBondContact O-N 2.65Å; L749-E784 HydrophobicContact CD2-CB 4.38Å; L749-V785 HydrophobicContact CB-CG2 4.19Å; L749-V785 HydrophobicContact CD1-CG2 4.38Å; L749-Y788 HydrophobicContact CD1-CD1 4.44Å; L749-Y788 HydrophobicContact CD1-CD2 4.27Å; L749-Y788 HydrophobicContact CD1-CG 3.87Å
750	A	90.4	Very high	91.6	Very high	70 Å²	70	53.7 Å²	53.7	58%	0.579	29%	0.288	S	S	*	.	H	α-helix	trans	-61.5	-32.1	179.7	0	0	0	0	0	113.8	C748 K754	C748-A750 VanDerWaalsContact C-N 3.33Å; C748-A750 PolarHBondContact O-N 2.86Å; A750-K754 WeakPolarHBondContact O-CB 3.39Å; A750-K754 PolarHBondContact O-N 3.4Å
751	R	90.9	Very high	91.6	Very high	56 Å²	56	54 Å²	54	21%	0.211	29%	0.289	C	S	.	.	H	α-helix	trans	-76.1	-39.2	172.5	-77.5	178.9	68.3	-134.1	4.1	111.3	D732 D742 A743 C748 L749 K754 L755	D732-R751 VanDerWaalsContact CG-NH2 3.31Å; D732-R751 IonicContact OD1-CZ 2.67Å; D732-R751 IonicContact OD1-NE 3.85Å; D732-R751 IonicContact OD1-NH2 3.64Å; D732-R751 PolarHBondContact OD1-NH2 2.92Å; D732-R751 IonicContact OD2-CZ 3.55Å; D732-R751 IonicContact OD2-NE 2.67Å; D732-R751 PolarHBondContact OD2-NE 3.04Å; D732-R751 IonicContact OD2-NH2 2.69Å; D732-R751 PolarHBondContact OD2-NH2 3.36Å; D732-R751 VanDerWaalsContact OD2-NH2 3.16Å; D742-R751 IonicContact OD2-CZ 2.66Å; D742-R751 IonicContact OD2-NH1 3.32Å; D742-R751 PolarHBondContact OD2-NH1 3.47Å; D742-R751 IonicContact OD2-NH2 3.17Å; A743-R751 HydrophobicContact CB-CB 3.77Å; C748-R751 HydrophobicContact CB-CB 4.27Å; C748-R751 PolarHBondContact O-N 3.1Å; L749-R751 VanDerWaalsContact C-N 3.29Å; L749-R751 PolarHBondContact O-N 3.03Å; R751-K754 PolarHBondContact O-N 3.39Å; R751-L755 HydrophobicContact CB-CD1 4.49Å; R751-L755 WeakPolarHBondContact O-CB 3.4Å; R751-L755 WeakPolarHBondContact O-CG 3.21Å; R751-L755 PolarHBondContact O-N 3.19Å
752	V	92.4	Very high	91.7	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-47.1	174.2	174.6	0	0	0	0	110.5	L740 A743 A744 C748 L749 K754 L755 C756 V785 Y788 L789	L740-V752 HydrophobicContact CD1-CB 4.38Å; L740-V752 HydrophobicContact CD1-CG1 3.99Å; L740-V752 HydrophobicContact CD1-CG2 4.39Å; A743-V752 HydrophobicContact CB-CG2 3.75Å; A744-V752 HydrophobicContact CB-CG2 4.31Å; C748-V752 PolarHBondContact O-N 3.32Å; L749-V752 PolarHBondContact O-N 3.42Å; L749-V752 VanDerWaalsContact O-N 3.08Å; V752-K754 VanDerWaalsContact C-N 3.28Å; V752-K754 PolarHBondContact O-N 3.09Å; V752-L755 PolarHBondContact O-N 3.02Å; V752-C756 HydrophobicContact CG1-CB 4.46Å; V752-C756 WeakPolarHBondContact O-CB 3.5Å; V752-C756 PolarHBondContact O-N 3.1Å; V752-V785 HydrophobicContact CG1-CG1 4.42Å; V752-V785 HydrophobicContact CG2-CG1 4Å; V752-V785 HydrophobicContact CG2-CG2 4.37Å; V752-Y788 HydrophobicContact CG1-CD1 3.9Å; V752-Y788 HydrophobicContact CG1-CE1 4.18Å; V752-L789 HydrophobicContact CG1-CD2 4.04Å; V752-L789 HydrophobicContact CG1-CG 4.33Å
753	Q	91.9	Very high	91.7	Very high	95 Å²	95	54.7 Å²	54.7	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-56.8	-37.5	175.4	-76.6	172.4	-19	0	0	113.4	L749 Y788	L749-Q753 HydrophobicContact CD1-CG 4.18Å; L749-Q753 HydrophobicContact CG-CG 4.34Å; L749-Q753 WeakPolarHBondContact O-CB 3.42Å; L749-Q753 WeakPolarHBondContact O-CG 3.34Å; L749-Q753 PolarHBondContact O-N 2.65Å; Q753-Y788 HydrophobicContact CG-CD1 4.46Å; Q753-Y788 HydrophobicContact CG-CD2 4.03Å; Q753-Y788 HydrophobicContact CG-CE1 4.03Å; Q753-Y788 HydrophobicContact CG-CE2 3.53Å; Q753-Y788 HydrophobicContact CG-CG 4.46Å
754	K	88.1	Confident	91.8	Very high	121 Å²	121	59.4 Å²	59.4	53%	0.526	31%	0.311	S	S	.	.	H	α-helix	trans	-77.7	-29.9	179.7	-174	173.5	-176.7	172.5	0	113.9	D729 A750 R751 V752	D729-K754 IonicContact OD1-NZ 3.31Å; D729-K754 PolarHBondContact OD1-NZ 3.27Å; D729-K754 IonicContact OD2-NZ 2.7Å; D729-K754 PolarHBondContact OD2-NZ 3.37Å; A750-K754 WeakPolarHBondContact O-CB 3.39Å; A750-K754 PolarHBondContact O-N 3.4Å; R751-K754 PolarHBondContact O-N 3.39Å; V752-K754 VanDerWaalsContact C-N 3.28Å; V752-K754 PolarHBondContact O-N 3.09Å
755	L	89.6	Confident	91.4	Very high	35 Å²	35	62 Å²	62	18%	0.183	33%	0.325	C	S	.	.	H	α-helix	trans	-104.5	-21.1	-170.5	-61.7	174	0	0	0	114.1	D732 A739 L740 R751 V752 N760	D732-L755 HydrophobicContact CB-CD1 4.14Å; D732-L755 HydrophobicContact CB-CD2 3.78Å; A739-L755 HydrophobicContact CB-CD1 3.73Å; L740-L755 HydrophobicContact CB-CB 4.35Å; L740-L755 HydrophobicContact CD1-CB 4.31Å; R751-L755 HydrophobicContact CB-CD1 4.49Å; R751-L755 WeakPolarHBondContact O-CB 3.4Å; R751-L755 WeakPolarHBondContact O-CG 3.21Å; R751-L755 PolarHBondContact O-N 3.19Å; V752-L755 PolarHBondContact O-N 3.02Å; L755-N760 PolarHBondContact O-ND2 3.43Å; L755-N760 PolarHBondContact O-OD1 2.94Å
756	C	91	Very high	90.8	Very high	23 Å²	23	62 Å²	62	16%	0.155	34%	0.341	C	S	.	.			trans	-75.6	129.7	-179.4	-170.4	0	0	0	0	111	L740 V752 N760 I761 Y788	L740-C756 HydrophobicContact CD1-CB 4.04Å; L740-C756 HydrophobicContact CD2-CB 4.46Å; V752-C756 HydrophobicContact CG1-CB 4.46Å; V752-C756 WeakPolarHBondContact O-CB 3.5Å; V752-C756 PolarHBondContact O-N 3.1Å; C756-N760 WeakPolarHBondContact CA-OD1 3.48Å; C756-I761 VanDerWaalsContact SG-CG1 3.58Å; C756-Y788 HydrophobicContact CB-CE1 4.41Å
757	S	90.1	Very high	90.1	Very high	39 Å²	39	64.4 Å²	64.4	27%	0.273	36%	0.355	S	S	.	.			trans	-132	163	170.9	84	0	0	0	0	109.9	E759 N760 I761	S757-E759 WeakPolarHBondContact CB-OE2 3.49Å; S757-E759 PolarHBondContact O-N 2.84Å; S757-E759 VanDerWaalsContact O-N 3.12Å; S757-E759 PolarHBondContact OG-N 2.9Å; S757-E759 PolarHBondContact OG-OE2 3.5Å; S757-N760 PolarHBondContact N-OD1 2.66Å; S757-N760 PolarHBondContact O-N 2.68Å; S757-N760 VanDerWaalsContact O-N 3.14Å; S757-N760 PolarHBondContact O-OD1 2.75Å; S757-I761 WeakPolarHBondContact O-CB 3.11Å; S757-I761 PolarHBondContact O-N 2.68Å
758	P	88.3	Confident	89.7	Confident	113 Å²	113	64.9 Å²	64.9	73%	0.734	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29	177.4	-26.1	36.1	0	0	0	113.6
759	E	87.5	Confident	89.4	Confident	158 Å²	158	67.4 Å²	67.4	74%	0.738	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-32.6	-179.8	-54.5	75.7	-163.9	0	0	113	S757	S757-E759 WeakPolarHBondContact CB-OE2 3.49Å; S757-E759 PolarHBondContact O-N 2.84Å; S757-E759 VanDerWaalsContact O-N 3.12Å; S757-E759 PolarHBondContact OG-N 2.9Å; S757-E759 PolarHBondContact OG-OE2 3.5Å
760	N	92.7	Very high	89.4	Confident	24 Å²	24	68.1 Å²	68.1	13%	0.128	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-4	-173.4	78.8	6.2	0	0	0	114.9	D737 L740 L755 C756 S757 N762 C763	D737-N760 WeakPolarHBondContact OD1-CB 3.26Å; L740-N760 HydrophobicContact CD2-CB 4.47Å; L740-N760 VanDerWaalsContact CD2-OD1 3.31Å; L740-N760 WeakPolarHBondContact CD2-OD1 3.3Å; L755-N760 PolarHBondContact O-ND2 3.43Å; L755-N760 PolarHBondContact O-OD1 2.94Å; C756-N760 WeakPolarHBondContact CA-OD1 3.48Å; S757-N760 PolarHBondContact N-OD1 2.66Å; S757-N760 PolarHBondContact O-N 2.68Å; S757-N760 VanDerWaalsContact O-N 3.14Å; S757-N760 PolarHBondContact O-OD1 2.75Å; N760-N762 PolarHBondContact O-N 2.91Å; N760-N762 VanDerWaalsContact O-N 3.09Å; N760-C763 HydrophobicContact CB-CB 4.38Å; N760-C763 WeakPolarHBondContact O-CB 3.15Å; N760-C763 PolarHBondContact O-N 3.16Å; N760-C763 PolarHBondContact O-SG 3.05Å
761	I	93.9	Very high	89.6	Confident	7 Å²	7	65 Å²	65	4%	0.036	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.7	-178.9	-168.1	166	0	0	0	113.7	C756 S757 L789 H792 A794	C756-I761 VanDerWaalsContact SG-CG1 3.58Å; S757-I761 WeakPolarHBondContact O-CB 3.11Å; S757-I761 PolarHBondContact O-N 2.68Å; I761-L789 HydrophobicContact CD1-CD2 4.49Å; I761-L789 WeakPolarHBondContact CD1-O 3.4Å; I761-L789 HydrophobicContact CG1-CD2 4Å; I761-H792 HydrophobicContact CD1-CB 3.58Å; I761-H792 WeakPolarHBondContact CD1-O 3.34Å; I761-A794 HydrophobicContact CD1-CB 4.22Å; I761-A794 HydrophobicContact CG1-CB 4.05Å
762	N	94.5	Very high	89.8	Confident	58 Å²	58	62.3 Å²	62.3	31%	0.31	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	24.7	174.6	-68.6	-55.3	0	0	0	112.8	N760 G793 D795	N760-N762 PolarHBondContact O-N 2.91Å; N760-N762 VanDerWaalsContact O-N 3.09Å; N762-G793 PolarHBondContact ND2-O 3.1Å; N762-D795 PolarHBondContact OD1-N 2.95Å
763	C	94.4	Very high	90.1	Very high	10 Å²	10	62.3 Å²	62.3	7%	0.068	33%	0.331	C	S	.	.			trans	-55.7	160.5	171.9	68.8	0	0	0	0	111.3	D737 N760 T772 P773	D737-C763 HydrophobicContact CB-CB 3.69Å; D737-C763 VanDerWaalsContact CG-CB 3.42Å; D737-C763 WeakPolarHBondContact OD2-CB 3.45Å; N760-C763 HydrophobicContact CB-CB 4.38Å; N760-C763 WeakPolarHBondContact O-CB 3.15Å; N760-C763 PolarHBondContact O-N 3.16Å; N760-C763 PolarHBondContact O-SG 3.05Å; C763-T772 WeakPolarHBondContact O-CA 3.49Å; C763-P773 WeakPolarHBondContact O-CD 3.45Å; C763-P773 VanDerWaalsContact SG-CG 3.58Å
764	R	93.9	Very high	90.3	Very high	99 Å²	99	57.8 Å²	57.8	37%	0.374	31%	0.309	S	S	.	.			trans	-132.2	139.8	-172.6	-58.5	-174.4	174.4	-125.8	2.8	112.9	A766 N770 S771 T772 Q799	R764-A766 PolarHBondContact O-N 3.11Å; R764-N770 VanDerWaalsContact CB-OD1 3.23Å; R764-N770 WeakPolarHBondContact CB-OD1 3.46Å; R764-N770 VanDerWaalsContact CD-OD1 3.26Å; R764-N770 WeakPolarHBondContact CD-OD1 3.43Å; R764-N770 PolarHBondContact NH1-ND2 3.38Å; R764-N770 PolarHBondContact NH1-O 3.43Å; R764-S771 WeakPolarHBondContact CA-O 3.24Å; R764-T772 HydrophobicContact CG-CG2 4.32Å; R764-Q799 PolarHBondContact NH1-O 3.01Å
765	D	87.4	Confident	90.8	Very high	55 Å²	55	52 Å²	52	29%	0.294	28%	0.284	S	S	.	.			trans	-67.6	93.1	170.1	175.1	11	0	0	0	110.8	L741 Q767 G768 N770 S771	L741-D765 HydrophobicContact CD1-CB 4.13Å; D765-Q767 PolarHBondContact O-N 2.7Å; D765-Q767 PolarHBondContact OD1-N 3.02Å; D765-Q767 VanDerWaalsContact OD1-N 3.09Å; D765-G768 VanDerWaalsContact CG-N 3.3Å; D765-G768 PolarHBondContact O-N 3.41Å; D765-G768 PolarHBondContact OD1-N 2.99Å; D765-G768 VanDerWaalsContact OD2-CA 3.26Å; D765-G768 WeakPolarHBondContact OD2-CA 3.47Å; D765-G768 PolarHBondContact OD2-N 3.02Å; D765-N770 WeakPolarHBondContact O-CA 3.34Å; D765-N770 PolarHBondContact O-N 3.42Å; D765-S771 PolarHBondContact N-O 2.59Å
766	A	81.1	Confident	91.1	Very high	87 Å²	87	51.6 Å²	51.6	72%	0.719	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.1	-178.8	0	0	0	0	0	114.3	R764	R764-A766 PolarHBondContact O-N 3.11Å
767	Q	76.8	Confident	91.4	Very high	187 Å²	187	50.5 Å²	50.5	87%	0.874	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-28.9	-179	-61.7	-62.6	-20.3	0	0	112.3	D765	D765-Q767 PolarHBondContact O-N 2.7Å; D765-Q767 PolarHBondContact OD1-N 3.02Å; D765-Q767 VanDerWaalsContact OD1-N 3.09Å
768	G	84	Confident	91.6	Very high	36 Å²	36	48.6 Å²	48.6	37%	0.371	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-130.8	177.3	0	0	0	0	0	114.2	D765 N770	D765-G768 VanDerWaalsContact CG-N 3.3Å; D765-G768 PolarHBondContact O-N 3.41Å; D765-G768 PolarHBondContact OD1-N 2.99Å; D765-G768 VanDerWaalsContact OD2-CA 3.26Å; D765-G768 WeakPolarHBondContact OD2-CA 3.47Å; D765-G768 PolarHBondContact OD2-N 3.02Å; G768-N770 VanDerWaalsContact C-N 3.27Å; G768-N770 PolarHBondContact O-N 3.04Å
769	R	86.3	Confident	91.8	Very high	100 Å²	100	43.6 Å²	43.6	38%	0.377	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	9.8	-174.6	-75.6	-160.3	-70.7	139	-15.7	114.3	S771 D800 K801 L804 N809	R769-S771 WeakPolarHBondContact CB-OG 3.41Å; R769-S771 PolarHBondContact O-N 3.16Å; R769-D800 IonicContact CZ-OD2 2.74Å; R769-D800 IonicContact NE-OD2 3.49Å; R769-D800 IonicContact NH1-OD2 3.72Å; R769-D800 PolarHBondContact NH1-OD2 3.02Å; R769-D800 WeakPolarHBondContact O-CB 3.35Å; R769-K801 WeakPolarHBondContact O-CB 3.37Å; R769-K801 PolarHBondContact O-N 3.31Å; R769-L804 VanDerWaalsContact NH1-CD1 3.33Å; R769-N809 PolarHBondContact NH1-OD1 3.14Å; R769-N809 PolarHBondContact NH2-OD1 3.43Å
770	N	91.9	Very high	92.1	Very high	58 Å²	58	42 Å²	42	31%	0.31	22%	0.218	S	C	.	.			trans	60.3	31.4	-172.2	-157.3	39	0	0	0	112.6	R764 D765 G768 K801	R764-N770 VanDerWaalsContact CB-OD1 3.23Å; R764-N770 WeakPolarHBondContact CB-OD1 3.46Å; R764-N770 VanDerWaalsContact CD-OD1 3.26Å; R764-N770 WeakPolarHBondContact CD-OD1 3.43Å; R764-N770 PolarHBondContact NH1-ND2 3.38Å; R764-N770 PolarHBondContact NH1-O 3.43Å; D765-N770 WeakPolarHBondContact O-CA 3.34Å; D765-N770 PolarHBondContact O-N 3.42Å; G768-N770 VanDerWaalsContact C-N 3.27Å; G768-N770 PolarHBondContact O-N 3.04Å; N770-K801 HydrophobicContact CB-CB 4.01Å
771	S	93.9	Very high	92.3	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.028	23%	0.232	C	C	.	.			trans	-80.1	146.7	-177.5	-58.3	0	0	0	0	112	R764 D765 R769	R764-S771 WeakPolarHBondContact CA-O 3.24Å; D765-S771 PolarHBondContact N-O 2.59Å; R769-S771 WeakPolarHBondContact CB-OG 3.41Å; R769-S771 PolarHBondContact O-N 3.16Å
772	T	96.8	Very high	92.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.237	C	C	.	.			trans	-87.7	167.2	175.9	69.6	0	0	0	0	112.4	C763 R764 L774 H775 L776 A798	C763-T772 WeakPolarHBondContact O-CA 3.49Å; R764-T772 HydrophobicContact CG-CG2 4.32Å; T772-L774 PolarHBondContact O-N 2.8Å; T772-H775 PolarHBondContact N-ND1 2.83Å; T772-H775 WeakPolarHBondContact O-CB 3.49Å; T772-H775 PolarHBondContact O-N 3.46Å; T772-H775 PolarHBondContact OG1-ND1 3Å; T772-L776 PolarHBondContact O-N 3.04Å; T772-A798 HydrophobicContact CG2-CB 3.93Å
773	P	97.2	Very high	92.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-51.3	-38.8	172.4	-29.7	37.2	0	0	0	112.9	L740 L741 A744 C763 H775 L776 A777 L789	L740-P773 HydrophobicContact CD2-CG 4.08Å; L740-P773 HydrophobicContact CG-CG 3.97Å; L741-P773 HydrophobicContact CD2-CG 3.9Å; L741-P773 HydrophobicContact CG-CG 4.5Å; A744-P773 HydrophobicContact CB-CB 3.77Å; C763-P773 WeakPolarHBondContact O-CD 3.45Å; C763-P773 VanDerWaalsContact SG-CG 3.58Å; P773-H775 PolarHBondContact O-N 3.26Å; P773-L776 PolarHBondContact O-N 2.75Å; P773-A777 PolarHBondContact O-N 2.73Å; P773-L789 HydrophobicContact CB-CD1 3.74Å; P773-L789 HydrophobicContact CB-CD2 4.12Å
774	L	97.7	Very high	92.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-36.7	178.1	-176.2	61.8	0	0	0	112.9	T772 L776 A778 A786 L789 L790 A794 P806 L822	T772-L774 PolarHBondContact O-N 2.8Å; L774-L776 VanDerWaalsContact C-N 3.27Å; L774-L776 PolarHBondContact O-N 3.21Å; L774-A778 WeakPolarHBondContact O-CB 3.27Å; L774-A778 PolarHBondContact O-N 2.82Å; L774-A786 HydrophobicContact CD1-CB 3.97Å; L774-L789 HydrophobicContact CB-CD1 4.46Å; L774-L789 HydrophobicContact CD1-CB 4.5Å; L774-L790 HydrophobicContact CD1-CD1 4.29Å; L774-L790 HydrophobicContact CD1-CD2 4.36Å; L774-L790 HydrophobicContact CD1-CG 4.01Å; L774-L790 HydrophobicContact CD2-CD2 3.62Å; L774-L790 HydrophobicContact CD2-CG 4.18Å; L774-A794 HydrophobicContact CB-CB 4.26Å; L774-A794 HydrophobicContact CD2-CB 4.09Å; L774-P806 HydrophobicContact CB-CG 4.42Å; L774-P806 HydrophobicContact CD2-CB 4.39Å; L774-P806 HydrophobicContact CD2-CG 3.96Å; L774-P806 HydrophobicContact CG-CB 4.09Å; L774-P806 HydrophobicContact CG-CG 3.93Å; L774-L822 HydrophobicContact CD1-CD2 4.28Å; L774-L822 HydrophobicContact CD2-CD2 4.17Å; L774-L822 HydrophobicContact CG-CD2 4.38Å
775	H	96.9	Very high	92.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-37	172.9	-74.3	82.1	0	0	0	112.4	T772 P773 G779 A798 L804 N809	T772-H775 PolarHBondContact N-ND1 2.83Å; T772-H775 WeakPolarHBondContact O-CB 3.49Å; T772-H775 PolarHBondContact O-N 3.46Å; T772-H775 PolarHBondContact OG1-ND1 3Å; P773-H775 PolarHBondContact O-N 3.26Å; H775-G779 PolarHBondContact O-N 3.47Å; H775-A798 PolarHBondContact CE1-O 3.48Å; H775-A798 PolarHBondContact NE2-O 2.96Å; H775-A798 VanDerWaalsContact NE2-O 3.17Å; H775-L804 PolarHBondContact NE2-O 3.48Å; H775-L804 VanDerWaalsContact NE2-O 3.1Å; H775-N809 PolarHBondContact O-ND2 3.3Å
776	L	96.1	Very high	93.1	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.131	23%	0.234	C	C	.	.	H	α-helix	trans	-74.9	-46.8	-179.8	-62.6	175.8	0	0	0	110.3	L741 K745 T772 P773 L774 A778 G779 Y780	L741-L776 HydrophobicContact CB-CD1 3.86Å; L741-L776 HydrophobicContact CD2-CD1 3.68Å; L741-L776 HydrophobicContact CG-CD1 4.4Å; L741-L776 WeakPolarHBondContact O-CD1 3.21Å; K745-L776 HydrophobicContact CB-CB 4.12Å; K745-L776 HydrophobicContact CB-CD1 4.32Å; T772-L776 PolarHBondContact O-N 3.04Å; P773-L776 PolarHBondContact O-N 2.75Å; L774-L776 VanDerWaalsContact C-N 3.27Å; L774-L776 PolarHBondContact O-N 3.21Å; L776-A778 VanDerWaalsContact C-N 3.27Å; L776-A778 PolarHBondContact O-N 3.23Å; L776-G779 PolarHBondContact O-N 3.16Å; L776-Y780 HydrophobicContact CD2-CE2 4.48Å; L776-Y780 WeakPolarHBondContact O-CB 3.31Å; L776-Y780 VanDerWaalsContact O-CD2 3.29Å; L776-Y780 WeakPolarHBondContact O-CD2 3.42Å; L776-Y780 PolarHBondContact O-N 3.05Å; L776-Y780 VanDerWaalsContact O-N 3.08Å
777	A	96.9	Very high	93.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-44.7	172.8	0	0	0	0	0	111.3	P773 N781 N782 V785 A786 L789 I818	P773-A777 PolarHBondContact O-N 2.73Å; A777-N781 PolarHBondContact O-N 2.99Å; A777-N782 HydrophobicContact CB-CB 4.28Å; A777-N782 PolarHBondContact O-N 3.37Å; A777-V785 HydrophobicContact CB-CB 4.34Å; A777-V785 HydrophobicContact CB-CG1 3.85Å; A777-A786 HydrophobicContact CB-CB 4.05Å; A777-L789 HydrophobicContact CB-CD1 4.32Å; A777-I818 WeakPolarHBondContact O-CD1 3.49Å
778	A	95.7	Very high	94.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-36.7	179.5	0	0	0	0	0	114	L774 L776 P806 H815 I818 L822	L774-A778 WeakPolarHBondContact O-CB 3.27Å; L774-A778 PolarHBondContact O-N 2.82Å; L776-A778 VanDerWaalsContact C-N 3.27Å; L776-A778 PolarHBondContact O-N 3.23Å; A778-P806 HydrophobicContact CB-CB 4.04Å; A778-H815 PolarHBondContact O-CD2 2.92Å; A778-I818 HydrophobicContact CB-CG2 3.77Å; A778-L822 HydrophobicContact CB-CD1 4.3Å
779	G	92.6	Very high	95.5	Very high	7 Å²	7	34.9 Å²	34.9	7%	0.072	16%	0.163	C	C	.	.	H	α-helix	trans	-77.9	-26.4	179.2	0	0	0	0	0	114.7	H775 L776 H815	H775-G779 PolarHBondContact O-N 3.47Å; L776-G779 PolarHBondContact O-N 3.16Å; G779-H815 PolarHBondContact O-NE2 3.4Å
780	Y	94.3	Very high	96	Very high	126 Å²	126	30.6 Å²	30.6	49%	0.494	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	8.4	-175.3	-73.3	-98.7	0	0	0	114.1	K745 L776	K745-Y780 HydrophobicContact CD-CE1 4.46Å; K745-Y780 HydrophobicContact CD-CE2 4.2Å; K745-Y780 VanDerWaalsContact CE-CZ 3.45Å; K745-Y780 VanDerWaalsContact CE-OH 3.29Å; K745-Y780 WeakPolarHBondContact CE-OH 3.49Å; K745-Y780 HydrophobicContact CG-CD1 4.22Å; K745-Y780 HydrophobicContact CG-CD2 4.03Å; K745-Y780 HydrophobicContact CG-CE1 4.14Å; K745-Y780 HydrophobicContact CG-CE2 3.96Å; K745-Y780 HydrophobicContact CG-CG 4.17Å; K745-Y780 PolarHBondContact NZ-OH 3.03Å; L776-Y780 HydrophobicContact CD2-CE2 4.48Å; L776-Y780 WeakPolarHBondContact O-CB 3.31Å; L776-Y780 VanDerWaalsContact O-CD2 3.29Å; L776-Y780 WeakPolarHBondContact O-CD2 3.42Å; L776-Y780 PolarHBondContact O-N 3.05Å; L776-Y780 VanDerWaalsContact O-N 3.08Å
781	N	94.8	Very high	96.1	Very high	76 Å²	76	33.4 Å²	33.4	41%	0.406	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	35.3	-179.1	-153.5	38.5	0	0	0	116	A777 L783	A777-N781 PolarHBondContact O-N 2.99Å; N781-L783 PolarHBondContact O-N 3.02Å
782	N	96.2	Very high	96.2	Very high	29 Å²	29	37.9 Å²	37.9	16%	0.155	18%	0.179	C	C	.	.			trans	-92.4	74.8	179.9	-57.8	-41.1	0	0	0	111	A744 K745 G747 A777 V785 A786	A744-N782 PolarHBondContact O-ND2 3.44Å; K745-N782 VanDerWaalsContact C-ND2 3.33Å; K745-N782 PolarHBondContact O-ND2 3.09Å; G747-N782 WeakPolarHBondContact CA-OD1 3.35Å; G747-N782 PolarHBondContact N-ND2 3.35Å; A777-N782 HydrophobicContact CB-CB 4.28Å; A777-N782 PolarHBondContact O-N 3.37Å; N782-V785 HydrophobicContact CB-CB 4.11Å; N782-V785 HydrophobicContact CB-CG2 4.47Å; N782-V785 PolarHBondContact O-N 3.3Å; N782-A786 PolarHBondContact O-N 3.24Å
783	L	95.3	Very high	96	Very high	67 Å²	67	40.2 Å²	40.2	35%	0.351	20%	0.203	S	C	.	.	H	α-helix	trans	-56.4	-53.2	-172.5	-175.3	67.7	0	0	0	113.4	N781 V785 A786 E787 D817 I818 L821	N781-L783 PolarHBondContact O-N 3.02Å; L783-V785 PolarHBondContact O-N 3.02Å; L783-A786 WeakPolarHBondContact O-CB 3.32Å; L783-A786 PolarHBondContact O-N 3.02Å; L783-E787 PolarHBondContact O-N 3.29Å; L783-D817 HydrophobicContact CD1-CB 4.22Å; L783-D817 HydrophobicContact CD2-CB 4.23Å; L783-I818 HydrophobicContact CB-CG1 4.36Å; L783-I818 HydrophobicContact CD1-CG1 3.81Å; L783-L821 HydrophobicContact CD1-CB 4.24Å; L783-L821 HydrophobicContact CD1-CD2 3.71Å
784	E	96	Very high	96	Very high	133 Å²	133	40.6 Å²	40.6	62%	0.621	21%	0.206	S	C	*	.	H	α-helix	trans	-58.4	-36.2	-179.2	-61	174.8	-177.1	0	0	112.7	L749 Y788	L749-E784 HydrophobicContact CD2-CB 4.38Å; E784-Y788 WeakPolarHBondContact O-CB 3.39Å; E784-Y788 PolarHBondContact O-N 3.44Å
785	V	97.3	Very high	95.9	Very high	2 Å²	2	44 Å²	44	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-73	-40.5	176.3	170.1	0	0	0	0	111.2	A744 L749 V752 A777 N782 L783 E787 L789	A744-V785 HydrophobicContact CB-CG1 4.07Å; L749-V785 HydrophobicContact CB-CG2 4.19Å; L749-V785 HydrophobicContact CD1-CG2 4.38Å; V752-V785 HydrophobicContact CG1-CG1 4.42Å; V752-V785 HydrophobicContact CG2-CG1 4Å; V752-V785 HydrophobicContact CG2-CG2 4.37Å; A777-V785 HydrophobicContact CB-CB 4.34Å; A777-V785 HydrophobicContact CB-CG1 3.85Å; N782-V785 HydrophobicContact CB-CB 4.11Å; N782-V785 HydrophobicContact CB-CG2 4.47Å; N782-V785 PolarHBondContact O-N 3.3Å; L783-V785 PolarHBondContact O-N 3.02Å; V785-E787 VanDerWaalsContact C-N 3.32Å; V785-L789 HydrophobicContact CG1-CD1 3.8Å; V785-L789 HydrophobicContact CG1-CG 4.31Å; V785-L789 WeakPolarHBondContact O-CB 3.42Å; V785-L789 WeakPolarHBondContact O-CG 3.29Å; V785-L789 PolarHBondContact O-N 3.38Å
786	A	97.3	Very high	95.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-41	175.8	0	0	0	0	0	111.1	L774 A777 N782 L783 L790 L821	L774-A786 HydrophobicContact CD1-CB 3.97Å; A777-A786 HydrophobicContact CB-CB 4.05Å; N782-A786 PolarHBondContact O-N 3.24Å; L783-A786 WeakPolarHBondContact O-CB 3.32Å; L783-A786 PolarHBondContact O-N 3.02Å; A786-L790 WeakPolarHBondContact O-CB 3.37Å; A786-L790 WeakPolarHBondContact O-CD1 3.37Å; A786-L790 WeakPolarHBondContact O-CG 3.48Å; A786-L790 PolarHBondContact O-N 3.22Å; A786-L821 HydrophobicContact CB-CD2 4.05Å
787	E	97.3	Very high	95.9	Very high	66 Å²	66	46.2 Å²	46.2	31%	0.308	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-52.5	175.8	-173	157.4	-128.9	0	0	111.1	L783 V785 L789 L790 E791 L821 K824	L783-E787 PolarHBondContact O-N 3.29Å; V785-E787 VanDerWaalsContact C-N 3.32Å; E787-L789 VanDerWaalsContact C-N 3.32Å; E787-L789 PolarHBondContact O-N 3.1Å; E787-L790 PolarHBondContact O-N 3.14Å; E787-L790 VanDerWaalsContact O-N 3.1Å; E787-E791 WeakPolarHBondContact O-CG 3.47Å; E787-E791 PolarHBondContact O-N 3.47Å; E787-L821 HydrophobicContact CB-CD1 4.39Å; E787-L821 HydrophobicContact CB-CD2 3.86Å; E787-L821 HydrophobicContact CG-CD1 4.31Å; E787-K824 IonicContact OE1-NZ 3.25Å
788	Y	97.6	Very high	95.9	Very high	39 Å²	39	46.3 Å²	46.3	15%	0.153	24%	0.238	C	C	.	.	H	α-helix	trans	-56	-44.6	176.8	-178.8	-91.6	0	0	0	112.8	L749 V752 Q753 C756 E784 L790 E791 H792	L749-Y788 HydrophobicContact CD1-CD1 4.44Å; L749-Y788 HydrophobicContact CD1-CD2 4.27Å; L749-Y788 HydrophobicContact CD1-CG 3.87Å; V752-Y788 HydrophobicContact CG1-CD1 3.9Å; V752-Y788 HydrophobicContact CG1-CE1 4.18Å; Q753-Y788 HydrophobicContact CG-CD1 4.46Å; Q753-Y788 HydrophobicContact CG-CD2 4.03Å; Q753-Y788 HydrophobicContact CG-CE1 4.03Å; Q753-Y788 HydrophobicContact CG-CE2 3.53Å; Q753-Y788 HydrophobicContact CG-CG 4.46Å; C756-Y788 HydrophobicContact CB-CE1 4.41Å; E784-Y788 WeakPolarHBondContact O-CB 3.39Å; E784-Y788 PolarHBondContact O-N 3.44Å; Y788-L790 PolarHBondContact O-N 2.97Å; Y788-E791 PolarHBondContact O-N 3.16Å; Y788-H792 AromaticContact CD2-CE1 3.55Å; Y788-H792 AromaticContact CD2-ND1 3.73Å; Y788-H792 AromaticContact CE1-ND1 3.93Å; Y788-H792 AromaticContact CE2-CE1 3.12Å; Y788-H792 WeakPolarHBondContact CE2-CE1 3.43Å; Y788-H792 AromaticContact CE2-ND1 3.57Å; Y788-H792 AromaticContact CE2-NE2 3.66Å; Y788-H792 AromaticContact CG-ND1 3.98Å; Y788-H792 AromaticContact CZ-CE1 3.5Å; Y788-H792 AromaticContact CZ-ND1 3.66Å; Y788-H792 AromaticContact CZ-NE2 3.72Å; Y788-H792 PolarHBondContact O-N 2.84Å; Y788-H792 VanDerWaalsContact O-N 3.15Å; Y788-H792 PolarHBondContact O-ND1 2.88Å
789	L	97.1	Very high	95.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-41.5	177.6	-74.1	170	0	0	0	111.8	A744 V752 I761 P773 L774 A777 V785 E787 H792 G793 A794	A744-L789 HydrophobicContact CB-CD1 4.4Å; V752-L789 HydrophobicContact CG1-CD2 4.04Å; V752-L789 HydrophobicContact CG1-CG 4.33Å; I761-L789 HydrophobicContact CD1-CD2 4.49Å; I761-L789 WeakPolarHBondContact CD1-O 3.4Å; I761-L789 HydrophobicContact CG1-CD2 4Å; P773-L789 HydrophobicContact CB-CD1 3.74Å; P773-L789 HydrophobicContact CB-CD2 4.12Å; L774-L789 HydrophobicContact CB-CD1 4.46Å; L774-L789 HydrophobicContact CD1-CB 4.5Å; A777-L789 HydrophobicContact CB-CD1 4.32Å; V785-L789 HydrophobicContact CG1-CD1 3.8Å; V785-L789 HydrophobicContact CG1-CG 4.31Å; V785-L789 WeakPolarHBondContact O-CB 3.42Å; V785-L789 WeakPolarHBondContact O-CG 3.29Å; V785-L789 PolarHBondContact O-N 3.38Å; E787-L789 VanDerWaalsContact C-N 3.32Å; E787-L789 PolarHBondContact O-N 3.1Å; L789-H792 PolarHBondContact O-N 3.31Å; L789-G793 PolarHBondContact O-N 3.08Å; L789-A794 HydrophobicContact CB-CB 3.9Å; L789-A794 WeakPolarHBondContact O-CB 3.29Å; L789-A794 PolarHBondContact O-N 2.89Å
790	L	96.6	Very high	95.9	Very high	10 Å²	10	51 Å²	51	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-67.3	-42.8	178.2	-73.3	164.7	0	0	0	112.1	L774 A786 E787 Y788 H792 G793 V796 L821 L822 Y825	L774-L790 HydrophobicContact CD1-CD1 4.29Å; L774-L790 HydrophobicContact CD1-CD2 4.36Å; L774-L790 HydrophobicContact CD1-CG 4.01Å; L774-L790 HydrophobicContact CD2-CD2 3.62Å; L774-L790 HydrophobicContact CD2-CG 4.18Å; A786-L790 WeakPolarHBondContact O-CB 3.37Å; A786-L790 WeakPolarHBondContact O-CD1 3.37Å; A786-L790 WeakPolarHBondContact O-CG 3.48Å; A786-L790 PolarHBondContact O-N 3.22Å; E787-L790 PolarHBondContact O-N 3.14Å; E787-L790 VanDerWaalsContact O-N 3.1Å; Y788-L790 PolarHBondContact O-N 2.97Å; L790-H792 PolarHBondContact O-N 3.44Å; L790-G793 PolarHBondContact O-N 3.35Å; L790-V796 HydrophobicContact CD2-CB 3.84Å; L790-V796 HydrophobicContact CD2-CG2 3.85Å; L790-L821 HydrophobicContact CD1-CD2 4.11Å; L790-L821 HydrophobicContact CD1-CG 3.91Å; L790-L822 HydrophobicContact CD1-CD2 4.18Å; L790-Y825 HydrophobicContact CB-CD1 3.84Å; L790-Y825 HydrophobicContact CB-CD2 4.02Å; L790-Y825 HydrophobicContact CB-CE1 3.85Å; L790-Y825 HydrophobicContact CB-CE2 4.01Å; L790-Y825 HydrophobicContact CB-CG 3.93Å; L790-Y825 HydrophobicContact CD1-CD2 3.72Å; L790-Y825 HydrophobicContact CD1-CE2 4.23Å; L790-Y825 HydrophobicContact CD1-CG 4Å; L790-Y825 HydrophobicContact CD2-CD1 4.44Å; L790-Y825 HydrophobicContact CD2-CG 4.15Å; L790-Y825 HydrophobicContact CG-CD2 4.35Å; L790-Y825 HydrophobicContact CG-CG 4.25Å
791	E	95.7	Very high	95.7	Very high	118 Å²	118	51.9 Å²	51.9	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-58.3	-33.7	174.7	-72.9	-178.1	155.4	0	0	112.7	E787 Y788 Y825	E787-E791 WeakPolarHBondContact O-CG 3.47Å; E787-E791 PolarHBondContact O-N 3.47Å; Y788-E791 PolarHBondContact O-N 3.16Å; E791-Y825 VanDerWaalsContact CG-OH 3.25Å; E791-Y825 WeakPolarHBondContact CG-OH 3.4Å
792	H	94.8	Very high	95.6	Very high	98 Å²	98	48.7 Å²	48.7	45%	0.454	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	6.4	-178.1	-67.1	72.9	0	0	0	113.8	I761 Y788 L789 L790	I761-H792 HydrophobicContact CD1-CB 3.58Å; I761-H792 WeakPolarHBondContact CD1-O 3.34Å; Y788-H792 AromaticContact CD2-CE1 3.55Å; Y788-H792 AromaticContact CD2-ND1 3.73Å; Y788-H792 AromaticContact CE1-ND1 3.93Å; Y788-H792 AromaticContact CE2-CE1 3.12Å; Y788-H792 WeakPolarHBondContact CE2-CE1 3.43Å; Y788-H792 AromaticContact CE2-ND1 3.57Å; Y788-H792 AromaticContact CE2-NE2 3.66Å; Y788-H792 AromaticContact CG-ND1 3.98Å; Y788-H792 AromaticContact CZ-CE1 3.5Å; Y788-H792 AromaticContact CZ-ND1 3.66Å; Y788-H792 AromaticContact CZ-NE2 3.72Å; Y788-H792 PolarHBondContact O-N 2.84Å; Y788-H792 VanDerWaalsContact O-N 3.15Å; Y788-H792 PolarHBondContact O-ND1 2.88Å; L789-H792 PolarHBondContact O-N 3.31Å; L790-H792 PolarHBondContact O-N 3.44Å
793	G	92.9	Very high	95.4	Very high	48 Å²	48	47.4 Å²	47.4	50%	0.495	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	24.9	172.2	0	0	0	0	0	116.1	N762 L789 L790	N762-G793 PolarHBondContact ND2-O 3.1Å; L789-G793 PolarHBondContact O-N 3.08Å; L790-G793 PolarHBondContact O-N 3.35Å
794	A	96.6	Very high	95.4	Very high	9 Å²	9	45.5 Å²	45.5	7%	0.074	23%	0.233	C	C	.	.			trans	-62.9	136.3	168.4	0	0	0	0	0	111	I761 L774 L789 V796	I761-A794 HydrophobicContact CD1-CB 4.22Å; I761-A794 HydrophobicContact CG1-CB 4.05Å; L774-A794 HydrophobicContact CB-CB 4.26Å; L774-A794 HydrophobicContact CD2-CB 4.09Å; L789-A794 HydrophobicContact CB-CB 3.9Å; L789-A794 WeakPolarHBondContact O-CB 3.29Å; L789-A794 PolarHBondContact O-N 2.89Å; A794-V796 PolarHBondContact O-N 3.19Å; A794-V796 VanDerWaalsContact O-N 3.09Å
795	D	96.3	Very high	95.5	Very high	71 Å²	71	39.2 Å²	39.2	38%	0.38	20%	0.204	S	C	.	.			trans	-74.6	103.9	179.7	174.2	12.8	0	0	0	110.3	N762 N797 A798	N762-D795 PolarHBondContact OD1-N 2.95Å; D795-N797 PolarHBondContact O-N 3.06Å; D795-N797 VanDerWaalsContact O-N 3.15Å; D795-N797 WeakPolarHBondContact OD1-CA 3.5Å; D795-N797 PolarHBondContact OD1-N 2.89Å; D795-A798 HydrophobicContact CB-CB 3.96Å; D795-A798 WeakPolarHBondContact O-CB 3.31Å; D795-A798 PolarHBondContact O-N 3.22Å; D795-A798 VanDerWaalsContact O-N 3.14Å; D795-A798 PolarHBondContact OD1-N 3.02Å; D795-A798 VanDerWaalsContact OD1-N 3.16Å; D795-A798 VanDerWaalsContact OD2-CA 3.28Å; D795-A798 WeakPolarHBondContact OD2-CA 3.34Å; D795-A798 PolarHBondContact OD2-N 2.98Å
796	V	96.6	Very high	95.5	Very high	16 Å²	16	39.1 Å²	39.1	10%	0.097	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.8	177.7	76.6	0	0	0	0	113.7	L790 A794 L822 Y825 T827	L790-V796 HydrophobicContact CD2-CB 3.84Å; L790-V796 HydrophobicContact CD2-CG2 3.85Å; A794-V796 PolarHBondContact O-N 3.19Å; A794-V796 VanDerWaalsContact O-N 3.09Å; V796-L822 HydrophobicContact CG2-CB 4.33Å; V796-L822 HydrophobicContact CG2-CD2 3.7Å; V796-Y825 WeakPolarHBondContact CG1-O 3.38Å; V796-T827 PolarHBondContact O-OG1 2.97Å
797	N	96.3	Very high	95.5	Very high	55 Å²	55	39.1 Å²	39.1	29%	0.294	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	12.7	-178.2	-68.3	-47.8	0	0	0	112.5	D795 Q799 I805 N826 T827 C828	D795-N797 PolarHBondContact O-N 3.06Å; D795-N797 VanDerWaalsContact O-N 3.15Å; D795-N797 WeakPolarHBondContact OD1-CA 3.5Å; D795-N797 PolarHBondContact OD1-N 2.89Å; N797-Q799 PolarHBondContact O-N 3.31Å; N797-I805 WeakPolarHBondContact O-CG2 3.3Å; N797-N826 PolarHBondContact ND2-O 3.22Å; N797-T827 WeakPolarHBondContact OD1-CA 3.31Å; N797-T827 PolarHBondContact OD1-OG1 2.75Å; N797-C828 PolarHBondContact OD1-N 2.88Å
798	A	95.9	Very high	95.5	Very high	2 Å²	2	36.1 Å²	36.1	2%	0.017	19%	0.189	C	C	.	.			trans	-55.9	129.4	175.6	0	0	0	0	0	109.8	T772 H775 D795 I805	T772-A798 HydrophobicContact CG2-CB 3.93Å; H775-A798 PolarHBondContact CE1-O 3.48Å; H775-A798 PolarHBondContact NE2-O 2.96Å; H775-A798 VanDerWaalsContact NE2-O 3.17Å; D795-A798 HydrophobicContact CB-CB 3.96Å; D795-A798 WeakPolarHBondContact O-CB 3.31Å; D795-A798 PolarHBondContact O-N 3.22Å; D795-A798 VanDerWaalsContact O-N 3.14Å; D795-A798 PolarHBondContact OD1-N 3.02Å; D795-A798 VanDerWaalsContact OD1-N 3.16Å; D795-A798 VanDerWaalsContact OD2-CA 3.28Å; D795-A798 WeakPolarHBondContact OD2-CA 3.34Å; D795-A798 PolarHBondContact OD2-N 2.98Å; A798-I805 WeakPolarHBondContact O-CA 3.31Å
799	Q	94.6	Very high	95.4	Very high	97 Å²	97	34.7 Å²	34.7	45%	0.453	18%	0.184	S	C	.	.			trans	-94.6	134.9	177.2	-73.3	-173.4	-25	0	0	112.2	R764 N797 G803 L804 I805	R764-Q799 PolarHBondContact NH1-O 3.01Å; N797-Q799 PolarHBondContact O-N 3.31Å; Q799-G803 PolarHBondContact NE2-O 2.99Å; Q799-L804 WeakPolarHBondContact CA-O 3.43Å; Q799-I805 HydrophobicContact CG-CG2 3.77Å
800	D	94	Very high	95.4	Very high	9 Å²	9	34.7 Å²	34.7	5%	0.048	18%	0.184	C	C	.	.			trans	-76.9	-174.6	170.6	93	-18.1	0	0	0	112.5	R769 G802 G803 L804	R769-D800 IonicContact CZ-OD2 2.74Å; R769-D800 IonicContact NE-OD2 3.49Å; R769-D800 IonicContact NH1-OD2 3.72Å; R769-D800 PolarHBondContact NH1-OD2 3.02Å; R769-D800 WeakPolarHBondContact O-CB 3.35Å; D800-G802 PolarHBondContact O-N 3.45Å; D800-G802 VanDerWaalsContact OD1-CA 3.24Å; D800-G802 WeakPolarHBondContact OD1-CA 3.25Å; D800-G802 PolarHBondContact OD1-N 3.33Å; D800-G803 PolarHBondContact O-N 3.18Å; D800-G803 PolarHBondContact OD1-N 3.27Å; D800-L804 PolarHBondContact N-O 3.38Å; D800-L804 WeakPolarHBondContact OD1-CB 3.31Å; D800-L804 PolarHBondContact OD1-N 3.33Å
801	K	91.7	Very high	95.2	Very high	144 Å²	144	34.2 Å²	34.2	63%	0.626	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.2	179.6	-173.8	173.9	179.3	179	0	113.6	R769 N770 K834	R769-K801 WeakPolarHBondContact O-CB 3.37Å; R769-K801 PolarHBondContact O-N 3.31Å; N770-K801 HydrophobicContact CB-CB 4.01Å; K801-K834 WeakPolarHBondContact O-CE 3.41Å; K801-K834 PolarHBondContact O-NZ 3.39Å
802	G	90.8	Very high	95.1	Very high	10 Å²	10	29.8 Å²	29.8	10%	0.103	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-9.2	172.8	0	0	0	0	0	114	D800 K834	D800-G802 PolarHBondContact O-N 3.45Å; D800-G802 VanDerWaalsContact OD1-CA 3.24Å; D800-G802 WeakPolarHBondContact OD1-CA 3.25Å; D800-G802 PolarHBondContact OD1-N 3.33Å; G802-K834 VanDerWaalsContact O-CB 3.26Å; G802-K834 WeakPolarHBondContact O-CB 3.34Å; G802-K834 VanDerWaalsContact O-CG 3.24Å; G802-K834 WeakPolarHBondContact O-CG 3.45Å; G802-K834 PolarHBondContact O-N 3.32Å
803	G	93.1	Very high	94.9	Very high	2 Å²	2	31.2 Å²	31.2	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	87.8	3.5	-172.1	0	0	0	0	0	113.7	Q799 D800	Q799-G803 PolarHBondContact NE2-O 2.99Å; D800-G803 PolarHBondContact O-N 3.18Å; D800-G803 PolarHBondContact OD1-N 3.27Å
804	L	95.6	Very high	94.8	Very high	26 Å²	26	30 Å²	30	14%	0.136	15%	0.154	C	C	.	.			trans	-73.5	138.6	180	-61.4	164.4	0	0	0	109.3	R769 H775 Q799 D800 H808 D833	R769-L804 VanDerWaalsContact NH1-CD1 3.33Å; H775-L804 PolarHBondContact NE2-O 3.48Å; H775-L804 VanDerWaalsContact NE2-O 3.1Å; Q799-L804 WeakPolarHBondContact CA-O 3.43Å; D800-L804 PolarHBondContact N-O 3.38Å; D800-L804 WeakPolarHBondContact OD1-CB 3.31Å; D800-L804 PolarHBondContact OD1-N 3.33Å; L804-H808 HydrophobicContact CB-CB 4.09Å; L804-H808 HydrophobicContact CD2-CB 3.65Å; L804-H808 HydrophobicContact CG-CB 4.45Å; L804-D833 HydrophobicContact CD2-CB 3.73Å; L804-D833 HydrophobicContact CG-CB 4.18Å
805	I	97.4	Very high	94.7	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.158	C	C	.	.			trans	-97.7	167.6	170.4	62	158.1	0	0	0	110.4	N797 A798 Q799 L807 H808 T827 A831	N797-I805 WeakPolarHBondContact O-CG2 3.3Å; A798-I805 WeakPolarHBondContact O-CA 3.31Å; Q799-I805 HydrophobicContact CG-CG2 3.77Å; I805-L807 HydrophobicContact CD1-CB 3.9Å; I805-L807 HydrophobicContact CG1-CB 4.18Å; I805-L807 PolarHBondContact O-N 2.94Å; I805-H808 VanDerWaalsContact CG1-ND1 3.26Å; I805-H808 WeakPolarHBondContact CG1-ND1 3.1Å; I805-H808 PolarHBondContact N-ND1 3.19Å; I805-H808 VanDerWaalsContact N-ND1 3.18Å; I805-H808 WeakPolarHBondContact O-CB 3.4Å; I805-H808 PolarHBondContact O-N 3.32Å; I805-T827 WeakPolarHBondContact CD1-OG1 3.35Å; I805-A831 HydrophobicContact CD1-CB 3.59Å; I805-A831 HydrophobicContact CG1-CB 3.94Å; I805-A831 HydrophobicContact CG2-CB 4.4Å
806	P	97.6	Very high	94.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-52.1	-32.3	178	-30	36.5	0	0	0	114.5	L774 A778 H808 N809 A810 L822	L774-P806 HydrophobicContact CB-CG 4.42Å; L774-P806 HydrophobicContact CD2-CB 4.39Å; L774-P806 HydrophobicContact CD2-CG 3.96Å; L774-P806 HydrophobicContact CG-CB 4.09Å; L774-P806 HydrophobicContact CG-CG 3.93Å; A778-P806 HydrophobicContact CB-CB 4.04Å; P806-H808 PolarHBondContact O-N 2.92Å; P806-N809 WeakPolarHBondContact O-CB 3.47Å; P806-N809 PolarHBondContact O-N 3.23Å; P806-A810 PolarHBondContact O-N 3.06Å; P806-L822 HydrophobicContact CB-CD1 4.01Å; P806-L822 HydrophobicContact CB-CD2 4Å
807	L	97.7	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65	-34.6	176.5	-176.1	63.6	0	0	0	112.9	I805 N809 A810 A811 A819 L822 T827 P839 L855	I805-L807 HydrophobicContact CD1-CB 3.9Å; I805-L807 HydrophobicContact CG1-CB 4.18Å; I805-L807 PolarHBondContact O-N 2.94Å; L807-N809 VanDerWaalsContact C-N 3.34Å; L807-N809 PolarHBondContact O-N 3.43Å; L807-A810 PolarHBondContact O-N 3.27Å; L807-A811 VanDerWaalsContact O-CB 3.22Å; L807-A811 WeakPolarHBondContact O-CB 3.17Å; L807-A811 PolarHBondContact O-N 3.41Å; L807-A819 HydrophobicContact CD1-CB 3.66Å; L807-L822 HydrophobicContact CB-CD1 4.21Å; L807-L822 HydrophobicContact CD1-CD1 4.35Å; L807-T827 HydrophobicContact CB-CG2 4.15Å; L807-T827 HydrophobicContact CD1-CG2 4.41Å; L807-T827 HydrophobicContact CD2-CG2 3.55Å; L807-T827 HydrophobicContact CG-CG2 4.23Å; L807-P839 HydrophobicContact CB-CG 4.3Å; L807-P839 HydrophobicContact CD2-CB 3.98Å; L807-P839 HydrophobicContact CD2-CG 3.75Å; L807-P839 HydrophobicContact CG-CB 3.89Å; L807-P839 HydrophobicContact CG-CG 3.86Å; L807-L855 HydrophobicContact CD1-CD2 4.29Å; L807-L855 HydrophobicContact CD2-CD2 3.87Å; L807-L855 HydrophobicContact CG-CD2 4.38Å
808	H	97.2	Very high	94.5	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-39.4	173.3	-68.9	89.2	0	0	0	111.8	L804 I805 P806 A811 S812 A831 D833 F837 T838	L804-H808 HydrophobicContact CB-CB 4.09Å; L804-H808 HydrophobicContact CD2-CB 3.65Å; L804-H808 HydrophobicContact CG-CB 4.45Å; I805-H808 VanDerWaalsContact CG1-ND1 3.26Å; I805-H808 WeakPolarHBondContact CG1-ND1 3.1Å; I805-H808 PolarHBondContact N-ND1 3.19Å; I805-H808 VanDerWaalsContact N-ND1 3.18Å; I805-H808 WeakPolarHBondContact O-CB 3.4Å; I805-H808 PolarHBondContact O-N 3.32Å; P806-H808 PolarHBondContact O-N 2.92Å; H808-A811 PolarHBondContact O-N 2.79Å; H808-S812 PolarHBondContact O-N 2.95Å; H808-A831 WeakPolarHBondContact CE1-CB 3.46Å; H808-A831 PolarHBondContact CE1-O 3.44Å; H808-A831 PolarHBondContact NE2-O 2.91Å; H808-D833 PolarHBondContact NE2-N 3.31Å; H808-F837 PolarHBondContact NE2-O 3.29Å; H808-T838 WeakPolarHBondContact NE2-CA 3.44Å; H808-T838 PolarHBondContact NE2-N 2.91Å
809	N	95.2	Very high	94.5	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.053	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-47.6	175.5	-83	-1.6	0	0	0	110.5	R769 H775 P806 L807 A811 Y813	R769-N809 PolarHBondContact NH1-OD1 3.14Å; R769-N809 PolarHBondContact NH2-OD1 3.43Å; H775-N809 PolarHBondContact O-ND2 3.3Å; P806-N809 WeakPolarHBondContact O-CB 3.47Å; P806-N809 PolarHBondContact O-N 3.23Å; L807-N809 VanDerWaalsContact C-N 3.34Å; L807-N809 PolarHBondContact O-N 3.43Å; N809-A811 PolarHBondContact O-N 3.13Å; N809-Y813 VanDerWaalsContact O-CD2 3.28Å; N809-Y813 WeakPolarHBondContact O-CD2 3.38Å; N809-Y813 PolarHBondContact O-N 3.17Å
810	A	96	Very high	94.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.2	-37.3	173.3	0	0	0	0	0	111.4	P806 L807 G814 H815 I818 A819 L822	P806-A810 PolarHBondContact O-N 3.06Å; L807-A810 PolarHBondContact O-N 3.27Å; A810-G814 WeakPolarHBondContact O-CA 3.33Å; A810-G814 PolarHBondContact O-N 3.09Å; A810-H815 HydrophobicContact CB-CB 4.45Å; A810-H815 PolarHBondContact O-N 2.93Å; A810-I818 HydrophobicContact CB-CG2 3.91Å; A810-A819 HydrophobicContact CB-CB 4.32Å; A810-L822 HydrophobicContact CB-CD1 4.26Å
811	A	94.3	Very high	94.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-72.9	-42.2	-177.9	0	0	0	0	0	115.7	L807 H808 N809 Y813 P839 E842 A843 R848 L851	L807-A811 VanDerWaalsContact O-CB 3.22Å; L807-A811 WeakPolarHBondContact O-CB 3.17Å; L807-A811 PolarHBondContact O-N 3.41Å; H808-A811 PolarHBondContact O-N 2.79Å; N809-A811 PolarHBondContact O-N 3.13Å; A811-Y813 VanDerWaalsContact C-N 3.31Å; A811-Y813 PolarHBondContact O-N 2.97Å; A811-P839 HydrophobicContact CB-CB 4.02Å; A811-P839 WeakPolarHBondContact CB-O 3.47Å; A811-E842 HydrophobicContact CB-CB 4.32Å; A811-A843 HydrophobicContact CB-CB 4.41Å; A811-R848 WeakPolarHBondContact O-CG 3.46Å; A811-L851 HydrophobicContact CB-CD2 3.66Å
812	S	93.4	Very high	94.9	Very high	25 Å²	25	22 Å²	22	18%	0.175	12%	0.124	C	C	.	.	H	α-helix	trans	-64.3	-38.5	177.8	-150.1	0	0	0	0	111.5	H808 E842 K846 R848	H808-S812 PolarHBondContact O-N 2.95Å; S812-E842 VanDerWaalsContact CB-OE2 3.23Å; S812-E842 WeakPolarHBondContact CB-OE2 3.47Å; S812-E842 PolarHBondContact OG-OE2 3.17Å; S812-K846 WeakPolarHBondContact O-CG 3.09Å; S812-K846 WeakPolarHBondContact OG-CE 3.44Å; S812-R848 PolarHBondContact O-NE 3.33Å; S812-R848 VanDerWaalsContact O-NE 3.14Å; S812-R848 PolarHBondContact O-NH2 2.94Å
813	Y	90.8	Very high	95.1	Very high	127 Å²	127	22.6 Å²	22.6	50%	0.498	13%	0.125	S	C	.	.	H	α-helix	trans	-87.9	-20.3	-179.5	-65.8	-68.4	0	0	0	114.8	N809 A811 H815 R848	N809-Y813 VanDerWaalsContact O-CD2 3.28Å; N809-Y813 WeakPolarHBondContact O-CD2 3.38Å; N809-Y813 PolarHBondContact O-N 3.17Å; A811-Y813 VanDerWaalsContact C-N 3.31Å; A811-Y813 PolarHBondContact O-N 2.97Å; Y813-H815 WeakPolarHBondContact CB-NE2 3.22Å; Y813-R848 VanDerWaalsContact O-CZ 3.26Å; Y813-R848 PolarHBondContact O-NH2 3.46Å
814	G	90.4	Very high	95.2	Very high	23 Å²	23	28.9 Å²	28.9	24%	0.237	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	29.6	175.3	0	0	0	0	0	115	A810 V816	A810-G814 WeakPolarHBondContact O-CA 3.33Å; A810-G814 PolarHBondContact O-N 3.09Å; G814-V816 PolarHBondContact O-N 3.36Å
815	H	94.9	Very high	95.3	Very high	35 Å²	35	30.9 Å²	30.9	16%	0.162	16%	0.158	C	C	.	.			trans	-85.8	85.9	-175.4	-57.2	-43.4	0	0	0	111.2	A778 G779 A810 Y813 I818 A819	A778-H815 PolarHBondContact O-CD2 2.92Å; G779-H815 PolarHBondContact O-NE2 3.4Å; A810-H815 HydrophobicContact CB-CB 4.45Å; A810-H815 PolarHBondContact O-N 2.93Å; Y813-H815 WeakPolarHBondContact CB-NE2 3.22Å; H815-I818 HydrophobicContact CB-CB 4.18Å; H815-I818 PolarHBondContact O-N 3.29Å; H815-A819 PolarHBondContact O-N 2.92Å
816	V	92.9	Very high	95.1	Very high	38 Å²	38	37.1 Å²	37.1	23%	0.23	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-46.7	-171.1	-175.6	0	0	0	0	112.9	G814 I818 A819 A820 Q850 L851 L854	G814-V816 PolarHBondContact O-N 3.36Å; V816-I818 VanDerWaalsContact C-N 3.34Å; V816-I818 PolarHBondContact O-N 3.47Å; V816-A819 PolarHBondContact O-N 3.48Å; V816-A819 VanDerWaalsContact O-N 3.16Å; V816-A820 PolarHBondContact O-N 2.85Å; V816-Q850 HydrophobicContact CG2-CB 4.18Å; V816-L851 HydrophobicContact CB-CD1 4.37Å; V816-L851 HydrophobicContact CG1-CD1 4.49Å; V816-L851 HydrophobicContact CG2-CD1 4.15Å; V816-L854 HydrophobicContact CG1-CD2 4.08Å
817	D	94	Very high	95.1	Very high	107 Å²	107	37.6 Å²	37.6	57%	0.572	20%	0.195	S	C	*	.	H	α-helix	trans	-65.4	-38.8	-177	-54	-48.1	0	0	0	112	L783 A820 L821	L783-D817 HydrophobicContact CD1-CB 4.22Å; L783-D817 HydrophobicContact CD2-CB 4.23Å; D817-A820 PolarHBondContact O-N 3.25Å; D817-L821 WeakPolarHBondContact O-CB 3.31Å; D817-L821 PolarHBondContact O-N 3.35Å
818	I	96.6	Very high	95	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-41.7	173.5	-70.2	-165.4	0	0	0	111.1	A777 A778 L783 A810 H815 V816 A820 L821 L822	A777-I818 WeakPolarHBondContact O-CD1 3.49Å; A778-I818 HydrophobicContact CB-CG2 3.77Å; L783-I818 HydrophobicContact CB-CG1 4.36Å; L783-I818 HydrophobicContact CD1-CG1 3.81Å; A810-I818 HydrophobicContact CB-CG2 3.91Å; H815-I818 HydrophobicContact CB-CB 4.18Å; H815-I818 PolarHBondContact O-N 3.29Å; V816-I818 VanDerWaalsContact C-N 3.34Å; V816-I818 PolarHBondContact O-N 3.47Å; I818-A820 VanDerWaalsContact C-N 3.34Å; I818-L821 WeakPolarHBondContact O-CB 3.44Å; I818-L821 PolarHBondContact O-N 3.29Å; I818-L822 HydrophobicContact CG2-CD1 3.88Å; I818-L822 HydrophobicContact CG2-CG 4.28Å; I818-L822 WeakPolarHBondContact O-CB 3.45Å; I818-L822 VanDerWaalsContact O-CG 3.26Å; I818-L822 WeakPolarHBondContact O-CG 3.38Å; I818-L822 PolarHBondContact O-N 3.23Å
819	A	95.4	Very high	94.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.1	-41	177	0	0	0	0	0	111.7	L807 A810 H815 V816 L821 L822 I823 L851 L854	L807-A819 HydrophobicContact CD1-CB 3.66Å; A810-A819 HydrophobicContact CB-CB 4.32Å; H815-A819 PolarHBondContact O-N 2.92Å; V816-A819 PolarHBondContact O-N 3.48Å; V816-A819 VanDerWaalsContact O-N 3.16Å; A819-L821 VanDerWaalsContact C-N 3.34Å; A819-L822 PolarHBondContact O-N 3.41Å; A819-I823 WeakPolarHBondContact O-CB 3.16Å; A819-I823 WeakPolarHBondContact O-CD1 3.35Å; A819-I823 VanDerWaalsContact O-CG1 3.23Å; A819-I823 WeakPolarHBondContact O-CG1 3.38Å; A819-I823 PolarHBondContact O-N 3.36Å; A819-L851 HydrophobicContact CB-CD1 3.45Å; A819-L851 VanDerWaalsContact CB-CD1 3.45Å; A819-L854 HydrophobicContact CB-CD2 4.06Å
820	A	94.8	Very high	94.9	Very high	41 Å²	41	43.1 Å²	43.1	34%	0.339	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-41	173.4	0	0	0	0	0	111.9	V816 D817 I818 I823 K824 L854	V816-A820 PolarHBondContact O-N 2.85Å; D817-A820 PolarHBondContact O-N 3.25Å; I818-A820 VanDerWaalsContact C-N 3.34Å; A820-I823 PolarHBondContact O-N 3.03Å; A820-K824 WeakPolarHBondContact O-CB 3.49Å; A820-K824 PolarHBondContact O-N 2.91Å; A820-L854 HydrophobicContact CB-CD2 4.13Å
821	L	96.9	Very high	94.9	Very high	13 Å²	13	43.7 Å²	43.7	7%	0.068	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-46.6	173.3	-179.2	67.5	0	0	0	111.9	L783 A786 E787 L790 D817 I818 A819 I823 K824 Y825	L783-L821 HydrophobicContact CD1-CB 4.24Å; L783-L821 HydrophobicContact CD1-CD2 3.71Å; A786-L821 HydrophobicContact CB-CD2 4.05Å; E787-L821 HydrophobicContact CB-CD1 4.39Å; E787-L821 HydrophobicContact CB-CD2 3.86Å; E787-L821 HydrophobicContact CG-CD1 4.31Å; L790-L821 HydrophobicContact CD1-CD2 4.11Å; L790-L821 HydrophobicContact CD1-CG 3.91Å; D817-L821 WeakPolarHBondContact O-CB 3.31Å; D817-L821 PolarHBondContact O-N 3.35Å; I818-L821 WeakPolarHBondContact O-CB 3.44Å; I818-L821 PolarHBondContact O-N 3.29Å; A819-L821 VanDerWaalsContact C-N 3.34Å; L821-I823 VanDerWaalsContact C-N 3.3Å; L821-I823 PolarHBondContact O-N 3.31Å; L821-K824 HydrophobicContact CD1-CD 4.33Å; L821-K824 WeakPolarHBondContact O-CB 3.22Å; L821-K824 PolarHBondContact O-N 3.05Å; L821-Y825 HydrophobicContact CD1-CD2 3.95Å; L821-Y825 HydrophobicContact CD1-CE2 3.69Å; L821-Y825 HydrophobicContact CG-CD2 4.39Å; L821-Y825 HydrophobicContact CG-CE2 4.5Å; L821-Y825 WeakPolarHBondContact O-CD2 3.36Å; L821-Y825 PolarHBondContact O-N 3.05Å; L821-Y825 VanDerWaalsContact O-N 3.09Å
822	L	97.4	Very high	94.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-38	176.6	-68.5	168.4	0	0	0	111.5	L774 A778 L790 V796 P806 L807 A810 I818 A819 Y825 N826 T827	L774-L822 HydrophobicContact CD1-CD2 4.28Å; L774-L822 HydrophobicContact CD2-CD2 4.17Å; L774-L822 HydrophobicContact CG-CD2 4.38Å; A778-L822 HydrophobicContact CB-CD1 4.3Å; L790-L822 HydrophobicContact CD1-CD2 4.18Å; V796-L822 HydrophobicContact CG2-CB 4.33Å; V796-L822 HydrophobicContact CG2-CD2 3.7Å; P806-L822 HydrophobicContact CB-CD1 4.01Å; P806-L822 HydrophobicContact CB-CD2 4Å; L807-L822 HydrophobicContact CB-CD1 4.21Å; L807-L822 HydrophobicContact CD1-CD1 4.35Å; A810-L822 HydrophobicContact CB-CD1 4.26Å; I818-L822 HydrophobicContact CG2-CD1 3.88Å; I818-L822 HydrophobicContact CG2-CG 4.28Å; I818-L822 WeakPolarHBondContact O-CB 3.45Å; I818-L822 VanDerWaalsContact O-CG 3.26Å; I818-L822 WeakPolarHBondContact O-CG 3.38Å; I818-L822 PolarHBondContact O-N 3.23Å; A819-L822 PolarHBondContact O-N 3.41Å; L822-Y825 CarbonylContact O-C 3.59Å; L822-Y825 PolarHBondContact O-N 2.97Å; L822-N826 PolarHBondContact O-N 3.3Å; L822-T827 HydrophobicContact CB-CG2 3.92Å; L822-T827 WeakPolarHBondContact O-CB 3.35Å; L822-T827 WeakPolarHBondContact O-CG2 3.19Å; L822-T827 PolarHBondContact O-N 3.48Å
823	I	95.2	Very high	95	Very high	24 Å²	24	46 Å²	46	12%	0.123	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-43	173.5	-70.1	163	0	0	0	111.4	A819 A820 L821 Y825 N826 T827 V829 L854 H858	A819-I823 WeakPolarHBondContact O-CB 3.16Å; A819-I823 WeakPolarHBondContact O-CD1 3.35Å; A819-I823 VanDerWaalsContact O-CG1 3.23Å; A819-I823 WeakPolarHBondContact O-CG1 3.38Å; A819-I823 PolarHBondContact O-N 3.36Å; A820-I823 PolarHBondContact O-N 3.03Å; L821-I823 VanDerWaalsContact C-N 3.3Å; L821-I823 PolarHBondContact O-N 3.31Å; I823-Y825 PolarHBondContact O-N 3.45Å; I823-N826 PolarHBondContact O-N 2.95Å; I823-T827 HydrophobicContact CG1-CG2 3.96Å; I823-V829 HydrophobicContact CG1-CG2 4.1Å; I823-L854 HydrophobicContact CD1-CD2 4.23Å; I823-L854 HydrophobicContact CD1-CG 4.23Å; I823-H858 HydrophobicContact CD1-CB 4.13Å; I823-H858 HydrophobicContact CG2-CB 4.11Å
824	K	96	Very high	95.1	Very high	133 Å²	133	46.7 Å²	46.7	58%	0.578	25%	0.252	S	S	*	.	H	α-helix	trans	-57.5	-31.6	173.4	173.2	-171.4	168.2	-164.4	0	112.4	E787 A820 L821	E787-K824 IonicContact OE1-NZ 3.25Å; A820-K824 WeakPolarHBondContact O-CB 3.49Å; A820-K824 PolarHBondContact O-N 2.91Å; L821-K824 HydrophobicContact CD1-CD 4.33Å; L821-K824 WeakPolarHBondContact O-CB 3.22Å; L821-K824 PolarHBondContact O-N 3.05Å
825	Y	97.1	Very high	95.3	Very high	69 Å²	69	52.2 Å²	52.2	27%	0.271	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	24.1	175.1	-77.5	-91.9	0	0	0	113.7	L790 E791 V796 L821 L822 I823 T827	L790-Y825 HydrophobicContact CB-CD1 3.84Å; L790-Y825 HydrophobicContact CB-CD2 4.02Å; L790-Y825 HydrophobicContact CB-CE1 3.85Å; L790-Y825 HydrophobicContact CB-CE2 4.01Å; L790-Y825 HydrophobicContact CB-CG 3.93Å; L790-Y825 HydrophobicContact CD1-CD2 3.72Å; L790-Y825 HydrophobicContact CD1-CE2 4.23Å; L790-Y825 HydrophobicContact CD1-CG 4Å; L790-Y825 HydrophobicContact CD2-CD1 4.44Å; L790-Y825 HydrophobicContact CD2-CG 4.15Å; L790-Y825 HydrophobicContact CG-CD2 4.35Å; L790-Y825 HydrophobicContact CG-CG 4.25Å; E791-Y825 VanDerWaalsContact CG-OH 3.25Å; E791-Y825 WeakPolarHBondContact CG-OH 3.4Å; V796-Y825 WeakPolarHBondContact CG1-O 3.38Å; L821-Y825 HydrophobicContact CD1-CD2 3.95Å; L821-Y825 HydrophobicContact CD1-CE2 3.69Å; L821-Y825 HydrophobicContact CG-CD2 4.39Å; L821-Y825 HydrophobicContact CG-CE2 4.5Å; L821-Y825 WeakPolarHBondContact O-CD2 3.36Å; L821-Y825 PolarHBondContact O-N 3.05Å; L821-Y825 VanDerWaalsContact O-N 3.09Å; L822-Y825 CarbonylContact O-C 3.59Å; L822-Y825 PolarHBondContact O-N 2.97Å; I823-Y825 PolarHBondContact O-N 3.45Å; Y825-T827 PolarHBondContact O-N 2.94Å
826	N	94	Very high	95.2	Very high	133 Å²	133	51.9 Å²	51.9	71%	0.711	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	41.5	175.5	-64.7	8.5	0	0	0	115	N797 L822 I823	N797-N826 PolarHBondContact ND2-O 3.22Å; L822-N826 PolarHBondContact O-N 3.3Å; I823-N826 PolarHBondContact O-N 2.95Å
827	T	96.4	Very high	95.4	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	26%	0.264	C	S	.	.			trans	-62.2	147.1	166.7	-157.4	0	0	0	0	111.8	V796 N797 I805 L807 L822 I823 Y825 V829	V796-T827 PolarHBondContact O-OG1 2.97Å; N797-T827 WeakPolarHBondContact OD1-CA 3.31Å; N797-T827 PolarHBondContact OD1-OG1 2.75Å; I805-T827 WeakPolarHBondContact CD1-OG1 3.35Å; L807-T827 HydrophobicContact CB-CG2 4.15Å; L807-T827 HydrophobicContact CD1-CG2 4.41Å; L807-T827 HydrophobicContact CD2-CG2 3.55Å; L807-T827 HydrophobicContact CG-CG2 4.23Å; L822-T827 HydrophobicContact CB-CG2 3.92Å; L822-T827 WeakPolarHBondContact O-CB 3.35Å; L822-T827 WeakPolarHBondContact O-CG2 3.19Å; L822-T827 PolarHBondContact O-N 3.48Å; I823-T827 HydrophobicContact CG1-CG2 3.96Å; Y825-T827 PolarHBondContact O-N 2.94Å; T827-V829 PolarHBondContact O-N 3.07Å; T827-V829 VanDerWaalsContact O-N 3.13Å
828	C	95.2	Very high	95.5	Very high	62 Å²	62	46.4 Å²	46.4	42%	0.419	24%	0.237	S	C	.	.			trans	-79.9	96.2	178.6	-176.4	0	0	0	0	110.3	N797 N830 A831	N797-C828 PolarHBondContact OD1-N 2.88Å; C828-N830 PolarHBondContact O-N 3.35Å; C828-N830 VanDerWaalsContact O-N 3.16Å; C828-A831 HydrophobicContact CB-CB 4Å; C828-A831 WeakPolarHBondContact O-CB 2.99Å; C828-A831 PolarHBondContact O-N 3.35Å
829	V	95.8	Very high	95.6	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.097	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-32.3	-177.2	178.5	0	0	0	0	113.1	I823 T827 P839 L855 A860	I823-V829 HydrophobicContact CG1-CG2 4.1Å; T827-V829 PolarHBondContact O-N 3.07Å; T827-V829 VanDerWaalsContact O-N 3.13Å; V829-P839 WeakPolarHBondContact O-CD 3.22Å; V829-L855 HydrophobicContact CG1-CD2 4.02Å; V829-A860 HydrophobicContact CG1-CB 3.66Å
830	N	95.4	Very high	95.6	Very high	50 Å²	50	46.4 Å²	46.4	27%	0.267	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	20.1	177.6	-69.4	-45.8	0	0	0	113.6	C828 T832 G859 A860 D861 M864	C828-N830 PolarHBondContact O-N 3.35Å; C828-N830 VanDerWaalsContact O-N 3.16Å; N830-T832 PolarHBondContact O-N 3.22Å; N830-G859 PolarHBondContact ND2-O 3.48Å; N830-A860 VanDerWaalsContact OD1-CA 3.28Å; N830-A860 WeakPolarHBondContact OD1-CA 3.48Å; N830-D861 PolarHBondContact OD1-N 3.05Å; N830-M864 HydrophobicContact CB-SD 3.81Å
831	A	95.3	Very high	95.6	Very high	12 Å²	12	44.4 Å²	44.4	10%	0.099	22%	0.221	C	C	.	.			trans	-57.4	133.7	175.4	0	0	0	0	0	111.1	I805 H808 C828 T838 P839	I805-A831 HydrophobicContact CD1-CB 3.59Å; I805-A831 HydrophobicContact CG1-CB 3.94Å; I805-A831 HydrophobicContact CG2-CB 4.4Å; H808-A831 WeakPolarHBondContact CE1-CB 3.46Å; H808-A831 PolarHBondContact CE1-O 3.44Å; H808-A831 PolarHBondContact NE2-O 2.91Å; C828-A831 HydrophobicContact CB-CB 4Å; C828-A831 WeakPolarHBondContact O-CB 2.99Å; C828-A831 PolarHBondContact O-N 3.35Å; A831-T838 WeakPolarHBondContact O-CA 3.32Å; A831-P839 WeakPolarHBondContact O-CD 3.28Å
832	T	95.6	Very high	95.5	Very high	59 Å²	59	45.1 Å²	45.1	36%	0.362	22%	0.224	S	C	.	.			trans	-101	138.5	175.9	41.7	0	0	0	0	111.4	N830 A836 F837 T838 M864	N830-T832 PolarHBondContact O-N 3.22Å; T832-A836 HydrophobicContact CG2-CB 4.26Å; T832-F837 WeakPolarHBondContact CA-O 3.42Å; T832-T838 HydrophobicContact CG2-CG2 3.92Å; T832-M864 HydrophobicContact CG2-CE 3.74Å
833	D	94.2	Very high	95.4	Very high	15 Å²	15	45.1 Å²	45.1	8%	0.08	22%	0.224	C	C	.	.			trans	-80.4	-173.6	166.3	80.8	-3.5	0	0	0	111.6	L804 H808 W835 A836 F837	L804-D833 HydrophobicContact CD2-CB 3.73Å; L804-D833 HydrophobicContact CG-CB 4.18Å; H808-D833 PolarHBondContact NE2-N 3.31Å; D833-W835 PolarHBondContact O-N 2.89Å; D833-W835 WeakPolarHBondContact OD1-CA 3.48Å; D833-W835 PolarHBondContact OD1-N 2.87Å; D833-A836 PolarHBondContact O-N 2.98Å; D833-A836 PolarHBondContact OD1-N 2.93Å; D833-A836 VanDerWaalsContact OD1-N 3.07Å; D833-F837 PolarHBondContact N-O 3.18Å; D833-F837 PolarHBondContact OD1-N 3.49Å
834	K	93.9	Very high	95.2	Very high	140 Å²	140	44 Å²	44	61%	0.609	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-15.7	-179.5	-76.5	177.7	177.2	178.2	0	115.2	K801 G802	K801-K834 WeakPolarHBondContact O-CE 3.41Å; K801-K834 PolarHBondContact O-NZ 3.39Å; G802-K834 VanDerWaalsContact O-CB 3.26Å; G802-K834 WeakPolarHBondContact O-CB 3.34Å; G802-K834 VanDerWaalsContact O-CG 3.24Å; G802-K834 WeakPolarHBondContact O-CG 3.45Å; G802-K834 PolarHBondContact O-N 3.32Å
835	W	93.9	Very high	95.1	Very high	139 Å²	139	40.5 Å²	40.5	53%	0.527	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	12.5	176.4	-57.4	-79.5	0	0	0	111.8	D833 F837 Q867	D833-W835 PolarHBondContact O-N 2.89Å; D833-W835 WeakPolarHBondContact OD1-CA 3.48Å; D833-W835 PolarHBondContact OD1-N 2.87Å; W835-F837 HydrophobicContact CB-CD2 4Å; W835-F837 HydrophobicContact CB-CE2 4.42Å; W835-F837 PolarHBondContact O-N 3.39Å; W835-Q867 WeakPolarHBondContact O-CB 3.36Å; W835-Q867 PolarHBondContact O-N 3.22Å
836	A	94	Very high	94.8	Very high	29 Å²	29	41.3 Å²	41.3	24%	0.24	21%	0.209	C	C	.	.			trans	60.3	25	-175.3	0	0	0	0	0	115.1	T832 D833	T832-A836 HydrophobicContact CG2-CB 4.26Å; D833-A836 PolarHBondContact O-N 2.98Å; D833-A836 PolarHBondContact OD1-N 2.93Å; D833-A836 VanDerWaalsContact OD1-N 3.07Å
837	F	96.3	Very high	94.5	Very high	29 Å²	29	36.3 Å²	36.3	13%	0.127	19%	0.189	C	C	.	.			trans	-74.7	134.9	167.3	-82.6	-116.1	0	0	0	110.3	H808 T832 D833 W835 H841 N866 L875	H808-F837 PolarHBondContact NE2-O 3.29Å; T832-F837 WeakPolarHBondContact CA-O 3.42Å; D833-F837 PolarHBondContact N-O 3.18Å; D833-F837 PolarHBondContact OD1-N 3.49Å; W835-F837 HydrophobicContact CB-CD2 4Å; W835-F837 HydrophobicContact CB-CE2 4.42Å; W835-F837 PolarHBondContact O-N 3.39Å; F837-H841 HydrophobicContact CB-CB 4.41Å; F837-H841 HydrophobicContact CD1-CB 3.71Å; F837-H841 HydrophobicContact CE1-CB 4.37Å; F837-H841 HydrophobicContact CG-CB 4.31Å; F837-N866 HydrophobicContact CD2-CB 3.75Å; F837-N866 HydrophobicContact CE2-CB 3.74Å; F837-N866 WeakPolarHBondContact CE2-ND2 3.28Å; F837-N866 HydrophobicContact CG-CB 4.47Å; F837-N866 HydrophobicContact CZ-CB 4.46Å; F837-N866 VanDerWaalsContact CZ-ND2 3.29Å; F837-N866 WeakPolarHBondContact CZ-ND2 3.46Å; F837-L875 HydrophobicContact CD1-CD1 4.27Å; F837-L875 HydrophobicContact CE1-CD1 3.45Å; F837-L875 VanDerWaalsContact CE1-CD1 3.45Å; F837-L875 HydrophobicContact CZ-CD1 3.9Å
838	T	97.1	Very high	94.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.			trans	-100	164.7	170.6	70.6	0	0	0	0	110.9	H808 A831 T832 L840 H841 E842 M864	H808-T838 WeakPolarHBondContact NE2-CA 3.44Å; H808-T838 PolarHBondContact NE2-N 2.91Å; A831-T838 WeakPolarHBondContact O-CA 3.32Å; T832-T838 HydrophobicContact CG2-CG2 3.92Å; T838-L840 PolarHBondContact O-N 2.99Å; T838-L840 VanDerWaalsContact O-N 3.12Å; T838-L840 PolarHBondContact OG1-N 3.28Å; T838-H841 PolarHBondContact N-ND1 3.38Å; T838-H841 WeakPolarHBondContact O-CB 3.46Å; T838-H841 PolarHBondContact O-N 2.87Å; T838-H841 PolarHBondContact OG1-ND1 3.46Å; T838-E842 PolarHBondContact O-N 3.37Å; T838-E842 VanDerWaalsContact O-N 3.17Å; T838-M864 HydrophobicContact CG2-CE 3.67Å; T838-M864 HydrophobicContact CG2-SD 3.9Å
839	P	97.2	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-53.8	-30.2	172.6	-27.4	35.8	0	0	0	113.5	L807 A811 V829 A831 A843 L855	L807-P839 HydrophobicContact CB-CG 4.3Å; L807-P839 HydrophobicContact CD2-CB 3.98Å; L807-P839 HydrophobicContact CD2-CG 3.75Å; L807-P839 HydrophobicContact CG-CB 3.89Å; L807-P839 HydrophobicContact CG-CG 3.86Å; A811-P839 HydrophobicContact CB-CB 4.02Å; A811-P839 WeakPolarHBondContact CB-O 3.47Å; V829-P839 WeakPolarHBondContact O-CD 3.22Å; A831-P839 WeakPolarHBondContact O-CD 3.28Å; P839-A843 VanDerWaalsContact O-CB 3.32Å; P839-A843 WeakPolarHBondContact O-CB 3.45Å; P839-A843 PolarHBondContact O-N 3.34Å; P839-L855 HydrophobicContact CB-CD1 4.17Å; P839-L855 HydrophobicContact CB-CD2 4.23Å
840	L	96.1	Very high	93.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-37.6	175.2	-174.7	64.6	0	0	0	112.6	T838 A843 A844 C852 L855 L856 A860 P862 A872 L885	T838-L840 PolarHBondContact O-N 2.99Å; T838-L840 VanDerWaalsContact O-N 3.12Å; T838-L840 PolarHBondContact OG1-N 3.28Å; L840-A843 PolarHBondContact O-N 2.89Å; L840-A844 VanDerWaalsContact O-CB 3.25Å; L840-A844 WeakPolarHBondContact O-CB 3.06Å; L840-A844 PolarHBondContact O-N 3.43Å; L840-C852 HydrophobicContact CD1-CB 4.14Å; L840-L855 HydrophobicContact CB-CD1 4.46Å; L840-L855 HydrophobicContact CD1-CB 4.21Å; L840-L855 HydrophobicContact CD1-CD1 4.43Å; L840-L856 HydrophobicContact CD1-CD2 4.43Å; L840-L856 HydrophobicContact CD1-CG 4.18Å; L840-L856 HydrophobicContact CD2-CD2 3.8Å; L840-L856 HydrophobicContact CD2-CG 4.43Å; L840-A860 HydrophobicContact CB-CB 4.15Å; L840-A860 HydrophobicContact CD2-CB 3.89Å; L840-A860 HydrophobicContact CG-CB 4.43Å; L840-P862 HydrophobicContact CD2-CB 4.18Å; L840-A872 HydrophobicContact CD2-CB 4.25Å; L840-A872 HydrophobicContact CG-CB 3.98Å; L840-L885 HydrophobicContact CD1-CD2 4.25Å; L840-L885 HydrophobicContact CD2-CD2 4.1Å; L840-L885 HydrophobicContact CG-CD2 4.36Å
841	H	95.8	Very high	93.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.3	-44.6	173.5	-70.6	83.1	0	0	0	111.1	F837 T838 A844 Q845 M864 Q870 A872 L875	F837-H841 HydrophobicContact CB-CB 4.41Å; F837-H841 HydrophobicContact CD1-CB 3.71Å; F837-H841 HydrophobicContact CE1-CB 4.37Å; F837-H841 HydrophobicContact CG-CB 4.31Å; T838-H841 PolarHBondContact N-ND1 3.38Å; T838-H841 WeakPolarHBondContact O-CB 3.46Å; T838-H841 PolarHBondContact O-N 2.87Å; T838-H841 PolarHBondContact OG1-ND1 3.46Å; H841-A844 PolarHBondContact O-N 3.09Å; H841-Q845 VanDerWaalsContact O-CB 3.3Å; H841-Q845 WeakPolarHBondContact O-CB 3.26Å; H841-Q845 PolarHBondContact O-N 3.41Å; H841-M864 PolarHBondContact CE1-O 3.01Å; H841-M864 VanDerWaalsContact CE1-O 3.28Å; H841-M864 PolarHBondContact NE2-O 3.41Å; H841-Q870 PolarHBondContact NE2-O 2.94Å; H841-A872 PolarHBondContact CD2-N 2.95Å; H841-A872 PolarHBondContact NE2-N 3.48Å; H841-L875 HydrophobicContact CB-CD1 4.17Å
842	E	94.5	Very high	92.8	Very high	27 Å²	27	42 Å²	42	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-60.6	-51.2	174.3	-82.8	-67.2	145.9	0	0	111.5	A811 S812 T838 A844 Q845 K846	A811-E842 HydrophobicContact CB-CB 4.32Å; S812-E842 VanDerWaalsContact CB-OE2 3.23Å; S812-E842 WeakPolarHBondContact CB-OE2 3.47Å; S812-E842 PolarHBondContact OG-OE2 3.17Å; T838-E842 PolarHBondContact O-N 3.37Å; T838-E842 VanDerWaalsContact O-N 3.17Å; E842-A844 VanDerWaalsContact C-N 3.32Å; E842-A844 PolarHBondContact O-N 3.13Å; E842-Q845 PolarHBondContact O-N 3.18Å; E842-K846 WeakPolarHBondContact O-CB 3.16Å; E842-K846 VanDerWaalsContact O-CG 3.32Å; E842-K846 WeakPolarHBondContact O-CG 3.47Å; E842-K846 PolarHBondContact O-N 2.98Å; E842-K846 VanDerWaalsContact OE2-CE 3.26Å; E842-K846 WeakPolarHBondContact OE2-CE 3.43Å; E842-K846 IonicContact OE2-NZ 2.69Å
843	A	94.1	Very high	92.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-43.6	178.8	0	0	0	0	0	112.3	A811 P839 L840 G847 R848 L851 C852 L855	A811-A843 HydrophobicContact CB-CB 4.41Å; P839-A843 VanDerWaalsContact O-CB 3.32Å; P839-A843 WeakPolarHBondContact O-CB 3.45Å; P839-A843 PolarHBondContact O-N 3.34Å; L840-A843 PolarHBondContact O-N 2.89Å; A843-G847 PolarHBondContact O-N 3.25Å; A843-R848 HydrophobicContact CB-CB 4.15Å; A843-R848 WeakPolarHBondContact O-CB 3.34Å; A843-R848 PolarHBondContact O-N 3.01Å; A843-L851 HydrophobicContact CB-CD2 4.2Å; A843-C852 VanDerWaalsContact C-SG 3.58Å; A843-L855 HydrophobicContact CB-CD1 3.93Å
844	A	92.4	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-44.1	179.8	0	0	0	0	0	112.3	L840 H841 E842 K846 G847 A872 A876 T877 I881 L885	L840-A844 VanDerWaalsContact O-CB 3.25Å; L840-A844 WeakPolarHBondContact O-CB 3.06Å; L840-A844 PolarHBondContact O-N 3.43Å; H841-A844 PolarHBondContact O-N 3.09Å; E842-A844 VanDerWaalsContact C-N 3.32Å; E842-A844 PolarHBondContact O-N 3.13Å; A844-K846 PolarHBondContact O-N 2.97Å; A844-G847 PolarHBondContact O-N 3.46Å; A844-A872 HydrophobicContact CB-CB 4.11Å; A844-A872 WeakPolarHBondContact CB-O 3.28Å; A844-A876 HydrophobicContact CB-CB 4.35Å; A844-T877 PolarHBondContact O-N 3.3Å; A844-I881 HydrophobicContact CB-CG2 4.03Å; A844-L885 HydrophobicContact CB-CD1 3.92Å
845	Q	93.3	Very high	92.1	Very high	61 Å²	61	35.3 Å²	35.3	29%	0.285	18%	0.177	S	C	.	.	H	α-helix	trans	-64.3	-40	178.3	-165.7	-166.1	71.8	0	0	111.8	H841 E842 G847 L875 T877	H841-Q845 VanDerWaalsContact O-CB 3.3Å; H841-Q845 WeakPolarHBondContact O-CB 3.26Å; H841-Q845 PolarHBondContact O-N 3.41Å; E842-Q845 PolarHBondContact O-N 3.18Å; Q845-G847 VanDerWaalsContact C-N 3.34Å; Q845-G847 PolarHBondContact O-N 3.15Å; Q845-L875 WeakPolarHBondContact CA-O 3.28Å; Q845-L875 HydrophobicContact CB-CB 4.22Å; Q845-L875 HydrophobicContact CG-CB 4.48Å; Q845-T877 VanDerWaalsContact O-CG2 3.31Å; Q845-T877 WeakPolarHBondContact O-CG2 3.25Å; Q845-T877 PolarHBondContact O-OG1 2.93Å
846	K	90.4	Very high	91.9	Very high	85 Å²	85	30.1 Å²	30.1	37%	0.37	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	3.8	-178.9	-53.5	-46.8	-176.9	-155	0	114.8	S812 E842 A844 R848	S812-K846 WeakPolarHBondContact O-CG 3.09Å; S812-K846 WeakPolarHBondContact OG-CE 3.44Å; E842-K846 WeakPolarHBondContact O-CB 3.16Å; E842-K846 VanDerWaalsContact O-CG 3.32Å; E842-K846 WeakPolarHBondContact O-CG 3.47Å; E842-K846 PolarHBondContact O-N 2.98Å; E842-K846 VanDerWaalsContact OE2-CE 3.26Å; E842-K846 WeakPolarHBondContact OE2-CE 3.43Å; E842-K846 IonicContact OE2-NZ 2.69Å; A844-K846 PolarHBondContact O-N 2.97Å; K846-R848 HydrophobicContact CB-CG 4.09Å
847	G	88.9	Confident	91.7	Very high	29 Å²	29	32.7 Å²	32.7	30%	0.299	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	40.9	176.2	0	0	0	0	0	114.3	A843 A844 Q845 I881	A843-G847 PolarHBondContact O-N 3.25Å; A844-G847 PolarHBondContact O-N 3.46Å; Q845-G847 VanDerWaalsContact C-N 3.34Å; Q845-G847 PolarHBondContact O-N 3.15Å; G847-I881 VanDerWaalsContact CA-CD1 3.46Å
848	R	90.3	Very high	91.5	Very high	86 Å²	86	36 Å²	36	33%	0.325	20%	0.196	S	C	.	.			trans	-103.4	64.7	-173.6	-49.2	-52.4	-171.7	-178.7	2	113.5	A811 S812 Y813 A843 K846 Q850 L851 C852	A811-R848 WeakPolarHBondContact O-CG 3.46Å; S812-R848 PolarHBondContact O-NE 3.33Å; S812-R848 VanDerWaalsContact O-NE 3.14Å; S812-R848 PolarHBondContact O-NH2 2.94Å; Y813-R848 VanDerWaalsContact O-CZ 3.26Å; Y813-R848 PolarHBondContact O-NH2 3.46Å; A843-R848 HydrophobicContact CB-CB 4.15Å; A843-R848 WeakPolarHBondContact O-CB 3.34Å; A843-R848 PolarHBondContact O-N 3.01Å; K846-R848 HydrophobicContact CB-CG 4.09Å; R848-Q850 PolarHBondContact O-N 2.91Å; R848-L851 HydrophobicContact CB-CB 4Å; R848-L851 WeakPolarHBondContact O-CA 3.44Å; R848-L851 WeakPolarHBondContact O-CB 3.45Å; R848-L851 PolarHBondContact O-N 2.74Å; R848-C852 PolarHBondContact O-N 3.03Å
849	T	86.4	Confident	90.9	Very high	41 Å²	41	38.3 Å²	38.3	25%	0.252	22%	0.22	S	C	.	.	H	α-helix	trans	-51.2	-48.9	-171.4	-37.5	0	0	0	0	115	L851 C852 A853 D880 I881 L884	T849-L851 PolarHBondContact O-N 3.09Å; T849-C852 PolarHBondContact O-N 2.81Å; T849-A853 PolarHBondContact O-N 3.47Å; T849-D880 VanDerWaalsContact CB-OD2 3.31Å; T849-D880 WeakPolarHBondContact CB-OD2 3.22Å; T849-D880 HydrophobicContact CG2-CB 4.2Å; T849-D880 WeakPolarHBondContact CG2-OD2 3.46Å; T849-D880 PolarHBondContact OG1-OD2 3.18Å; T849-I881 HydrophobicContact CG2-CG1 3.95Å; T849-I881 WeakPolarHBondContact OG1-CG1 3.48Å; T849-L884 HydrophobicContact CG2-CD2 4.44Å
850	Q	85.6	Confident	90.7	Very high	140 Å²	140	38.7 Å²	38.7	65%	0.654	22%	0.223	S	C	*	.	H	α-helix	trans	-59	-34.6	177.8	-69.8	179.4	-15.6	0	0	112.4	V816 R848 L854	V816-Q850 HydrophobicContact CG2-CB 4.18Å; R848-Q850 PolarHBondContact O-N 2.91Å; Q850-L854 PolarHBondContact O-N 2.87Å
851	L	89.5	Confident	90.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-83	-36.3	-179.1	-161.9	79.1	0	0	0	112.5	A811 V816 A819 A843 R848 T849 A853 L854 L855	A811-L851 HydrophobicContact CB-CD2 3.66Å; V816-L851 HydrophobicContact CB-CD1 4.37Å; V816-L851 HydrophobicContact CG1-CD1 4.49Å; V816-L851 HydrophobicContact CG2-CD1 4.15Å; A819-L851 HydrophobicContact CB-CD1 3.45Å; A819-L851 VanDerWaalsContact CB-CD1 3.45Å; A843-L851 HydrophobicContact CB-CD2 4.2Å; R848-L851 HydrophobicContact CB-CB 4Å; R848-L851 WeakPolarHBondContact O-CA 3.44Å; R848-L851 WeakPolarHBondContact O-CB 3.45Å; R848-L851 PolarHBondContact O-N 2.74Å; T849-L851 PolarHBondContact O-N 3.09Å; L851-A853 PolarHBondContact O-N 2.93Å; L851-L854 HydrophobicContact CD1-CD2 3.93Å; L851-L854 PolarHBondContact O-N 3.34Å; L851-L855 HydrophobicContact CD2-CD1 4.24Å; L851-L855 HydrophobicContact CG-CD1 4.12Å; L851-L855 HydrophobicContact CG-CG 4.31Å; L851-L855 WeakPolarHBondContact O-CB 3.44Å; L851-L855 VanDerWaalsContact O-CG 3.22Å; L851-L855 WeakPolarHBondContact O-CG 3.4Å; L851-L855 PolarHBondContact O-N 3.2Å
852	C	89.4	Confident	90.2	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-54.4	-44.6	167	-65.5	0	0	0	0	110.2	L840 A843 R848 T849 L855 L856 L884	L840-C852 HydrophobicContact CD1-CB 4.14Å; A843-C852 VanDerWaalsContact C-SG 3.58Å; R848-C852 PolarHBondContact O-N 3.03Å; T849-C852 PolarHBondContact O-N 2.81Å; C852-L855 PolarHBondContact O-N 2.73Å; C852-L856 WeakPolarHBondContact O-CB 3.3Å; C852-L856 WeakPolarHBondContact O-CD1 3.36Å; C852-L856 WeakPolarHBondContact O-CG 3.43Å; C852-L856 PolarHBondContact O-N 3.35Å; C852-L884 HydrophobicContact CB-CD2 3.75Å
853	A	87.6	Confident	90	Very high	41 Å²	41	43 Å²	43	34%	0.339	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-45.3	176.8	0	0	0	0	0	112.6	T849 L851 A857 L884	T849-A853 PolarHBondContact O-N 3.47Å; L851-A853 PolarHBondContact O-N 2.93Å; A853-A857 VanDerWaalsContact O-CB 3.29Å; A853-A857 WeakPolarHBondContact O-CB 3.49Å; A853-A857 PolarHBondContact O-N 3.15Å; A853-L884 HydrophobicContact CB-CD2 3.99Å
854	L	89.6	Confident	89.9	Confident	33 Å²	33	45.4 Å²	45.4	17%	0.173	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-48.2	175.7	-176.6	70.9	0	0	0	111.8	V816 A819 A820 I823 Q850 L851 A857 H858	V816-L854 HydrophobicContact CG1-CD2 4.08Å; A819-L854 HydrophobicContact CB-CD2 4.06Å; A820-L854 HydrophobicContact CB-CD2 4.13Å; I823-L854 HydrophobicContact CD1-CD2 4.23Å; I823-L854 HydrophobicContact CD1-CG 4.23Å; Q850-L854 PolarHBondContact O-N 2.87Å; L851-L854 HydrophobicContact CD1-CD2 3.93Å; L851-L854 PolarHBondContact O-N 3.34Å; L854-A857 PolarHBondContact O-N 3.35Å; L854-H858 PolarHBondContact O-CD2 3.27Å; L854-H858 VanDerWaalsContact O-CD2 3.23Å; L854-H858 PolarHBondContact O-N 3.47Å
855	L	91.9	Very high	89.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-46	-179	-70.9	168.7	0	0	0	111.2	L807 V829 P839 L840 A843 L851 C852 H858 G859 A860	L807-L855 HydrophobicContact CD1-CD2 4.29Å; L807-L855 HydrophobicContact CD2-CD2 3.87Å; L807-L855 HydrophobicContact CG-CD2 4.38Å; V829-L855 HydrophobicContact CG1-CD2 4.02Å; P839-L855 HydrophobicContact CB-CD1 4.17Å; P839-L855 HydrophobicContact CB-CD2 4.23Å; L840-L855 HydrophobicContact CB-CD1 4.46Å; L840-L855 HydrophobicContact CD1-CB 4.21Å; L840-L855 HydrophobicContact CD1-CD1 4.43Å; A843-L855 HydrophobicContact CB-CD1 3.93Å; L851-L855 HydrophobicContact CD2-CD1 4.24Å; L851-L855 HydrophobicContact CG-CD1 4.12Å; L851-L855 HydrophobicContact CG-CG 4.31Å; L851-L855 WeakPolarHBondContact O-CB 3.44Å; L851-L855 VanDerWaalsContact O-CG 3.22Å; L851-L855 WeakPolarHBondContact O-CG 3.4Å; L851-L855 PolarHBondContact O-N 3.2Å; C852-L855 PolarHBondContact O-N 2.73Å; L855-H858 CarbonylContact O-C 3.45Å; L855-H858 PolarHBondContact O-N 2.92Å; L855-G859 PolarHBondContact O-N 3.5Å; L855-A860 VanDerWaalsContact C-CB 3.43Å; L855-A860 HydrophobicContact CB-CB 3.86Å; L855-A860 WeakPolarHBondContact O-CB 3.25Å; L855-A860 PolarHBondContact O-N 2.94Å
856	L	90.3	Very high	89.9	Confident	31 Å²	31	49 Å²	49	16%	0.162	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-44	175.7	-70	167.2	0	0	0	111.8	L840 C852 H858 G859 P862 L884 L885 A888	L840-L856 HydrophobicContact CD1-CD2 4.43Å; L840-L856 HydrophobicContact CD1-CG 4.18Å; L840-L856 HydrophobicContact CD2-CD2 3.8Å; L840-L856 HydrophobicContact CD2-CG 4.43Å; C852-L856 WeakPolarHBondContact O-CB 3.3Å; C852-L856 WeakPolarHBondContact O-CD1 3.36Å; C852-L856 WeakPolarHBondContact O-CG 3.43Å; C852-L856 PolarHBondContact O-N 3.35Å; L856-H858 PolarHBondContact O-N 3.48Å; L856-G859 PolarHBondContact O-N 2.88Å; L856-P862 HydrophobicContact CD2-CB 4.14Å; L856-P862 HydrophobicContact CD2-CG 4.18Å; L856-L884 HydrophobicContact CD1-CD1 4.41Å; L856-L884 HydrophobicContact CD1-CD2 4.15Å; L856-L884 HydrophobicContact CD1-CG 3.88Å; L856-L885 HydrophobicContact CD1-CD2 4.18Å; L856-L885 HydrophobicContact CD2-CD2 4.44Å; L856-A888 HydrophobicContact CD1-CB 3.98Å; L856-A888 HydrophobicContact CD2-CB 3.94Å
857	A	89.6	Confident	89.9	Confident	82 Å²	82	51.9 Å²	51.9	68%	0.678	29%	0.291	S	S	*	.	H	α-helix	trans	-61.6	-26.4	176.4	0	0	0	0	0	113.2	A853 L854	A853-A857 VanDerWaalsContact O-CB 3.29Å; A853-A857 WeakPolarHBondContact O-CB 3.49Å; A853-A857 PolarHBondContact O-N 3.15Å; L854-A857 PolarHBondContact O-N 3.35Å
858	H	90.6	Very high	89.9	Confident	99 Å²	99	57.6 Å²	57.6	46%	0.458	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	24	175.4	-69.5	-72	0	0	0	113.8	I823 L854 L855 L856	I823-H858 HydrophobicContact CD1-CB 4.13Å; I823-H858 HydrophobicContact CG2-CB 4.11Å; L854-H858 PolarHBondContact O-CD2 3.27Å; L854-H858 VanDerWaalsContact O-CD2 3.23Å; L854-H858 PolarHBondContact O-N 3.47Å; L855-H858 CarbonylContact O-C 3.45Å; L855-H858 PolarHBondContact O-N 2.92Å; L856-H858 PolarHBondContact O-N 3.48Å
859	G	86	Confident	89.9	Confident	48 Å²	48	55.2 Å²	55.2	50%	0.495	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	22	167.1	0	0	0	0	0	115.8	N830 L855 L856	N830-G859 PolarHBondContact ND2-O 3.48Å; L855-G859 PolarHBondContact O-N 3.5Å; L856-G859 PolarHBondContact O-N 2.88Å
860	A	93.4	Very high	90.1	Very high	8 Å²	8	55.9 Å²	55.9	7%	0.066	31%	0.313	C	S	.	.			trans	-63.9	132.8	167.4	0	0	0	0	0	110.9	V829 N830 L840 L855 P862	V829-A860 HydrophobicContact CG1-CB 3.66Å; N830-A860 VanDerWaalsContact OD1-CA 3.28Å; N830-A860 WeakPolarHBondContact OD1-CA 3.48Å; L840-A860 HydrophobicContact CB-CB 4.15Å; L840-A860 HydrophobicContact CD2-CB 3.89Å; L840-A860 HydrophobicContact CG-CB 4.43Å; L855-A860 VanDerWaalsContact C-CB 3.43Å; L855-A860 HydrophobicContact CB-CB 3.86Å; L855-A860 WeakPolarHBondContact O-CB 3.25Å; L855-A860 PolarHBondContact O-N 2.94Å; A860-P862 WeakPolarHBondContact O-CD 3.48Å
861	D	90.7	Very high	90.5	Very high	59 Å²	59	49.6 Å²	49.6	32%	0.316	28%	0.284	S	S	.	.			trans	-90.5	111.9	179.7	179	-2	0	0	0	110.5	N830 T863 M864	N830-D861 PolarHBondContact OD1-N 3.05Å; D861-T863 PolarHBondContact O-N 3.39Å; D861-T863 WeakPolarHBondContact OD1-CA 3.25Å; D861-T863 VanDerWaalsContact OD1-CB 3.32Å; D861-T863 WeakPolarHBondContact OD1-CB 3.5Å; D861-T863 PolarHBondContact OD1-N 3.12Å; D861-T863 PolarHBondContact OD1-OG1 3.16Å; D861-T863 PolarHBondContact OD2-OG1 3.49Å; D861-M864 HydrophobicContact CB-CG 3.85Å; D861-M864 HydrophobicContact CB-SD 4.11Å
862	P	90.5	Very high	90.5	Very high	11 Å²	11	49.6 Å²	49.6	7%	0.071	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-10	179.5	31.8	-35.6	0	0	0	113.5	L840 L856 A860 L885 A888 M889	L840-P862 HydrophobicContact CD2-CB 4.18Å; L856-P862 HydrophobicContact CD2-CB 4.14Å; L856-P862 HydrophobicContact CD2-CG 4.18Å; A860-P862 WeakPolarHBondContact O-CD 3.48Å; P862-L885 HydrophobicContact CB-CD2 4Å; P862-A888 HydrophobicContact CG-CB 4.2Å; P862-A888 WeakPolarHBondContact CG-O 3.44Å; P862-M889 HydrophobicContact CB-CG 3.77Å; P862-M889 HydrophobicContact CG-CG 3.8Å
863	T	90.4	Very high	90.6	Very high	47 Å²	47	49.6 Å²	49.6	29%	0.288	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-12.6	-178.9	76.1	0	0	0	0	113.8	D861 P890 A893	D861-T863 PolarHBondContact O-N 3.39Å; D861-T863 WeakPolarHBondContact OD1-CA 3.25Å; D861-T863 VanDerWaalsContact OD1-CB 3.32Å; D861-T863 WeakPolarHBondContact OD1-CB 3.5Å; D861-T863 PolarHBondContact OD1-N 3.12Å; D861-T863 PolarHBondContact OD1-OG1 3.16Å; D861-T863 PolarHBondContact OD2-OG1 3.49Å; T863-P890 HydrophobicContact CG2-CG 4.03Å; T863-A893 HydrophobicContact CG2-CB 4.11Å
864	M	91.4	Very high	90.7	Very high	51 Å²	51	51.4 Å²	51.4	25%	0.251	29%	0.288	S	S	.	.			trans	-56.6	147	173.2	-75.1	-176.2	74.2	0	0	111	N830 T832 T838 H841 D861	N830-M864 HydrophobicContact CB-SD 3.81Å; T832-M864 HydrophobicContact CG2-CE 3.74Å; T838-M864 HydrophobicContact CG2-CE 3.67Å; T838-M864 HydrophobicContact CG2-SD 3.9Å; H841-M864 PolarHBondContact CE1-O 3.01Å; H841-M864 VanDerWaalsContact CE1-O 3.28Å; H841-M864 PolarHBondContact NE2-O 3.41Å; D861-M864 HydrophobicContact CB-CG 3.85Å; D861-M864 HydrophobicContact CB-SD 4.11Å
865	K	92.2	Very high	90.6	Very high	130 Å²	130	51 Å²	51	57%	0.565	29%	0.286	S	S	*	.			trans	-121.7	138.4	-177.3	-68.6	179.9	172.3	-148.5	0	111.6	G869 Q870 T871	K865-G869 VanDerWaalsContact CD-O 3.32Å; K865-G869 WeakPolarHBondContact CD-O 3.04Å; K865-G869 PolarHBondContact NZ-O 2.91Å; K865-Q870 VanDerWaalsContact CA-O 3.26Å; K865-Q870 WeakPolarHBondContact CA-O 3.46Å; K865-T871 HydrophobicContact CG-CG2 3.89Å
866	N	92.3	Very high	90.5	Very high	8 Å²	8	51.4 Å²	51.4	4%	0.043	29%	0.289	C	S	.	.			trans	-71	178.7	168.9	73.7	5.5	0	0	0	111.7	F837 E868 G869 Q870	F837-N866 HydrophobicContact CD2-CB 3.75Å; F837-N866 HydrophobicContact CE2-CB 3.74Å; F837-N866 WeakPolarHBondContact CE2-ND2 3.28Å; F837-N866 HydrophobicContact CG-CB 4.47Å; F837-N866 HydrophobicContact CZ-CB 4.46Å; F837-N866 VanDerWaalsContact CZ-ND2 3.29Å; F837-N866 WeakPolarHBondContact CZ-ND2 3.46Å; N866-E868 PolarHBondContact O-N 2.77Å; N866-E868 WeakPolarHBondContact OD1-CA 3.36Å; N866-E868 WeakPolarHBondContact OD1-CB 3.46Å; N866-E868 PolarHBondContact OD1-N 3.43Å; N866-G869 PolarHBondContact O-N 2.67Å; N866-G869 PolarHBondContact OD1-N 3.39Å; N866-G869 VanDerWaalsContact OD1-N 3.12Å; N866-Q870 PolarHBondContact N-O 2.87Å; N866-Q870 PolarHBondContact ND2-OE1 3.1Å; N866-Q870 WeakPolarHBondContact OD1-CB 3.36Å; N866-Q870 PolarHBondContact OD1-N 2.89Å; N866-Q870 PolarHBondContact OD1-O 3.41Å
867	Q	91	Very high	90	Very high	144 Å²	144	54.7 Å²	54.7	67%	0.673	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.8	179.3	-171.2	176.1	12	0	0	113.7	W835 G869	W835-Q867 WeakPolarHBondContact O-CB 3.36Å; W835-Q867 PolarHBondContact O-N 3.22Å; Q867-G869 VanDerWaalsContact C-N 3.31Å
868	E	89.7	Confident	89.5	Confident	149 Å²	149	52.1 Å²	52.1	70%	0.696	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.6	175.1	-57.6	-171.6	176.7	0	0	112.9	N866 Q870	N866-E868 PolarHBondContact O-N 2.77Å; N866-E868 WeakPolarHBondContact OD1-CA 3.36Å; N866-E868 WeakPolarHBondContact OD1-CB 3.46Å; N866-E868 PolarHBondContact OD1-N 3.43Å; E868-Q870 VanDerWaalsContact C-N 3.34Å; E868-Q870 HydrophobicContact CB-CG 4.26Å; E868-Q870 PolarHBondContact OE2-NE2 2.85Å; E868-Q870 PolarHBondContact OE2-OE1 3.5Å
869	G	88.9	Confident	88.9	Confident	36 Å²	36	54 Å²	54	37%	0.371	30%	0.302	S	S	.	.	S	Bend	trans	81.3	9.4	-179.7	0	0	0	0	0	114.9	K865 N866 Q867	K865-G869 VanDerWaalsContact CD-O 3.32Å; K865-G869 WeakPolarHBondContact CD-O 3.04Å; K865-G869 PolarHBondContact NZ-O 2.91Å; N866-G869 PolarHBondContact O-N 2.67Å; N866-G869 PolarHBondContact OD1-N 3.39Å; N866-G869 VanDerWaalsContact OD1-N 3.12Å; Q867-G869 VanDerWaalsContact C-N 3.31Å
870	Q	92.4	Very high	88.5	Confident	56 Å²	56	55.6 Å²	55.6	26%	0.262	30%	0.3	S	S	.	.			trans	-86.8	141.7	179.8	-61	155.2	-11.1	0	0	110.7	H841 K865 N866 E868 D874 L875	H841-Q870 PolarHBondContact NE2-O 2.94Å; K865-Q870 VanDerWaalsContact CA-O 3.26Å; K865-Q870 WeakPolarHBondContact CA-O 3.46Å; N866-Q870 PolarHBondContact N-O 2.87Å; N866-Q870 PolarHBondContact ND2-OE1 3.1Å; N866-Q870 WeakPolarHBondContact OD1-CB 3.36Å; N866-Q870 PolarHBondContact OD1-N 2.89Å; N866-Q870 PolarHBondContact OD1-O 3.41Å; E868-Q870 VanDerWaalsContact C-N 3.34Å; E868-Q870 HydrophobicContact CB-CG 4.26Å; E868-Q870 PolarHBondContact OE2-NE2 2.85Å; E868-Q870 PolarHBondContact OE2-OE1 3.5Å; Q870-D874 HydrophobicContact CB-CB 4.1Å; Q870-L875 HydrophobicContact CB-CG 4.48Å
871	T	93.4	Very high	87.9	Confident	8 Å²	8	55.2 Å²	55.2	5%	0.049	30%	0.297	C	S	.	.			trans	-89.7	171	169.6	64.4	0	0	0	0	111.5	K865 L873 D874 L875 M889	K865-T871 HydrophobicContact CG-CG2 3.89Å; T871-L873 PolarHBondContact O-N 3.47Å; T871-L873 PolarHBondContact OG1-N 3.14Å; T871-D874 WeakPolarHBondContact CB-OD2 3.36Å; T871-D874 PolarHBondContact N-OD2 3.04Å; T871-D874 PolarHBondContact O-N 3.31Å; T871-D874 VanDerWaalsContact O-N 3.12Å; T871-D874 PolarHBondContact OG1-N 2.87Å; T871-D874 PolarHBondContact OG1-OD2 3.29Å; T871-L875 PolarHBondContact O-N 2.87Å; T871-M889 HydrophobicContact CG2-CE 4.45Å
872	A	90.2	Very high	87.4	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-31.3	171.3	0	0	0	0	0	112.7	L840 H841 A844 L875 A876 L885	L840-A872 HydrophobicContact CD2-CB 4.25Å; L840-A872 HydrophobicContact CG-CB 3.98Å; H841-A872 PolarHBondContact CD2-N 2.95Å; H841-A872 PolarHBondContact NE2-N 3.48Å; A844-A872 HydrophobicContact CB-CB 4.11Å; A844-A872 WeakPolarHBondContact CB-O 3.28Å; A872-L875 PolarHBondContact O-N 3.5Å; A872-A876 PolarHBondContact O-N 3.34Å; A872-A876 VanDerWaalsContact O-N 3.07Å; A872-L885 HydrophobicContact CB-CD1 4.13Å; A872-L885 HydrophobicContact CB-CD2 4.27Å
873	L	89.9	Confident	87	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.5	-33.4	177	176.8	61.3	0	0	0	112.6	T871 L875 A876 R882 L885 M886 M889 L894	T871-L873 PolarHBondContact O-N 3.47Å; T871-L873 PolarHBondContact OG1-N 3.14Å; L873-L875 VanDerWaalsContact C-N 3.28Å; L873-L875 PolarHBondContact O-N 3.26Å; L873-A876 PolarHBondContact O-N 3.21Å; L873-R882 HydrophobicContact CD1-CB 4.15Å; L873-R882 HydrophobicContact CD1-CG 4.42Å; L873-R882 PolarHBondContact O-NH1 3.36Å; L873-L885 HydrophobicContact CB-CB 4.19Å; L873-L885 HydrophobicContact CB-CD1 4.38Å; L873-L885 HydrophobicContact CD1-CB 4.02Å; L873-M886 HydrophobicContact CD1-CE 4.07Å; L873-M886 HydrophobicContact CD1-CG 3.96Å; L873-M886 HydrophobicContact CD2-CE 4.37Å; L873-M886 HydrophobicContact CD2-CG 3.78Å; L873-M889 HydrophobicContact CB-SD 3.83Å; L873-M889 HydrophobicContact CD2-SD 3.57Å; L873-M889 VanDerWaalsContact CD2-SD 3.57Å; L873-M889 HydrophobicContact CG-SD 4.33Å; L873-L894 HydrophobicContact CD2-CD2 4.17Å
874	D	89.6	Confident	86.6	Confident	80 Å²	80	57.6 Å²	57.6	43%	0.428	31%	0.308	S	S	.	.	H	α-helix	trans	-69.5	-30.4	176.6	-59.4	-55	0	0	0	111.3	Q870 T871	Q870-D874 HydrophobicContact CB-CB 4.1Å; T871-D874 WeakPolarHBondContact CB-OD2 3.36Å; T871-D874 PolarHBondContact N-OD2 3.04Å; T871-D874 PolarHBondContact O-N 3.31Å; T871-D874 VanDerWaalsContact O-N 3.12Å; T871-D874 PolarHBondContact OG1-N 2.87Å; T871-D874 PolarHBondContact OG1-OD2 3.29Å
875	L	88.8	Confident	86.2	Confident	25 Å²	25	55.1 Å²	55.1	13%	0.131	30%	0.296	C	S	.	.	H	α-helix	trans	-88	-13.1	177.1	-64.2	-177.4	0	0	0	114.7	F837 H841 Q845 Q870 T871 A872 L873 T877	F837-L875 HydrophobicContact CD1-CD1 4.27Å; F837-L875 HydrophobicContact CE1-CD1 3.45Å; F837-L875 VanDerWaalsContact CE1-CD1 3.45Å; F837-L875 HydrophobicContact CZ-CD1 3.9Å; H841-L875 HydrophobicContact CB-CD1 4.17Å; Q845-L875 WeakPolarHBondContact CA-O 3.28Å; Q845-L875 HydrophobicContact CB-CB 4.22Å; Q845-L875 HydrophobicContact CG-CB 4.48Å; Q870-L875 HydrophobicContact CB-CG 4.48Å; T871-L875 PolarHBondContact O-N 2.87Å; A872-L875 PolarHBondContact O-N 3.5Å; L873-L875 VanDerWaalsContact C-N 3.28Å; L873-L875 PolarHBondContact O-N 3.26Å; L875-T877 PolarHBondContact O-N 2.82Å
876	A	88.9	Confident	85.7	Confident	8 Å²	8	51 Å²	51	7%	0.066	28%	0.28	C	S	.	.			trans	-65	117.7	-172.5	0	0	0	0	0	112.7	A844 A872 L873 I881 R882 L885	A844-A876 HydrophobicContact CB-CB 4.35Å; A872-A876 PolarHBondContact O-N 3.34Å; A872-A876 VanDerWaalsContact O-N 3.07Å; L873-A876 PolarHBondContact O-N 3.21Å; A876-I881 HydrophobicContact CB-CB 4.47Å; A876-I881 HydrophobicContact CB-CG2 3.87Å; A876-R882 HydrophobicContact CB-CG 3.78Å; A876-R882 PolarHBondContact O-NH1 3.18Å; A876-L885 HydrophobicContact CB-CD1 3.97Å
877	T	79.3	Confident	85	Confident	99 Å²	99	57.5 Å²	57.5	61%	0.607	31%	0.314	S	S	*	.			trans	-92.2	-8.1	-173.7	50.1	0	0	0	0	115.2	A844 Q845 L875	A844-T877 PolarHBondContact O-N 3.3Å; Q845-T877 VanDerWaalsContact O-CG2 3.31Å; Q845-T877 WeakPolarHBondContact O-CG2 3.25Å; Q845-T877 PolarHBondContact O-OG1 2.93Å; L875-T877 PolarHBondContact O-N 2.82Å
878	A	79.9	Confident	84.4	Confident	29 Å²	29	52.7 Å²	52.7	24%	0.24	30%	0.299	C	S	.	.	S	Bend	trans	-127.8	136.9	-177.6	0	0	0	0	0	111.3	D880 I881 R882	A878-D880 VanDerWaalsContact C-N 3.31Å; A878-D880 WeakPolarHBondContact CB-OD1 3.21Å; A878-D880 PolarHBondContact O-N 3.42Å; A878-I881 HydrophobicContact CB-CD1 4.14Å; A878-I881 HydrophobicContact CB-CG1 4.26Å; A878-I881 WeakPolarHBondContact O-CB 3.49Å; A878-I881 PolarHBondContact O-N 2.81Å; A878-I881 VanDerWaalsContact O-N 3.08Å; A878-R882 WeakPolarHBondContact O-CG 3.5Å; A878-R882 PolarHBondContact O-N 3.48Å
879	D	77.1	Confident	84	Confident	137 Å²	137	46.3 Å²	46.3	73%	0.733	27%	0.27	S	S	*	.	H	α-helix	trans	-65.4	-30.3	-170.3	-66.9	-41.5	0	0	0	114	R882 A883	D879-R882 PolarHBondContact O-N 3.15Å; D879-A883 WeakPolarHBondContact O-CB 3.47Å; D879-A883 PolarHBondContact O-N 3.41Å
880	D	78.3	Confident	83.4	Confident	83 Å²	83	47.7 Å²	47.7	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-65.8	-38.9	172.8	61.4	-26.1	0	0	0	112	T849 A878 L884	T849-D880 VanDerWaalsContact CB-OD2 3.31Å; T849-D880 WeakPolarHBondContact CB-OD2 3.22Å; T849-D880 HydrophobicContact CG2-CB 4.2Å; T849-D880 WeakPolarHBondContact CG2-OD2 3.46Å; T849-D880 PolarHBondContact OG1-OD2 3.18Å; A878-D880 VanDerWaalsContact C-N 3.31Å; A878-D880 WeakPolarHBondContact CB-OD1 3.21Å; A878-D880 PolarHBondContact O-N 3.42Å; D880-L884 VanDerWaalsContact O-CB 3.29Å; D880-L884 WeakPolarHBondContact O-CB 3.3Å; D880-L884 PolarHBondContact O-N 2.95Å
881	I	81.3	Confident	82.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.8	-38.6	172.5	-60.4	178.8	0	0	0	110.9	A844 G847 T849 A876 A878 L884 L885	A844-I881 HydrophobicContact CB-CG2 4.03Å; G847-I881 VanDerWaalsContact CA-CD1 3.46Å; T849-I881 HydrophobicContact CG2-CG1 3.95Å; T849-I881 WeakPolarHBondContact OG1-CG1 3.48Å; A876-I881 HydrophobicContact CB-CB 4.47Å; A876-I881 HydrophobicContact CB-CG2 3.87Å; A878-I881 HydrophobicContact CB-CD1 4.14Å; A878-I881 HydrophobicContact CB-CG1 4.26Å; A878-I881 WeakPolarHBondContact O-CB 3.49Å; A878-I881 PolarHBondContact O-N 2.81Å; A878-I881 VanDerWaalsContact O-N 3.08Å; I881-L884 PolarHBondContact O-N 2.89Å; I881-L885 HydrophobicContact CG2-CD1 3.66Å; I881-L885 HydrophobicContact CG2-CG 4.22Å; I881-L885 WeakPolarHBondContact O-CB 3.48Å; I881-L885 WeakPolarHBondContact O-CG 3.23Å; I881-L885 PolarHBondContact O-N 3.34Å
882	R	80.3	Confident	80.7	Confident	67 Å²	67	56.3 Å²	56.3	25%	0.253	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-46.4	175.1	-63.9	-173.7	72.5	66.9	12.5	110.7	L873 A876 A878 D879 L885 M886	L873-R882 HydrophobicContact CD1-CB 4.15Å; L873-R882 HydrophobicContact CD1-CG 4.42Å; L873-R882 PolarHBondContact O-NH1 3.36Å; A876-R882 HydrophobicContact CB-CG 3.78Å; A876-R882 PolarHBondContact O-NH1 3.18Å; A878-R882 WeakPolarHBondContact O-CG 3.5Å; A878-R882 PolarHBondContact O-N 3.48Å; D879-R882 PolarHBondContact O-N 3.15Å; R882-L885 PolarHBondContact O-N 3.23Å; R882-M886 WeakPolarHBondContact O-CB 3.22Å; R882-M886 WeakPolarHBondContact O-CG 3.41Å; R882-M886 PolarHBondContact O-N 2.96Å
883	A	81.3	Confident	79.3	Confident	48 Å²	48	58.3 Å²	58.3	40%	0.397	34%	0.341	S	S	.	.	H	α-helix	trans	-60.6	-50.4	174.5	0	0	0	0	0	111.9	D879 L885 M886 D887	D879-A883 WeakPolarHBondContact O-CB 3.47Å; D879-A883 PolarHBondContact O-N 3.41Å; A883-L885 VanDerWaalsContact C-N 3.31Å; A883-L885 PolarHBondContact O-N 3.14Å; A883-M886 PolarHBondContact O-N 3.36Å; A883-M886 VanDerWaalsContact O-N 3.17Å; A883-D887 PolarHBondContact O-N 2.9Å
884	L	81.6	Confident	78.1	Confident	51 Å²	51	60 Å²	60	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-57	-41.2	178.9	180	69.1	0	0	0	113.1	T849 C852 A853 L856 D880 I881 A888	T849-L884 HydrophobicContact CG2-CD2 4.44Å; C852-L884 HydrophobicContact CB-CD2 3.75Å; A853-L884 HydrophobicContact CB-CD2 3.99Å; L856-L884 HydrophobicContact CD1-CD1 4.41Å; L856-L884 HydrophobicContact CD1-CD2 4.15Å; L856-L884 HydrophobicContact CD1-CG 3.88Å; D880-L884 VanDerWaalsContact O-CB 3.29Å; D880-L884 WeakPolarHBondContact O-CB 3.3Å; D880-L884 PolarHBondContact O-N 2.95Å; I881-L884 PolarHBondContact O-N 2.89Å; L884-A888 WeakPolarHBondContact O-CB 3.44Å; L884-A888 PolarHBondContact O-N 3.13Å
885	L	83.9	Confident	76.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-75.2	-35.9	177.9	-71.9	169.1	0	0	0	112.2	L840 A844 L856 P862 A872 L873 A876 I881 R882 A883 A888 M889	L840-L885 HydrophobicContact CD1-CD2 4.25Å; L840-L885 HydrophobicContact CD2-CD2 4.1Å; L840-L885 HydrophobicContact CG-CD2 4.36Å; A844-L885 HydrophobicContact CB-CD1 3.92Å; L856-L885 HydrophobicContact CD1-CD2 4.18Å; L856-L885 HydrophobicContact CD2-CD2 4.44Å; P862-L885 HydrophobicContact CB-CD2 4Å; A872-L885 HydrophobicContact CB-CD1 4.13Å; A872-L885 HydrophobicContact CB-CD2 4.27Å; L873-L885 HydrophobicContact CB-CB 4.19Å; L873-L885 HydrophobicContact CB-CD1 4.38Å; L873-L885 HydrophobicContact CD1-CB 4.02Å; A876-L885 HydrophobicContact CB-CD1 3.97Å; I881-L885 HydrophobicContact CG2-CD1 3.66Å; I881-L885 HydrophobicContact CG2-CG 4.22Å; I881-L885 WeakPolarHBondContact O-CB 3.48Å; I881-L885 WeakPolarHBondContact O-CG 3.23Å; I881-L885 PolarHBondContact O-N 3.34Å; R882-L885 PolarHBondContact O-N 3.23Å; A883-L885 VanDerWaalsContact C-N 3.31Å; A883-L885 PolarHBondContact O-N 3.14Å; L885-A888 PolarHBondContact O-N 3.28Å; L885-M889 WeakPolarHBondContact O-CB 3.47Å; L885-M889 WeakPolarHBondContact O-CG 3.43Å; L885-M889 PolarHBondContact O-N 3.45Å
886	M	80.9	Confident	74.8	Confident	43 Å²	43	62.2 Å²	62.2	21%	0.212	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-42.8	173.2	-74.2	177.6	-169.3	0	0	111.7	L873 R882 A883 A888 M889 L894 F898	L873-M886 HydrophobicContact CD1-CE 4.07Å; L873-M886 HydrophobicContact CD1-CG 3.96Å; L873-M886 HydrophobicContact CD2-CE 4.37Å; L873-M886 HydrophobicContact CD2-CG 3.78Å; R882-M886 WeakPolarHBondContact O-CB 3.22Å; R882-M886 WeakPolarHBondContact O-CG 3.41Å; R882-M886 PolarHBondContact O-N 2.96Å; A883-M886 PolarHBondContact O-N 3.36Å; A883-M886 VanDerWaalsContact O-N 3.17Å; M886-A888 VanDerWaalsContact C-N 3.26Å; M886-A888 PolarHBondContact O-N 3.45Å; M886-M889 PolarHBondContact O-N 2.9Å; M886-L894 HydrophobicContact CB-CD2 4.22Å; M886-L894 HydrophobicContact CG-CD2 4.02Å; M886-F898 HydrophobicContact CE-CD1 4.34Å; M886-F898 HydrophobicContact CE-CD2 4.18Å; M886-F898 HydrophobicContact CE-CE1 4.02Å; M886-F898 HydrophobicContact CE-CE2 3.85Å; M886-F898 HydrophobicContact CE-CG 4.42Å; M886-F898 HydrophobicContact CE-CZ 3.77Å
887	D	78.5	Confident	72.8	Confident	145 Å²	145	66.5 Å²	66.5	78%	0.775	40%	0.402	S	S	*	.	H	α-helix	trans	-65.6	-28.2	176.3	-75.6	-8	0	0	0	112.5	A883	A883-D887 PolarHBondContact O-N 2.9Å
888	A	79	Confident	71.2	Confident	43 Å²	43	66.8 Å²	66.8	36%	0.355	40%	0.395	S	S	.	.	H	α-helix	trans	-88	-12.8	178.4	0	0	0	0	0	114.4	L856 P862 L884 L885 M886	L856-A888 HydrophobicContact CD1-CB 3.98Å; L856-A888 HydrophobicContact CD2-CB 3.94Å; P862-A888 HydrophobicContact CG-CB 4.2Å; P862-A888 WeakPolarHBondContact CG-O 3.44Å; L884-A888 WeakPolarHBondContact O-CB 3.44Å; L884-A888 PolarHBondContact O-N 3.13Å; L885-A888 PolarHBondContact O-N 3.28Å; M886-A888 VanDerWaalsContact C-N 3.26Å; M886-A888 PolarHBondContact O-N 3.45Å
889	M	81.6	Confident	69.4	Low	15 Å²	15	71 Å²	71	7%	0.074	41%	0.407	C	S	.	.	S	Bend	trans	-91.1	141.5	-179.2	-77.8	176.2	80.9	0	0	112.1	P862 T871 L873 L885 M886 A893 L894	P862-M889 HydrophobicContact CB-CG 3.77Å; P862-M889 HydrophobicContact CG-CG 3.8Å; T871-M889 HydrophobicContact CG2-CE 4.45Å; L873-M889 HydrophobicContact CB-SD 3.83Å; L873-M889 HydrophobicContact CD2-SD 3.57Å; L873-M889 VanDerWaalsContact CD2-SD 3.57Å; L873-M889 HydrophobicContact CG-SD 4.33Å; L885-M889 WeakPolarHBondContact O-CB 3.47Å; L885-M889 WeakPolarHBondContact O-CG 3.43Å; L885-M889 PolarHBondContact O-N 3.45Å; M886-M889 PolarHBondContact O-N 2.9Å; M889-A893 HydrophobicContact CE-CB 3.87Å; M889-A893 WeakPolarHBondContact CE-O 3.38Å; M889-L894 HydrophobicContact CB-CD2 4.08Å; M889-L894 HydrophobicContact SD-CD2 4.43Å
890	P	74.9	Confident	67.4	Low	64 Å²	64	70.4 Å²	70.4	42%	0.416	41%	0.411	S	S	.	.			trans	-65.4	147	172.8	26.8	-32.5	0	0	0	110.9	T863 D892 A893	T863-P890 HydrophobicContact CG2-CG 4.03Å; P890-D892 PolarHBondContact O-N 3.07Å; P890-A893 HydrophobicContact CG-CB 3.9Å; P890-A893 PolarHBondContact O-N 3.42Å
891	P	64.9	Low	65.4	Low	99 Å²	99	75.5 Å²	75.5	64%	0.643	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-56.2	-29.1	-172.6	-28.2	35.2	0	0	0	115.3	A893	P891-A893 VanDerWaalsContact C-N 3.32Å
892	D	63.9	Low	63.2	Low	146 Å²	146	79.9 Å²	79.9	78%	0.781	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-76	-17.9	179.6	-65.7	-45	0	0	0	113.9	P890	P890-D892 PolarHBondContact O-N 3.07Å
893	A	60.4	Low	60.9	Low	42 Å²	42	83.5 Å²	83.5	35%	0.347	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-91.9	-8.4	179.8	0	0	0	0	0	113.8	T863 M889 P890 P891	T863-A893 HydrophobicContact CG2-CB 4.11Å; M889-A893 HydrophobicContact CE-CB 3.87Å; M889-A893 WeakPolarHBondContact CE-O 3.38Å; P890-A893 HydrophobicContact CG-CB 3.9Å; P890-A893 PolarHBondContact O-N 3.42Å; P891-A893 VanDerWaalsContact C-N 3.32Å
894	L	64.9	Low	58.4	Low	37 Å²	37	86.6 Å²	86.6	19%	0.194	51%	0.512	C	S	.	.	S	Bend	trans	-74.5	144	179.6	-68.6	171.9	0	0	0	112.2	L873 M886 M889	L873-L894 HydrophobicContact CD2-CD2 4.17Å; M886-L894 HydrophobicContact CB-CD2 4.22Å; M886-L894 HydrophobicContact CG-CD2 4.02Å; M889-L894 HydrophobicContact CB-CD2 4.08Å; M889-L894 HydrophobicContact SD-CD2 4.43Å
895	P	58.5	Low	55.9	Low	43 Å²	43	91 Å²	91	28%	0.279	54%	0.54	S	S	.	.			trans	-56.1	145.7	175.2	-25.1	34.2	0	0	0	112.8	C897 F898	P895-C897 PolarHBondContact O-N 2.98Å; P895-F898 HydrophobicContact CB-CD2 4.31Å; P895-F898 PolarHBondContact O-N 3.06Å
896	S	51.7	Low	53.3	Low	107 Å²	107	95.6 Å²	95.6	75%	0.748	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-59.8	-21.2	-170.8	55.1	0	0	0	0	115.2	F898	S896-F898 VanDerWaalsContact C-N 3.3Å; S896-F898 PolarHBondContact O-N 3.19Å
897	C	46.4	Very low	50.8	Low	99 Å²	99	97.8 Å²	97.8	67%	0.669	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-73.6	-12.6	174.8	51.1	0	0	0	0	114.8	P895	P895-C897 PolarHBondContact O-N 2.98Å
898	F	46.3	Very low	48.5	Very low	105 Å²	105	95.9 Å²	95.9	46%	0.461	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-106.7	4.6	178.2	-66.8	-75.8	0	0	0	113.8	M886 P895 S896 P900	M886-F898 HydrophobicContact CE-CD1 4.34Å; M886-F898 HydrophobicContact CE-CD2 4.18Å; M886-F898 HydrophobicContact CE-CE1 4.02Å; M886-F898 HydrophobicContact CE-CE2 3.85Å; M886-F898 HydrophobicContact CE-CG 4.42Å; M886-F898 HydrophobicContact CE-CZ 3.77Å; P895-F898 HydrophobicContact CB-CD2 4.31Å; P895-F898 PolarHBondContact O-N 3.06Å; S896-F898 VanDerWaalsContact C-N 3.3Å; S896-F898 PolarHBondContact O-N 3.19Å; F898-P900 WeakPolarHBondContact O-CD 3.36Å
899	K	40.6	Very low	46.1	Very low	116 Å²	116	100.2 Å²	100.2	50%	0.504	62%	0.617	S	S	.	*	S	Bend	trans	-71.3	120.9	172.6	-65.8	-167.4	175.5	-163.3	0	109.4	Q901	K899-Q901 PolarHBondContact O-N 2.96Å; K899-Q901 VanDerWaalsContact O-N 3.14Å
900	P	36.8	Very low	43.6	Very low	125 Å²	125	107 Å²	107	81%	0.812	65%	0.652	S	S	*	*			trans	-63.3	118.9	175.4	25	-32.4	0	0	0	109.5	F898 A902	F898-P900 WeakPolarHBondContact O-CD 3.36Å; P900-A902 PolarHBondContact O-N 3.08Å
901	Q	35.1	Very low	41.2	Very low	191 Å²	191	109 Å²	109	89%	0.893	67%	0.668	S	S	*	*			trans	-70.8	96.2	172.1	-79.9	-172	-27.9	0	0	109.4	K899 T903	K899-Q901 PolarHBondContact O-N 2.96Å; K899-Q901 VanDerWaalsContact O-N 3.14Å; Q901-T903 PolarHBondContact O-N 3.44Å; Q901-T903 VanDerWaalsContact O-N 3.14Å
902	A	35.6	Very low	40.3	Very low	91 Å²	91	110.3 Å²	110.3	75%	0.752	68%	0.676	S	S	*	*			trans	-67.4	106.5	169.3	0	0	0	0	0	110	P900 V904	P900-A902 PolarHBondContact O-N 3.08Å; A902-V904 PolarHBondContact O-N 2.92Å
903	T	31.1	Very low	38.4	Very low	144 Å²	144	107.2 Å²	107.2	88%	0.883	67%	0.671	S	S	*	*			trans	-73	121.6	168.6	-4.2	0	0	0	0	109.6	Q901	Q901-T903 PolarHBondContact O-N 3.44Å; Q901-T903 VanDerWaalsContact O-N 3.14Å
904	V	30.4	Very low	36.7	Very low	112 Å²	112	110.5 Å²	110.5	68%	0.679	69%	0.691	S	S	*	*			trans	-93.1	126.2	-179.4	179	0	0	0	0	110.5	A902	A902-V904 PolarHBondContact O-N 2.92Å
905	V	29.4	Very low	34.9	Very low	144 Å²	144	115 Å²	115	87%	0.873	72%	0.721	S	S	*	*			trans	-135.1	88.8	140.5	-166.2	0	0	0	0	109.6
906	S	28.4	Very low	34	Very low	97 Å²	97	118.5 Å²	118.5	68%	0.678	74%	0.743	S	S	*	*			trans	6.9	132.7	151.7	-48.7	0	0	0	0	120.3
907	A	28.6	Very low	32.7	Very low	89 Å²	89	118.2 Å²	118.2	74%	0.736	74%	0.741	S	S	*	*				-165.9	129.5	96.5	0	0	0	0	0	115.7
908	S	29.8	Very low	31.7	Very low	104 Å²	104	118.7 Å²	118.7	73%	0.727	75%	0.745	S	S	*	*			trans	67.4	99.2	141.3	51.1	0	0	0	0	124.4
909	V	29.5	Very low	30.7	Very low	134 Å²	134	121 Å²	121	81%	0.812	76%	0.761	S	S	*	*				58.9	118.5	124	-144	0	0	0	0	120.8
910	I	28.8	Very low	30	Very low	157 Å²	157	120.7 Å²	120.7	81%	0.805	77%	0.773	S	S	*	*				178.4	129.4	100.2	-79.6	164.3	0	0	0	109.8
911	S	23.8	Very low	29.6	Very low	108 Å²	108	119.1 Å²	119.1	76%	0.755	77%	0.771	S	S	*	*			trans	-104.3	-176.2	168.8	-36.5	0	0	0	0	109.9
912	P	46.4	Very low	29.3	Very low	126 Å²	126	115.1 Å²	115.1	82%	0.818	77%	0.77	S	S	*	*			cis	-117.5	-163.4	-19.6	29.5	-5.5	0	0	0	109.4
913	A	24.3	Very low	28.8	Very low	81 Å²	81	116 Å²	116	67%	0.669	77%	0.771	S	S	*	*			cis	-173	160.1	35	0	0	0	0	0	114
914	S	24.7	Very low	28.5	Very low	110 Å²	110	114.8 Å²	114.8	77%	0.769	77%	0.769	S	S	*	*			trans	59.5	104.6	143.9	-53.6	0	0	0	0	121.8
915	T	27.5	Very low	28.3	Very low	133 Å²	133	116.9 Å²	116.9	82%	0.816	78%	0.775	S	S	*	*			trans	-28.9	170.1	137.6	51.2	0	0	0	0	116.9
916	P	40	Very low	28	Very low	115 Å²	115	117.2 Å²	117.2	75%	0.747	77%	0.771	S	S	*	*			cis	-138.7	-164	18	38.8	-17.1	0	0	0	116.1
917	S	23.6	Very low	27.9	Very low	102 Å²	102	119.5 Å²	119.5	71%	0.713	78%	0.776	S	S	*	*			trans	104.7	102.8	154.7	75.1	0	0	0	0	119.7
918	C	26.2	Very low	27.7	Very low	109 Å²	109	123.1 Å²	123.1	74%	0.736	78%	0.782	S	S	*	*			trans	41.9	154.5	132.5	68.4	0	0	0	0	124.7
919	L	23.4	Very low	27.6	Very low	152 Å²	152	123.1 Å²	123.1	80%	0.796	79%	0.788	S	S	*	*			trans	79.2	113.6	168.8	-52.3	173.2	0	0	0	113.6
920	S	27.1	Very low	27.5	Very low	110 Å²	110	120.1 Å²	120.1	77%	0.769	79%	0.785	S	S	*	*				84.4	150.7	61	-66.6	0	0	0	0	113.1
921	A	27.8	Very low	27.6	Very low	93 Å²	93	118.4 Å²	118.4	77%	0.769	78%	0.784	S	S	*	*			trans	74.8	121.6	-176.8	0	0	0	0	0	113.8
922	A	28	Very low	27.7	Very low	106 Å²	106	121.8 Å²	121.8	88%	0.876	79%	0.792	S	S	*	*			cis	53.4	96	25.4	0	0	0	0	0	113
923	S	25.6	Very low	26.6	Very low	110 Å²	110	121.5 Å²	121.5	77%	0.769	79%	0.788	S	S	*	*			trans	-134.1	148.7	168.4	58.4	0	0	0	0	110.2
924	S	25	Very low	26.5	Very low	118 Å²	118	126.3 Å²	126.3	83%	0.825	80%	0.797	S	S	*	*	S	Bend	trans	88.4	104.6	-158.3	-44.3	0	0	0	0	111.8
925	I	25.6	Very low	26.6	Very low	157 Å²	157	129 Å²	129	81%	0.805	80%	0.802	S	S	*	*			cis	-143.8	126.7	8.6	-58.9	178.2	0	0	0	110
926	D	24.1	Very low	26.4	Very low	151 Å²	151	127.1 Å²	127.1	81%	0.807	80%	0.8	S	S	*	*			trans	-79.8	134.2	159.3	-105.2	-44.6	0	0	0	110
927	N	26	Very low	25.6	Very low	145 Å²	145	125.7 Å²	125.7	78%	0.775	80%	0.798	S	S	*	*			trans	155.1	115.4	150.2	-83.3	-35.1	0	0	0	107.3
928	L	25.5	Very low	25.7	Very low	164 Å²	164	126.1 Å²	126.1	86%	0.859	80%	0.801	S	S	*	*			cis	-159.4	131.1	32.7	-159.7	76.3	0	0	0	109.5
929	A	27	Very low	25.6	Very low	104 Å²	104	125.3 Å²	125.3	86%	0.86	80%	0.802	S	S	*	*			trans	-127.3	141.4	169.6	0	0	0	0	0	110
930	G	26.6	Very low	25.7	Very low	72 Å²	72	122.9 Å²	122.9	74%	0.742	80%	0.804	S	S	*	*			trans	135.1	144	165.3	0	0	0	0	0	115.1
931	P	32.2	Very low	25.6	Very low	120 Å²	120	122.3 Å²	122.3	78%	0.779	81%	0.806	S	S	*	*			cis	-131.2	161.2	-38.4	35.8	-22.2	0	0	0	112.8
932	L	24.5	Very low	25.5	Very low	179 Å²	179	121.4 Å²	121.4	94%	0.937	81%	0.805	S	S	*	*			trans	-72.8	131.9	164.5	-87.1	161.8	0	0	0	110.1
933	T	23.6	Very low	25.4	Very low	120 Å²	120	120.8 Å²	120.8	74%	0.736	80%	0.8	S	S	*	*			trans	-138.8	143.8	158.9	-15.5	0	0	0	0	110.5
934	E	23.4	Very low	25.3	Very low	182 Å²	182	121.8 Å²	121.8	85%	0.85	81%	0.807	S	S	*	*			trans	77.8	133.6	162.8	-57.1	-160.6	131.7	0	0	121.2
935	L	25.6	Very low	25.3	Very low	168 Å²	168	119.3 Å²	119.3	88%	0.88	80%	0.8	S	S	*	*			trans	-51	145.4	161.3	-61.8	75.1	0	0	0	111.2
936	A	23.3	Very low	25.3	Very low	93 Å²	93	118.9 Å²	118.9	77%	0.769	80%	0.804	S	S	*	*				170.4	163.5	105.1	0	0	0	0	0	113.1
937	A	24.4	Very low	25.4	Very low	84 Å²	84	116.5 Å²	116.5	69%	0.694	81%	0.806	S	S	*	*			trans	58	93.4	143.6	0	0	0	0	0	119.3
938	S	24.4	Very low	25.3	Very low	111 Å²	111	117.7 Å²	117.7	78%	0.776	81%	0.812	S	S	*	*				37	127.7	111.2	67.6	0	0	0	0	120.5
939	A	25.1	Very low	25.4	Very low	92 Å²	92	113 Å²	113	76%	0.76	80%	0.804	S	S	*	*				119.9	142.3	120.3	0	0	0	0	0	117.3
940	A	25	Very low	25.3	Very low	102 Å²	102	112.8 Å²	112.8	84%	0.843	80%	0.802	S	S	*	*			trans	66.5	155.5	160.4	0	0	0	0	0	117.9
941	A	25.3	Very low	25.3	Very low	98 Å²	98	115.8 Å²	115.8	81%	0.81	81%	0.811	S	S	*	*			cis	-174.7	161.1	-29.2	0	0	0	0	0	107.4
942	G	24.9	Very low	24.9	Very low	73 Å²	73	112.7 Å²	112.7	75%	0.753	80%	0.801	S	S	*	*			trans	81.5	109.9	167	0	0	0	0	0	113.5
943	A	25.6	Very low	25	Very low	93 Å²	93	110.4 Å²	110.4	77%	0.769	80%	0.795	S	S	*	*			cis	82.3	130.2	49	0	0	0	0	0	114.4
944	S	25.2	Very low	25	Very low	132 Å²	132	112 Å²	112	92%	0.923	80%	0.799	S	S	*	*			trans	62.1	146.2	173.2	67.5	0	0	0	0	117.1
945	G	24.2	Very low	25.3	Very low	66 Å²	66	114.3 Å²	114.3	68%	0.68	80%	0.8	S	S	*	*			cis	165.2	158.2	-6	0	0	0	0	0	111.2
946	V	25.4	Very low	25.4	Very low	147 Å²	147	115 Å²	115	89%	0.891	80%	0.796	S	S	*	*			trans	54	115	163.4	-166	0	0	0	0	117.4
947	A	25.3	Very low	25.6	Very low	102 Å²	102	118.6 Å²	118.6	84%	0.843	80%	0.797	S	S	*	*			trans	-95.5	136.1	164.3	0	0	0	0	0	110.6
948	D	25.6	Very low	25.8	Very low	169 Å²	169	118.1 Å²	118.1	90%	0.904	80%	0.8	S	S	*	*			trans	-133.8	154.5	157.3	-152.8	-8.9	0	0	0	108.2
949	G	26.6	Very low	26	Very low	66 Å²	66	122.4 Å²	122.4	68%	0.68	81%	0.808	S	S	*	*			trans	-103.9	-168.1	-152.5	0	0	0	0	0	118.3
950	A	26	Very low	26.3	Very low	100 Å²	100	126.7 Å²	126.7	83%	0.826	82%	0.815	S	S	*	*			trans	100.6	114.2	157.8	0	0	0	0	0	120.4
951	S	25.2	Very low	26.7	Very low	134 Å²	134	128 Å²	128	94%	0.937	81%	0.812	S	S	*	*			trans	78.5	140	130.3	-154.6	0	0	0	0	121.9
952	G	24	Very low	27.7	Very low	55 Å²	55	130.5 Å²	130.5	57%	0.567	81%	0.809	S	S	*	*			trans	135.9	103.7	148.7	0	0	0	0	0	116.6
953	T	26.7	Very low	28.8	Very low	131 Å²	131	134.1 Å²	134.1	80%	0.804	81%	0.81	S	S	*	*			trans	44.4	144.9	131.2	54.6	0	0	0	0	120.7
954	D	24.8	Very low	30.1	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	82%	0.816	S	S	*	*			cis	-159.4	163.8	7.5	-121.3	-34.9	0	0	0	110.2
955	R	28.4	Very low	32.2	Very low	229 Å²	229	134.4 Å²	134.4	86%	0.864	79%	0.787	S	S	*	*			trans	-112.8	133.6	175.1	-85.1	-176.2	172.6	-177.9	-2.1	112.3
956	K	27.2	Very low	34.7	Very low	183 Å²	183	135.2 Å²	135.2	80%	0.796	78%	0.776	S	S	*	*			trans	-161.4	146	150.1	-91.2	-158.5	172.5	-171.6	0	109.2
957	E	29	Very low	37.2	Very low	169 Å²	169	129.4 Å²	129.4	79%	0.79	74%	0.739	S	S	*	*			cis	-168.4	149.5	-21.1	-143.5	166.3	-174.7	0	0	107.1
958	G	28.1	Very low	39.7	Very low	74 Å²	74	125.6 Å²	125.6	76%	0.763	71%	0.707	S	S	*	*			trans	126	95.7	162.2	0	0	0	0	0	117.5
959	E	29.1	Very low	42.2	Very low	200 Å²	200	121.9 Å²	121.9	94%	0.935	68%	0.684	S	S	*	*			trans	-156.9	159.9	142.2	-125.5	174.7	-176.3	0	0	111
960	M	30.3	Very low	45	Very low	183 Å²	183	118.9 Å²	118.9	90%	0.901	65%	0.652	S	S	*	*			trans	-67.9	149.6	-163.1	-83.3	141.1	48.5	0	0	116.2
961	T	33.7	Very low	47.6	Very low	128 Å²	128	114.1 Å²	114.1	79%	0.785	61%	0.613	S	S	*	*			trans	-77.7	118.1	179.2	47.8	0	0	0	0	113.6	L963	T961-L963 PolarHBondContact O-N 3.34Å
962	M	47.3	Very low	50.3	Low	151 Å²	151	113.5 Å²	113.5	74%	0.744	59%	0.593	S	S	*	*			trans	-81.7	77.7	170.5	-92.1	-84.4	-147.8	0	0	111.5
963	L	47.4	Very low	53	Low	150 Å²	150	114.6 Å²	114.6	79%	0.785	59%	0.593	S	S	*	*			trans	-135.5	4.3	-177.4	-84.9	173	0	0	0	117.1	T961	T961-L963 PolarHBondContact O-N 3.34Å
964	D	51.8	Low	55.5	Low	167 Å²	167	110.4 Å²	110.4	89%	0.893	57%	0.565	S	S	*	*			trans	-142.6	60.9	175.7	-97.5	-39.8	0	0	0	111.4
965	M	70.2	Confident	58	Low	63 Å²	63	105.7 Å²	105.7	31%	0.31	55%	0.553	S	S	.	*			trans	-98.1	123.5	173.4	-157.7	175	-160.2	0	0	109.6	Q969 L990 L1022	M965-Q969 HydrophobicContact CE-CB 4.2Å; M965-Q969 HydrophobicContact CG-CB 3.99Å; M965-L990 WeakPolarHBondContact O-CD1 3.44Å; M965-L1022 HydrophobicContact SD-CD1 3.9Å
966	N	76.4	Confident	60.8	Low	83 Å²	83	95 Å²	95	44%	0.444	51%	0.513	S	S	.	.			trans	-94.4	163.3	178.2	69.6	38.4	0	0	0	112.7	S968 Q969 F970	N966-S968 PolarHBondContact O-N 2.91Å; N966-S968 VanDerWaalsContact O-N 3.14Å; N966-S968 PolarHBondContact OD1-N 3Å; N966-Q969 VanDerWaalsContact N-OE1 3.15Å; N966-Q969 WeakPolarHBondContact O-CB 3.43Å; N966-Q969 PolarHBondContact O-N 3.41Å; N966-Q969 WeakPolarHBondContact OD1-CG 3.17Å; N966-Q969 PolarHBondContact OD1-N 3.21Å; N966-F970 PolarHBondContact O-N 2.76Å
967	I	78.7	Confident	63.5	Low	25 Å²	25	89.7 Å²	89.7	13%	0.128	49%	0.491	C	S	.	.	H	α-helix	trans	-54.6	-37.3	-176	-168.2	67.4	0	0	0	112.5	Q969 F970 L971 F983 L990 L993	I967-Q969 PolarHBondContact O-N 2.73Å; I967-F970 HydrophobicContact CD1-CD1 4.22Å; I967-F970 PolarHBondContact O-N 2.9Å; I967-L971 HydrophobicContact CG1-CD1 4.39Å; I967-L971 HydrophobicContact CG1-CG 4.49Å; I967-L971 WeakPolarHBondContact O-CG 3.27Å; I967-L971 PolarHBondContact O-N 2.77Å; I967-F983 HydrophobicContact CD1-CD1 3.79Å; I967-F983 HydrophobicContact CD1-CE1 4Å; I967-F983 HydrophobicContact CG1-CB 4.28Å; I967-F983 HydrophobicContact CG1-CD1 3.73Å; I967-F983 HydrophobicContact CG1-CE1 4.43Å; I967-F983 HydrophobicContact CG1-CG 4.2Å; I967-L990 HydrophobicContact CB-CG 4.29Å; I967-L990 HydrophobicContact CD1-CD2 3.64Å; I967-L990 HydrophobicContact CD1-CG 3.83Å; I967-L993 HydrophobicContact CD1-CD2 3.89Å
968	S	77.7	Confident	65.9	Low	23 Å²	23	87.1 Å²	87.1	16%	0.161	48%	0.479	C	S	.	.	H	α-helix	trans	-71.2	-28.4	179.7	-74.8	0	0	0	0	114	N966 R980 E984	N966-S968 PolarHBondContact O-N 2.91Å; N966-S968 VanDerWaalsContact O-N 3.14Å; N966-S968 PolarHBondContact OD1-N 3Å; S968-R980 PolarHBondContact O-NH2 3.1Å; S968-R980 VanDerWaalsContact O-NH2 3.09Å; S968-R980 WeakPolarHBondContact OG-CD 3.28Å; S968-R980 WeakPolarHBondContact OG-CG 3.43Å; S968-R980 PolarHBondContact OG-NE 2.72Å; S968-R980 VanDerWaalsContact OG-NE 3.16Å; S968-E984 PolarHBondContact OG-OE1 2.8Å
969	Q	77.8	Confident	68.5	Low	90 Å²	90	84.1 Å²	84.1	42%	0.421	45%	0.445	S	S	.	.	H	α-helix	trans	-78.7	-36	169.8	-70.1	166.3	-11.6	0	0	112	M965 N966 I967 K972 S973	M965-Q969 HydrophobicContact CE-CB 4.2Å; M965-Q969 HydrophobicContact CG-CB 3.99Å; N966-Q969 VanDerWaalsContact N-OE1 3.15Å; N966-Q969 WeakPolarHBondContact O-CB 3.43Å; N966-Q969 PolarHBondContact O-N 3.41Å; N966-Q969 WeakPolarHBondContact OD1-CG 3.17Å; N966-Q969 PolarHBondContact OD1-N 3.21Å; I967-Q969 PolarHBondContact O-N 2.73Å; Q969-K972 WeakPolarHBondContact O-CB 3.48Å; Q969-K972 PolarHBondContact O-N 3.17Å; Q969-S973 PolarHBondContact O-N 3.3Å
970	F	84.4	Confident	71.1	Confident	3 Å²	3	77.7 Å²	77.7	1%	0.013	41%	0.413	C	S	.	.	H	α-helix	trans	-66.9	-46.7	176.2	172	-100	0	0	0	112.4	N966 I967 K972 S973 L974 L990 L993 L1015 G1018 V1019 L1022	N966-F970 PolarHBondContact O-N 2.76Å; I967-F970 HydrophobicContact CD1-CD1 4.22Å; I967-F970 PolarHBondContact O-N 2.9Å; F970-K972 PolarHBondContact O-N 2.77Å; F970-S973 PolarHBondContact O-N 3.45Å; F970-S973 VanDerWaalsContact O-N 3.09Å; F970-S973 PolarHBondContact O-OG 3.02Å; F970-L974 HydrophobicContact CD1-CD1 4.33Å; F970-L974 HydrophobicContact CE1-CD1 3.63Å; F970-L974 HydrophobicContact CE2-CD1 4.09Å; F970-L974 HydrophobicContact CZ-CD1 3.5Å; F970-L974 HydrophobicContact CZ-CG 4.39Å; F970-L974 PolarHBondContact O-N 3.21Å; F970-L990 HydrophobicContact CB-CD1 4.24Å; F970-L990 HydrophobicContact CB-CD2 3.8Å; F970-L990 HydrophobicContact CD1-CD2 3.57Å; F970-L990 HydrophobicContact CD2-CD2 4.07Å; F970-L990 HydrophobicContact CE1-CD2 4.1Å; F970-L990 HydrophobicContact CG-CD2 3.53Å; F970-L993 HydrophobicContact CD1-CD2 4.19Å; F970-L993 HydrophobicContact CE1-CD2 3.6Å; F970-L993 HydrophobicContact CZ-CD2 4.44Å; F970-L1015 HydrophobicContact CE1-CD2 4.31Å; F970-G1018 VanDerWaalsContact CE2-C 3.48Å; F970-V1019 HydrophobicContact CE2-CB 4.41Å; F970-V1019 HydrophobicContact CE2-CG2 4.47Å; F970-V1019 HydrophobicContact CZ-CB 3.85Å; F970-V1019 HydrophobicContact CZ-CG2 4.12Å; F970-L1022 HydrophobicContact CD2-CD2 3.88Å; F970-L1022 HydrophobicContact CE2-CB 4.4Å; F970-L1022 HydrophobicContact CE2-CD2 4.26Å
971	L	82.5	Confident	73.2	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-58	-33.7	173.1	-69.6	175.4	0	0	0	111.7	I967 L974 G975 L976 R980 F983 L1015	I967-L971 HydrophobicContact CG1-CD1 4.39Å; I967-L971 HydrophobicContact CG1-CG 4.49Å; I967-L971 WeakPolarHBondContact O-CG 3.27Å; I967-L971 PolarHBondContact O-N 2.77Å; L971-L974 PolarHBondContact O-N 3.04Å; L971-G975 PolarHBondContact O-N 3.02Å; L971-L976 HydrophobicContact CD2-CB 4.4Å; L971-L976 CarbonylContact O-C 3.54Å; L971-L976 WeakPolarHBondContact O-CA 3.23Å; L971-L976 PolarHBondContact O-N 3.32Å; L971-R980 HydrophobicContact CD1-CB 4.32Å; L971-F983 HydrophobicContact CD1-CB 4.33Å; L971-F983 HydrophobicContact CD1-CD2 3.93Å; L971-F983 HydrophobicContact CD1-CE2 4.49Å; L971-F983 HydrophobicContact CD1-CG 4.13Å; L971-F983 HydrophobicContact CD2-CD2 4.33Å; L971-F983 HydrophobicContact CD2-CE2 4.08Å; L971-F983 HydrophobicContact CD2-CZ 4.46Å; L971-L1015 HydrophobicContact CD2-CD2 3.34Å
972	K	80.9	Confident	75.5	Confident	121 Å²	121	70.3 Å²	70.3	53%	0.526	37%	0.372	S	S	.	.	H	α-helix	trans	-67.8	-41.7	174.4	-178.6	167.7	-164.3	108	0	113.1	Q969 F970 L974 G975 E977	Q969-K972 WeakPolarHBondContact O-CB 3.48Å; Q969-K972 PolarHBondContact O-N 3.17Å; F970-K972 PolarHBondContact O-N 2.77Å; K972-L974 PolarHBondContact O-N 2.72Å; K972-G975 PolarHBondContact O-N 3.26Å; K972-G975 VanDerWaalsContact O-N 3.14Å; K972-E977 HydrophobicContact CB-CG 3.76Å; K972-E977 WeakPolarHBondContact CD-OE1 3.19Å; K972-E977 WeakPolarHBondContact CE-OE1 3.41Å; K972-E977 HydrophobicContact CG-CG 4.04Å; K972-E977 VanDerWaalsContact CG-OE1 3.31Å; K972-E977 WeakPolarHBondContact CG-OE1 3.37Å; K972-E977 IonicContact NZ-OE1 2.68Å; K972-E977 PolarHBondContact NZ-OE1 3.01Å; K972-E977 IonicContact NZ-OE2 3.47Å; K972-E977 PolarHBondContact NZ-OE2 3.06Å
973	S	80.2	Confident	77.2	Confident	79 Å²	79	63.2 Å²	63.2	55%	0.552	34%	0.337	S	S	*	.	H	α-helix	trans	-64.8	-24.1	177.7	74.5	0	0	0	0	113.3	Q969 F970	Q969-S973 PolarHBondContact O-N 3.3Å; F970-S973 PolarHBondContact O-N 3.45Å; F970-S973 VanDerWaalsContact O-N 3.09Å; F970-S973 PolarHBondContact O-OG 3.02Å
974	L	80.1	Confident	78.5	Confident	42 Å²	42	60.8 Å²	60.8	22%	0.22	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-4.7	176.2	-60.9	179.4	0	0	0	114.7	F970 L971 K972 L976 L1015	F970-L974 HydrophobicContact CD1-CD1 4.33Å; F970-L974 HydrophobicContact CE1-CD1 3.63Å; F970-L974 HydrophobicContact CE2-CD1 4.09Å; F970-L974 HydrophobicContact CZ-CD1 3.5Å; F970-L974 HydrophobicContact CZ-CG 4.39Å; F970-L974 PolarHBondContact O-N 3.21Å; L971-L974 PolarHBondContact O-N 3.04Å; K972-L974 PolarHBondContact O-N 2.72Å; L974-L976 VanDerWaalsContact C-N 3.34Å; L974-L976 HydrophobicContact CB-CD1 4.23Å; L974-L976 HydrophobicContact CB-CG 4.22Å; L974-L1015 HydrophobicContact CD1-CD2 4.19Å
975	G	76.5	Confident	79.6	Confident	57 Å²	57	60.6 Å²	60.6	59%	0.588	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	22.6	-174.1	0	0	0	0	0	114.3	L971 K972	L971-G975 PolarHBondContact O-N 3.02Å; K972-G975 PolarHBondContact O-N 3.26Å; K972-G975 VanDerWaalsContact O-N 3.14Å
976	L	88	Confident	79.8	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.021	31%	0.312	C	S	.	.			trans	-111.4	30.7	-175.5	-62.8	178.6	0	0	0	112.8	L971 L974 H978 L979 H1011 K1014 L1015	L971-L976 HydrophobicContact CD2-CB 4.4Å; L971-L976 CarbonylContact O-C 3.54Å; L971-L976 WeakPolarHBondContact O-CA 3.23Å; L971-L976 PolarHBondContact O-N 3.32Å; L974-L976 VanDerWaalsContact C-N 3.34Å; L974-L976 HydrophobicContact CB-CD1 4.23Å; L974-L976 HydrophobicContact CB-CG 4.22Å; L976-H978 PolarHBondContact O-N 2.97Å; L976-L979 HydrophobicContact CB-CD1 4.16Å; L976-L979 HydrophobicContact CD1-CD1 4.34Å; L976-L979 HydrophobicContact CD2-CD1 4.49Å; L976-L979 PolarHBondContact O-N 3.17Å; L976-H1011 HydrophobicContact CD1-CB 4.49Å; L976-H1011 HydrophobicContact CD2-CB 4.34Å; L976-K1014 HydrophobicContact CD1-CB 4.12Å; L976-L1015 HydrophobicContact CD1-CD1 4.48Å; L976-L1015 HydrophobicContact CD1-CD2 3.83Å; L976-L1015 HydrophobicContact CD1-CG 3.8Å
977	E	82.6	Confident	79.3	Confident	71 Å²	71	65.1 Å²	65.1	33%	0.332	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-55.7	-28.1	-178.1	-65.1	-158.9	-119.8	0	0	113.8	K972 L979 R980	K972-E977 HydrophobicContact CB-CG 3.76Å; K972-E977 WeakPolarHBondContact CD-OE1 3.19Å; K972-E977 WeakPolarHBondContact CE-OE1 3.41Å; K972-E977 HydrophobicContact CG-CG 4.04Å; K972-E977 VanDerWaalsContact CG-OE1 3.31Å; K972-E977 WeakPolarHBondContact CG-OE1 3.37Å; K972-E977 IonicContact NZ-OE1 2.68Å; K972-E977 PolarHBondContact NZ-OE1 3.01Å; K972-E977 IonicContact NZ-OE2 3.47Å; K972-E977 PolarHBondContact NZ-OE2 3.06Å; E977-L979 PolarHBondContact O-N 3.19Å; E977-R980 VanDerWaalsContact O-CB 3.24Å; E977-R980 WeakPolarHBondContact O-CB 3.27Å; E977-R980 PolarHBondContact O-N 2.84Å; E977-R980 VanDerWaalsContact O-N 3.14Å; E977-R980 IonicContact OE2-CZ 2.78Å; E977-R980 IonicContact OE2-NH1 2.68Å; E977-R980 IonicContact OE2-NH2 2.74Å; E977-R980 PolarHBondContact OE2-NH2 3.25Å
978	H	81.3	Confident	79	Confident	115 Å²	115	64.5 Å²	64.5	53%	0.532	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-67.3	-9.6	177.9	67.8	-89.3	0	0	0	114.5	L976 H1011	L976-H978 PolarHBondContact O-N 2.97Å; H978-H1011 AromaticContact CE1-CE1 3.63Å; H978-H1011 AromaticContact CE1-ND1 3.99Å; H978-H1011 AromaticContact NE2-CE1 3.42Å; H978-H1011 PolarHBondContact NE2-CE1 3.24Å; H978-H1011 AromaticContact NE2-ND1 3.54Å
979	L	82.9	Confident	78.8	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.058	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-93.1	-4.7	175.1	-57.7	179.3	0	0	0	112.7	L976 E977 D981 I982 F983 I1006 H1011 L1015	L976-L979 HydrophobicContact CB-CD1 4.16Å; L976-L979 HydrophobicContact CD1-CD1 4.34Å; L976-L979 HydrophobicContact CD2-CD1 4.49Å; L976-L979 PolarHBondContact O-N 3.17Å; E977-L979 PolarHBondContact O-N 3.19Å; L979-D981 VanDerWaalsContact C-N 3.32Å; L979-D981 PolarHBondContact O-N 3.47Å; L979-I982 HydrophobicContact CD2-CD1 4.18Å; L979-I982 WeakPolarHBondContact O-CB 3.45Å; L979-I982 PolarHBondContact O-N 3.15Å; L979-F983 HydrophobicContact CB-CD2 4.38Å; L979-F983 HydrophobicContact CB-CE2 4.4Å; L979-F983 WeakPolarHBondContact O-CD2 3.24Å; L979-F983 PolarHBondContact O-N 2.92Å; L979-I1006 HydrophobicContact CD1-CD1 4.31Å; L979-I1006 HydrophobicContact CD1-CG2 3.91Å; L979-I1006 HydrophobicContact CD2-CG2 4.43Å; L979-H1011 HydrophobicContact CD1-CB 4.29Å; L979-L1015 HydrophobicContact CD1-CD1 4.08Å
980	R	82.6	Confident	78.5	Confident	66 Å²	66	63.7 Å²	63.7	25%	0.249	32%	0.321	C	S	.	.	H	α-helix	trans	-52.2	-47.5	-176.4	-178.7	177.1	-65.5	138.7	6.7	112.6	S968 L971 E977 I982 F983 E984	S968-R980 PolarHBondContact O-NH2 3.1Å; S968-R980 VanDerWaalsContact O-NH2 3.09Å; S968-R980 WeakPolarHBondContact OG-CD 3.28Å; S968-R980 WeakPolarHBondContact OG-CG 3.43Å; S968-R980 PolarHBondContact OG-NE 2.72Å; S968-R980 VanDerWaalsContact OG-NE 3.16Å; L971-R980 HydrophobicContact CD1-CB 4.32Å; E977-R980 VanDerWaalsContact O-CB 3.24Å; E977-R980 WeakPolarHBondContact O-CB 3.27Å; E977-R980 PolarHBondContact O-N 2.84Å; E977-R980 VanDerWaalsContact O-N 3.14Å; E977-R980 IonicContact OE2-CZ 2.78Å; E977-R980 IonicContact OE2-NH1 2.68Å; E977-R980 IonicContact OE2-NH2 2.74Å; E977-R980 PolarHBondContact OE2-NH2 3.25Å; R980-I982 PolarHBondContact O-N 3.35Å; R980-F983 PolarHBondContact O-N 3.17Å; R980-F983 VanDerWaalsContact O-N 3.09Å; R980-E984 WeakPolarHBondContact CD-OE1 3.43Å; R980-E984 HydrophobicContact CG-CG 4.2Å; R980-E984 WeakPolarHBondContact CG-OE1 3.43Å; R980-E984 PolarHBondContact O-N 3.21Å
981	D	73.4	Confident	77.3	Confident	124 Å²	124	68.9 Å²	68.9	66%	0.663	35%	0.349	S	S	*	.	H	α-helix	trans	-61.2	-28.6	-177.9	-54.7	-7.8	0	0	0	112.9	L979 R985	L979-D981 VanDerWaalsContact C-N 3.32Å; L979-D981 PolarHBondContact O-N 3.47Å; D981-R985 WeakPolarHBondContact O-CB 3.3Å; D981-R985 PolarHBondContact O-N 3.33Å
982	I	83.6	Confident	76.4	Confident	32 Å²	32	71.9 Å²	71.9	16%	0.164	37%	0.368	C	S	.	.	H	α-helix	trans	-73.3	-47.5	175.7	-59.6	176	0	0	0	109.7	L979 R980 E984 R985 E986 I1004 I1006	L979-I982 HydrophobicContact CD2-CD1 4.18Å; L979-I982 WeakPolarHBondContact O-CB 3.45Å; L979-I982 PolarHBondContact O-N 3.15Å; R980-I982 PolarHBondContact O-N 3.35Å; I982-E984 VanDerWaalsContact C-N 3.35Å; I982-E984 PolarHBondContact O-N 3.32Å; I982-R985 PolarHBondContact O-N 3.41Å; I982-E986 WeakPolarHBondContact O-CG 3.47Å; I982-E986 PolarHBondContact O-N 3.33Å; I982-I1004 HydrophobicContact CG2-CB 4.3Å; I982-I1004 HydrophobicContact CG2-CD1 4.23Å; I982-I1004 HydrophobicContact CG2-CG1 4.29Å; I982-I1004 VanDerWaalsContact CG2-O 3.32Å; I982-I1004 WeakPolarHBondContact CG2-O 3.41Å; I982-I1006 HydrophobicContact CD1-CG1 4.44Å
983	F	82.3	Confident	76.1	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.009	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-38.1	178.2	-81.6	-99.3	0	0	0	112.3	I967 L971 L979 R980 Q987 I988 L993 L1001 I1006 L1015	I967-F983 HydrophobicContact CD1-CD1 3.79Å; I967-F983 HydrophobicContact CD1-CE1 4Å; I967-F983 HydrophobicContact CG1-CB 4.28Å; I967-F983 HydrophobicContact CG1-CD1 3.73Å; I967-F983 HydrophobicContact CG1-CE1 4.43Å; I967-F983 HydrophobicContact CG1-CG 4.2Å; L971-F983 HydrophobicContact CD1-CB 4.33Å; L971-F983 HydrophobicContact CD1-CD2 3.93Å; L971-F983 HydrophobicContact CD1-CE2 4.49Å; L971-F983 HydrophobicContact CD1-CG 4.13Å; L971-F983 HydrophobicContact CD2-CD2 4.33Å; L971-F983 HydrophobicContact CD2-CE2 4.08Å; L971-F983 HydrophobicContact CD2-CZ 4.46Å; L979-F983 HydrophobicContact CB-CD2 4.38Å; L979-F983 HydrophobicContact CB-CE2 4.4Å; L979-F983 WeakPolarHBondContact O-CD2 3.24Å; L979-F983 PolarHBondContact O-N 2.92Å; R980-F983 PolarHBondContact O-N 3.17Å; R980-F983 VanDerWaalsContact O-N 3.09Å; F983-Q987 WeakPolarHBondContact O-CA 3.42Å; F983-Q987 PolarHBondContact O-N 3.36Å; F983-Q987 VanDerWaalsContact O-N 3.08Å; F983-I988 HydrophobicContact CD1-CB 3.64Å; F983-I988 HydrophobicContact CD1-CG2 3.54Å; F983-I988 HydrophobicContact CE1-CB 4.18Å; F983-I988 HydrophobicContact CE1-CG2 3.6Å; F983-I988 HydrophobicContact CG-CB 4.43Å; F983-I988 PolarHBondContact O-N 2.92Å; F983-L993 HydrophobicContact CE1-CB 4.37Å; F983-L993 HydrophobicContact CE1-CD1 3.9Å; F983-L993 HydrophobicContact CE1-CD2 3.85Å; F983-L993 HydrophobicContact CE1-CG 4.25Å; F983-L993 HydrophobicContact CZ-CD1 4.01Å; F983-L993 HydrophobicContact CZ-CD2 4.19Å; F983-L1001 HydrophobicContact CZ-CD2 4.35Å; F983-I1006 HydrophobicContact CE2-CD1 3.58Å; F983-I1006 HydrophobicContact CZ-CD1 4.07Å; F983-L1015 HydrophobicContact CE2-CD1 4.23Å; F983-L1015 HydrophobicContact CZ-CD1 4.12Å; F983-L1015 HydrophobicContact CZ-CD2 4.28Å
984	E	74.6	Confident	75.5	Confident	98 Å²	98	64.2 Å²	64.2	46%	0.458	33%	0.332	S	S	.	.	H	α-helix	trans	-72.5	-37	176.1	-70.5	-179.1	-171.1	0	0	112.3	S968 R980 I982 Q987	S968-E984 PolarHBondContact OG-OE1 2.8Å; R980-E984 WeakPolarHBondContact CD-OE1 3.43Å; R980-E984 HydrophobicContact CG-CG 4.2Å; R980-E984 WeakPolarHBondContact CG-OE1 3.43Å; R980-E984 PolarHBondContact O-N 3.21Å; I982-E984 VanDerWaalsContact C-N 3.35Å; I982-E984 PolarHBondContact O-N 3.32Å; E984-Q987 PolarHBondContact O-N 2.94Å; E984-Q987 PolarHBondContact O-NE2 3.02Å
985	R	74.4	Confident	74.1	Confident	163 Å²	163	69.4 Å²	69.4	62%	0.615	36%	0.36	S	S	*	.	H	α-helix	trans	-66.7	-44.2	176.5	-171.7	-175.8	74.7	-144.8	-4.2	112.5	D981 I982 Q987	D981-R985 WeakPolarHBondContact O-CB 3.3Å; D981-R985 PolarHBondContact O-N 3.33Å; I982-R985 PolarHBondContact O-N 3.41Å; R985-Q987 VanDerWaalsContact C-N 3.29Å
986	E	74.9	Confident	73.5	Confident	87 Å²	87	68 Å²	68	41%	0.407	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	3.1	179.7	-52.5	-52.6	146.7	0	0	113.1	I982 I988 I1004	I982-E986 WeakPolarHBondContact O-CG 3.47Å; I982-E986 PolarHBondContact O-N 3.33Å; E986-I988 VanDerWaalsContact C-N 3.31Å; E986-I988 HydrophobicContact CB-CD1 3.74Å; E986-I988 HydrophobicContact CB-CG1 3.88Å; E986-I988 HydrophobicContact CG-CD1 4.49Å; E986-I988 PolarHBondContact O-N 3.23Å; E986-I1004 HydrophobicContact CG-CB 4.21Å; E986-I1004 HydrophobicContact CG-CG2 4.16Å
987	Q	66.1	Low	72.1	Confident	154 Å²	154	69.1 Å²	69.1	72%	0.72	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	37.3	-179.9	-62	-71.3	-57.7	0	0	114.3	F983 E984 R985 T989	F983-Q987 WeakPolarHBondContact O-CA 3.42Å; F983-Q987 PolarHBondContact O-N 3.36Å; F983-Q987 VanDerWaalsContact O-N 3.08Å; E984-Q987 PolarHBondContact O-N 2.94Å; E984-Q987 PolarHBondContact O-NE2 3.02Å; R985-Q987 VanDerWaalsContact C-N 3.29Å; Q987-T989 PolarHBondContact O-N 3.27Å
988	I	73	Confident	71.1	Confident	12 Å²	12	68.3 Å²	68.3	6%	0.062	35%	0.347	C	S	.	.			trans	-85.7	111.6	-176.5	-60.7	167.5	0	0	0	110.3	F983 E986 V992 L993 M996 I1004	F983-I988 HydrophobicContact CD1-CB 3.64Å; F983-I988 HydrophobicContact CD1-CG2 3.54Å; F983-I988 HydrophobicContact CE1-CB 4.18Å; F983-I988 HydrophobicContact CE1-CG2 3.6Å; F983-I988 HydrophobicContact CG-CB 4.43Å; F983-I988 PolarHBondContact O-N 2.92Å; E986-I988 VanDerWaalsContact C-N 3.31Å; E986-I988 HydrophobicContact CB-CD1 3.74Å; E986-I988 HydrophobicContact CB-CG1 3.88Å; E986-I988 HydrophobicContact CG-CD1 4.49Å; E986-I988 PolarHBondContact O-N 3.23Å; I988-V992 HydrophobicContact CG2-CB 4.27Å; I988-V992 HydrophobicContact CG2-CG1 4.11Å; I988-L993 HydrophobicContact CG2-CB 4.23Å; I988-M996 HydrophobicContact CD1-CE 4.05Å; I988-M996 HydrophobicContact CD1-SD 4.04Å; I988-M996 HydrophobicContact CG1-SD 4.44Å; I988-M996 HydrophobicContact CG2-SD 3.87Å; I988-I1004 HydrophobicContact CD1-CD1 3.44Å; I988-I1004 VanDerWaalsContact CD1-CD1 3.44Å; I988-I1004 HydrophobicContact CD1-CG2 4.21Å
989	T	74.1	Confident	70.1	Confident	67 Å²	67	67.5 Å²	67.5	41%	0.411	34%	0.343	S	S	.	.			trans	-89.3	173	173.7	50.7	0	0	0	0	111.7	Q987 D991 V992 L993	Q987-T989 PolarHBondContact O-N 3.27Å; T989-D991 WeakPolarHBondContact CB-OD1 3.48Å; T989-D991 PolarHBondContact OG1-OD1 3.06Å; T989-V992 PolarHBondContact O-N 2.85Å; T989-V992 WeakPolarHBondContact OG1-CG2 3.4Å; T989-L993 WeakPolarHBondContact O-CB 3.49Å; T989-L993 PolarHBondContact O-N 3.41Å
990	L	70.7	Confident	69.3	Low	29 Å²	29	71.6 Å²	71.6	15%	0.152	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-32.6	-173	-85.5	166.9	0	0	0	114.3	M965 I967 F970 L993 A994 V1019 L1022	M965-L990 WeakPolarHBondContact O-CD1 3.44Å; I967-L990 HydrophobicContact CB-CG 4.29Å; I967-L990 HydrophobicContact CD1-CD2 3.64Å; I967-L990 HydrophobicContact CD1-CG 3.83Å; F970-L990 HydrophobicContact CB-CD1 4.24Å; F970-L990 HydrophobicContact CB-CD2 3.8Å; F970-L990 HydrophobicContact CD1-CD2 3.57Å; F970-L990 HydrophobicContact CD2-CD2 4.07Å; F970-L990 HydrophobicContact CE1-CD2 4.1Å; F970-L990 HydrophobicContact CG-CD2 3.53Å; L990-L993 HydrophobicContact CD2-CD2 4.47Å; L990-A994 PolarHBondContact O-N 3.19Å; L990-A994 VanDerWaalsContact O-N 3.09Å; L990-V1019 HydrophobicContact CD2-CG2 4.02Å; L990-L1022 HydrophobicContact CD1-CD2 4.15Å; L990-L1022 HydrophobicContact CD2-CD2 4.21Å
991	D	58.3	Low	68.8	Low	112 Å²	112	68.4 Å²	68.4	60%	0.599	35%	0.35	S	S	*	.	H	α-helix	trans	-65.7	-45.5	170.5	55.9	-41.8	0	0	0	111.2	T989 L993 A994	T989-D991 WeakPolarHBondContact CB-OD1 3.48Å; T989-D991 PolarHBondContact OG1-OD1 3.06Å; D991-L993 PolarHBondContact O-N 2.88Å; D991-A994 WeakPolarHBondContact O-CB 3.4Å; D991-A994 PolarHBondContact O-N 3.38Å; D991-A994 VanDerWaalsContact O-N 3.15Å
992	V	64.4	Low	68.4	Low	64 Å²	64	66.4 Å²	66.4	39%	0.388	34%	0.335	S	S	.	.	H	α-helix	trans	-62.2	-43.6	173.8	178.7	0	0	0	0	110.7	I988 T989 A994 D995 M996	I988-V992 HydrophobicContact CG2-CB 4.27Å; I988-V992 HydrophobicContact CG2-CG1 4.11Å; T989-V992 PolarHBondContact O-N 2.85Å; T989-V992 WeakPolarHBondContact OG1-CG2 3.4Å; V992-A994 PolarHBondContact O-N 3.35Å; V992-D995 PolarHBondContact O-N 3.1Å; V992-M996 HydrophobicContact CG1-SD 4.23Å; V992-M996 WeakPolarHBondContact O-CG 3.39Å; V992-M996 PolarHBondContact O-N 3.41Å
993	L	73.3	Confident	67.7	Low	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-28.2	176	179	59.3	0	0	0	113.2	I967 F970 F983 I988 T989 L990 D991 D995 M996 L1001 V1019	I967-L993 HydrophobicContact CD1-CD2 3.89Å; F970-L993 HydrophobicContact CD1-CD2 4.19Å; F970-L993 HydrophobicContact CE1-CD2 3.6Å; F970-L993 HydrophobicContact CZ-CD2 4.44Å; F983-L993 HydrophobicContact CE1-CB 4.37Å; F983-L993 HydrophobicContact CE1-CD1 3.9Å; F983-L993 HydrophobicContact CE1-CD2 3.85Å; F983-L993 HydrophobicContact CE1-CG 4.25Å; F983-L993 HydrophobicContact CZ-CD1 4.01Å; F983-L993 HydrophobicContact CZ-CD2 4.19Å; I988-L993 HydrophobicContact CG2-CB 4.23Å; T989-L993 WeakPolarHBondContact O-CB 3.49Å; T989-L993 PolarHBondContact O-N 3.41Å; L990-L993 HydrophobicContact CD2-CD2 4.47Å; D991-L993 PolarHBondContact O-N 2.88Å; L993-D995 VanDerWaalsContact C-N 3.26Å; L993-D995 PolarHBondContact O-N 3.33Å; L993-M996 HydrophobicContact CD1-CB 4.49Å; L993-M996 PolarHBondContact O-N 3.01Å; L993-L1001 HydrophobicContact CD1-CD1 4.36Å; L993-L1001 HydrophobicContact CD1-CD2 3.71Å; L993-V1019 HydrophobicContact CD2-CG2 4.35Å; L993-V1019 HydrophobicContact CG-CG2 4.35Å
994	A	68.9	Low	67.2	Low	39 Å²	39	73.9 Å²	73.9	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-65.9	-29.5	177.6	0	0	0	0	0	113.1	L990 D991 V992 V1019 L1023	L990-A994 PolarHBondContact O-N 3.19Å; L990-A994 VanDerWaalsContact O-N 3.09Å; D991-A994 WeakPolarHBondContact O-CB 3.4Å; D991-A994 PolarHBondContact O-N 3.38Å; D991-A994 VanDerWaalsContact O-N 3.15Å; V992-A994 PolarHBondContact O-N 3.35Å; A994-V1019 HydrophobicContact CB-CG1 4.32Å; A994-L1023 HydrophobicContact CB-CD1 3.69Å
995	D	51.1	Low	66.4	Low	150 Å²	150	70.9 Å²	70.9	80%	0.802	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-2.8	178.6	-71.8	-26.7	0	0	0	113.3	V992 L993	V992-D995 PolarHBondContact O-N 3.1Å; L993-D995 VanDerWaalsContact C-N 3.26Å; L993-D995 PolarHBondContact O-N 3.33Å
996	M	63.4	Low	66.7	Low	29 Å²	29	63.2 Å²	63.2	14%	0.143	34%	0.337	C	S	.	.			trans	-90.2	129.4	-177.9	-71	-179.3	87.9	0	0	113.8	I988 V992 L993 E1000 L1001 I1004	I988-M996 HydrophobicContact CD1-CE 4.05Å; I988-M996 HydrophobicContact CD1-SD 4.04Å; I988-M996 HydrophobicContact CG1-SD 4.44Å; I988-M996 HydrophobicContact CG2-SD 3.87Å; V992-M996 HydrophobicContact CG1-SD 4.23Å; V992-M996 WeakPolarHBondContact O-CG 3.39Å; V992-M996 PolarHBondContact O-N 3.41Å; L993-M996 HydrophobicContact CD1-CB 4.49Å; L993-M996 PolarHBondContact O-N 3.01Å; M996-E1000 HydrophobicContact CE-CB 3.73Å; M996-L1001 HydrophobicContact CB-CD2 4.18Å; M996-L1001 HydrophobicContact CB-CG 4.21Å; M996-L1001 HydrophobicContact CE-CD2 3.97Å; M996-L1001 HydrophobicContact SD-CD2 4.07Å; M996-I1004 HydrophobicContact CE-CD1 4.12Å; M996-I1004 HydrophobicContact CE-CG2 4.4Å
997	G	58.8	Low	66.2	Low	27 Å²	27	64.3 Å²	64.3	28%	0.278	35%	0.345	S	S	.	.			trans	-94.8	-175.4	174.6	0	0	0	0	0	114.6	E999 E1000 L1001	G997-E999 VanDerWaalsContact C-N 3.31Å; G997-E999 PolarHBondContact O-N 3.48Å; G997-E1000 VanDerWaalsContact CA-OE2 3.24Å; G997-E1000 WeakPolarHBondContact CA-OE2 3.35Å; G997-E1000 PolarHBondContact N-OE2 3.4Å; G997-L1001 WeakPolarHBondContact O-CG 3.47Å; G997-L1001 PolarHBondContact O-N 3.29Å
998	H	61.5	Low	66.1	Low	53 Å²	53	59.3 Å²	59.3	25%	0.245	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.5	-174.7	-85.6	-77.6	0	0	0	114.5	K1002 Y1009 R1012 H1013	H998-K1002 WeakPolarHBondContact O-CB 3.49Å; H998-Y1009 AromaticContact CE1-CD2 3.85Å; H998-Y1009 AromaticContact CE1-CE2 3.28Å; H998-Y1009 WeakPolarHBondContact CE1-CE2 3.46Å; H998-Y1009 AromaticContact CE1-CZ 3.69Å; H998-Y1009 AromaticContact ND1-CD2 3.77Å; H998-Y1009 AromaticContact ND1-CE2 3.49Å; H998-Y1009 WeakPolarHBondContact ND1-CE2 3.4Å; H998-Y1009 AromaticContact NE2-CE2 3.78Å; H998-Y1009 AromaticContact NE2-CZ 3.99Å; H998-R1012 WeakPolarHBondContact ND1-CB 3.48Å; H998-R1012 WeakPolarHBondContact O-CD 3.38Å; H998-R1012 PolarHBondContact O-NH1 3.28Å; H998-H1013 AromaticContact NE2-ND1 3.85Å
999	E	58.8	Low	65.4	Low	99 Å²	99	65.2 Å²	65.2	46%	0.463	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-38.9	179.4	-67.1	-62.1	110.2	0	0	111.9	G997 L1001 K1002 E1003 R1012	G997-E999 VanDerWaalsContact C-N 3.31Å; G997-E999 PolarHBondContact O-N 3.48Å; E999-L1001 VanDerWaalsContact C-N 3.33Å; E999-L1001 PolarHBondContact O-N 3.26Å; E999-K1002 VanDerWaalsContact CD-NZ 3.32Å; E999-K1002 WeakPolarHBondContact O-CA 3.21Å; E999-K1002 WeakPolarHBondContact O-CB 3.14Å; E999-K1002 PolarHBondContact O-N 3.21Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.36Å; E999-K1002 IonicContact OE1-NZ 2.75Å; E999-K1002 PolarHBondContact OE1-NZ 3.23Å; E999-K1002 VanDerWaalsContact OE1-NZ 3.13Å; E999-K1002 WeakPolarHBondContact OE2-CD 3.33Å; E999-K1002 IonicContact OE2-NZ 3.1Å; E999-K1002 PolarHBondContact OE2-NZ 2.91Å; E999-E1003 PolarHBondContact O-N 2.63Å; E999-R1012 IonicContact OE1-NH1 2.8Å
1000	E	67.7	Low	64.5	Low	96 Å²	96	64.1 Å²	64.1	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-62.1	-40.4	173.6	-61.8	99.3	-177.2	0	0	111.7	M996 G997 K1002 E1003 I1004	M996-E1000 HydrophobicContact CE-CB 3.73Å; G997-E1000 VanDerWaalsContact CA-OE2 3.24Å; G997-E1000 WeakPolarHBondContact CA-OE2 3.35Å; G997-E1000 PolarHBondContact N-OE2 3.4Å; E1000-K1002 PolarHBondContact O-N 3.02Å; E1000-E1003 PolarHBondContact O-N 3Å; E1000-I1004 PolarHBondContact O-N 3.28Å
1001	L	71.6	Confident	64.5	Low	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-64.7	-23.8	174.5	-67.8	176.1	0	0	0	113.4	F983 L993 M996 G997 E999 I1004 I1006 R1012 L1015 I1016	F983-L1001 HydrophobicContact CZ-CD2 4.35Å; L993-L1001 HydrophobicContact CD1-CD1 4.36Å; L993-L1001 HydrophobicContact CD1-CD2 3.71Å; M996-L1001 HydrophobicContact CB-CD2 4.18Å; M996-L1001 HydrophobicContact CB-CG 4.21Å; M996-L1001 HydrophobicContact CE-CD2 3.97Å; M996-L1001 HydrophobicContact SD-CD2 4.07Å; G997-L1001 WeakPolarHBondContact O-CG 3.47Å; G997-L1001 PolarHBondContact O-N 3.29Å; E999-L1001 VanDerWaalsContact C-N 3.33Å; E999-L1001 PolarHBondContact O-N 3.26Å; L1001-I1004 HydrophobicContact CD2-CD1 4Å; L1001-I1004 VanDerWaalsContact O-CG1 3.24Å; L1001-I1004 WeakPolarHBondContact O-CG1 3.46Å; L1001-I1006 HydrophobicContact CD2-CD1 4.23Å; L1001-I1006 WeakPolarHBondContact O-CA 3.34Å; L1001-I1006 WeakPolarHBondContact O-CB 3.22Å; L1001-I1006 WeakPolarHBondContact O-CG1 3.38Å; L1001-I1006 PolarHBondContact O-N 3.44Å; L1001-R1012 HydrophobicContact CB-CB 4.49Å; L1001-R1012 HydrophobicContact CB-CG 3.84Å; L1001-R1012 HydrophobicContact CD1-CB 4.27Å; L1001-R1012 HydrophobicContact CD1-CG 4.45Å; L1001-L1015 HydrophobicContact CD1-CB 4.43Å; L1001-I1016 HydrophobicContact CD1-CD1 4Å; L1001-I1016 HydrophobicContact CD1-CG1 3.84Å
1002	K	64.1	Low	65.6	Low	81 Å²	81	61.3 Å²	61.3	35%	0.352	34%	0.336	S	S	.	.	H	α-helix	trans	-81.8	-39	177.6	-179.6	-167.2	178.7	-172.8	0	110.8	H998 E999 E1000 I1004 G1005	H998-K1002 WeakPolarHBondContact O-CB 3.49Å; E999-K1002 VanDerWaalsContact CD-NZ 3.32Å; E999-K1002 WeakPolarHBondContact O-CA 3.21Å; E999-K1002 WeakPolarHBondContact O-CB 3.14Å; E999-K1002 PolarHBondContact O-N 3.21Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.36Å; E999-K1002 IonicContact OE1-NZ 2.75Å; E999-K1002 PolarHBondContact OE1-NZ 3.23Å; E999-K1002 VanDerWaalsContact OE1-NZ 3.13Å; E999-K1002 WeakPolarHBondContact OE2-CD 3.33Å; E999-K1002 IonicContact OE2-NZ 3.1Å; E999-K1002 PolarHBondContact OE2-NZ 2.91Å; E1000-K1002 PolarHBondContact O-N 3.02Å; K1002-I1004 VanDerWaalsContact C-N 3.34Å; K1002-I1004 PolarHBondContact O-N 2.83Å; K1002-G1005 WeakPolarHBondContact O-CA 3.28Å; K1002-G1005 PolarHBondContact O-N 2.88Å
1003	E	69.8	Low	65.3	Low	164 Å²	164	62 Å²	62	77%	0.766	34%	0.335	S	S	*	.	H	α-helix	trans	-62.1	-37.3	176.9	-71.8	-178	169	0	0	112.7	E999 E1000 G1005	E999-E1003 PolarHBondContact O-N 2.63Å; E1000-E1003 PolarHBondContact O-N 3Å; E1003-G1005 PolarHBondContact O-N 3.28Å
1004	I	70.9	Confident	65.1	Low	27 Å²	27	67.4 Å²	67.4	14%	0.138	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-4.7	172.7	66	171.3	0	0	0	114.1	I982 E986 I988 M996 E1000 L1001 K1002 I1006	I982-I1004 HydrophobicContact CG2-CB 4.3Å; I982-I1004 HydrophobicContact CG2-CD1 4.23Å; I982-I1004 HydrophobicContact CG2-CG1 4.29Å; I982-I1004 VanDerWaalsContact CG2-O 3.32Å; I982-I1004 WeakPolarHBondContact CG2-O 3.41Å; E986-I1004 HydrophobicContact CG-CB 4.21Å; E986-I1004 HydrophobicContact CG-CG2 4.16Å; I988-I1004 HydrophobicContact CD1-CD1 3.44Å; I988-I1004 VanDerWaalsContact CD1-CD1 3.44Å; I988-I1004 HydrophobicContact CD1-CG2 4.21Å; M996-I1004 HydrophobicContact CE-CD1 4.12Å; M996-I1004 HydrophobicContact CE-CG2 4.4Å; E1000-I1004 PolarHBondContact O-N 3.28Å; L1001-I1004 HydrophobicContact CD2-CD1 4Å; L1001-I1004 VanDerWaalsContact O-CG1 3.24Å; L1001-I1004 WeakPolarHBondContact O-CG1 3.46Å; K1002-I1004 VanDerWaalsContact C-N 3.34Å; K1002-I1004 PolarHBondContact O-N 2.83Å; I1004-I1006 HydrophobicContact CD1-CD1 3.85Å; I1004-I1006 HydrophobicContact CD1-CG1 4.31Å; I1004-I1006 HydrophobicContact CG1-CD1 4.3Å; I1004-I1006 HydrophobicContact CG1-CG1 4.23Å
1005	G	59.5	Low	65.4	Low	35 Å²	35	65.6 Å²	65.6	36%	0.361	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.2	1.6	172.3	0	0	0	0	0	116.7	K1002 E1003 N1007	K1002-G1005 WeakPolarHBondContact O-CA 3.28Å; K1002-G1005 PolarHBondContact O-N 2.88Å; E1003-G1005 PolarHBondContact O-N 3.28Å; G1005-N1007 VanDerWaalsContact C-N 3.26Å; G1005-N1007 PolarHBondContact O-N 3.25Å; G1005-N1007 PolarHBondContact O-ND2 3.35Å
1006	I	80.1	Confident	66.4	Low	3 Å²	3	59.8 Å²	59.8	2%	0.015	31%	0.312	C	S	.	.			trans	-84.4	69.3	-179.4	-45.3	171.6	0	0	0	109.9	L979 I982 F983 L1001 I1004 A1008 H1011 R1012 L1015	L979-I1006 HydrophobicContact CD1-CD1 4.31Å; L979-I1006 HydrophobicContact CD1-CG2 3.91Å; L979-I1006 HydrophobicContact CD2-CG2 4.43Å; I982-I1006 HydrophobicContact CD1-CG1 4.44Å; F983-I1006 HydrophobicContact CE2-CD1 3.58Å; F983-I1006 HydrophobicContact CZ-CD1 4.07Å; L1001-I1006 HydrophobicContact CD2-CD1 4.23Å; L1001-I1006 WeakPolarHBondContact O-CA 3.34Å; L1001-I1006 WeakPolarHBondContact O-CB 3.22Å; L1001-I1006 WeakPolarHBondContact O-CG1 3.38Å; L1001-I1006 PolarHBondContact O-N 3.44Å; I1004-I1006 HydrophobicContact CD1-CD1 3.85Å; I1004-I1006 HydrophobicContact CD1-CG1 4.31Å; I1004-I1006 HydrophobicContact CG1-CD1 4.3Å; I1004-I1006 HydrophobicContact CG1-CG1 4.23Å; I1006-A1008 VanDerWaalsContact C-N 3.33Å; I1006-A1008 PolarHBondContact O-N 3.14Å; I1006-H1011 HydrophobicContact CG2-CB 3.9Å; I1006-R1012 HydrophobicContact CB-CG 4.16Å; I1006-R1012 HydrophobicContact CG2-CG 3.96Å; I1006-R1012 WeakPolarHBondContact O-CD 3.27Å; I1006-R1012 WeakPolarHBondContact O-CG 3.44Å; I1006-R1012 PolarHBondContact O-NE 2.98Å; I1006-L1015 HydrophobicContact CD1-CD1 3.78Å; I1006-L1015 HydrophobicContact CG2-CD1 4.42Å
1007	N	65	Low	66.7	Low	110 Å²	110	62.4 Å²	62.4	59%	0.588	32%	0.322	S	S	*	.			trans	-63.5	-33.8	-172.2	-70.3	-60.5	0	0	0	114	G1005 Y1009 R1012	G1005-N1007 VanDerWaalsContact C-N 3.26Å; G1005-N1007 PolarHBondContact O-N 3.25Å; G1005-N1007 PolarHBondContact O-ND2 3.35Å; N1007-Y1009 PolarHBondContact O-N 2.81Å; N1007-R1012 PolarHBondContact O-NE 3.19Å; N1007-R1012 PolarHBondContact O-NH2 3.31Å
1008	A	63.6	Low	67.3	Low	48 Å²	48	61.5 Å²	61.5	40%	0.397	31%	0.313	S	S	.	.			trans	-65.9	114.8	-178.2	0	0	0	0	0	112.3	I1006 G1010 H1011 R1012	I1006-A1008 VanDerWaalsContact C-N 3.33Å; I1006-A1008 PolarHBondContact O-N 3.14Å; A1008-G1010 VanDerWaalsContact C-N 3.34Å; A1008-G1010 PolarHBondContact O-N 2.84Å; A1008-H1011 HydrophobicContact CB-CB 4.25Å; A1008-H1011 PolarHBondContact O-N 2.9Å; A1008-H1011 VanDerWaalsContact O-N 3.09Å; A1008-R1012 PolarHBondContact O-N 2.98Å
1009	Y	58.2	Low	67.7	Low	137 Å²	137	59.3 Å²	59.3	54%	0.537	30%	0.303	S	S	.	.	H	α-helix	trans	-57.8	-42.9	-177.1	179.9	-97.6	0	0	0	112.9	H998 N1007 H1011 R1012 H1013	H998-Y1009 AromaticContact CE1-CD2 3.85Å; H998-Y1009 AromaticContact CE1-CE2 3.28Å; H998-Y1009 WeakPolarHBondContact CE1-CE2 3.46Å; H998-Y1009 AromaticContact CE1-CZ 3.69Å; H998-Y1009 AromaticContact ND1-CD2 3.77Å; H998-Y1009 AromaticContact ND1-CE2 3.49Å; H998-Y1009 WeakPolarHBondContact ND1-CE2 3.4Å; H998-Y1009 AromaticContact NE2-CE2 3.78Å; H998-Y1009 AromaticContact NE2-CZ 3.99Å; N1007-Y1009 PolarHBondContact O-N 2.81Å; Y1009-H1011 PolarHBondContact O-N 2.79Å; Y1009-R1012 PolarHBondContact O-N 3.37Å; Y1009-H1013 HydrophobicContact CE1-CB 4.3Å; Y1009-H1013 WeakPolarHBondContact O-CB 3.19Å; Y1009-H1013 PolarHBondContact O-N 3.09Å
1010	G	55.1	Low	68	Low	43 Å²	43	59 Å²	59	44%	0.443	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-27.3	178	0	0	0	0	0	114.3	A1008 K1014	A1008-G1010 VanDerWaalsContact C-N 3.34Å; A1008-G1010 PolarHBondContact O-N 2.84Å; G1010-K1014 WeakPolarHBondContact O-CB 3.3Å; G1010-K1014 WeakPolarHBondContact O-CG 3.49Å; G1010-K1014 PolarHBondContact O-N 3.22Å
1011	H	70.1	Confident	68	Low	62 Å²	62	63.9 Å²	63.9	29%	0.287	32%	0.316	S	S	.	.	H	α-helix	trans	-76.2	-47.3	173.8	-65.6	-176.8	0	0	0	110.4	L976 H978 L979 I1006 A1008 Y1009 H1013 K1014 L1015	L976-H1011 HydrophobicContact CD1-CB 4.49Å; L976-H1011 HydrophobicContact CD2-CB 4.34Å; H978-H1011 AromaticContact CE1-CE1 3.63Å; H978-H1011 AromaticContact CE1-ND1 3.99Å; H978-H1011 AromaticContact NE2-CE1 3.42Å; H978-H1011 PolarHBondContact NE2-CE1 3.24Å; H978-H1011 AromaticContact NE2-ND1 3.54Å; L979-H1011 HydrophobicContact CD1-CB 4.29Å; I1006-H1011 HydrophobicContact CG2-CB 3.9Å; A1008-H1011 HydrophobicContact CB-CB 4.25Å; A1008-H1011 PolarHBondContact O-N 2.9Å; A1008-H1011 VanDerWaalsContact O-N 3.09Å; Y1009-H1011 PolarHBondContact O-N 2.79Å; H1011-H1013 VanDerWaalsContact C-N 3.32Å; H1011-H1013 PolarHBondContact O-N 3.03Å; H1011-K1014 PolarHBondContact O-N 3.03Å; H1011-L1015 VanDerWaalsContact O-CG 3.3Å; H1011-L1015 WeakPolarHBondContact O-CG 3.41Å; H1011-L1015 PolarHBondContact O-N 3.02Å
1012	R	82.4	Confident	67.6	Low	21 Å²	21	66.8 Å²	66.8	8%	0.079	33%	0.331	C	S	.	.	H	α-helix	trans	-55.4	-46.1	173.9	-65.7	-175.2	-89.3	151	-2.4	112	H998 E999 L1001 I1006 N1007 A1008 Y1009 L1015 I1016	H998-R1012 WeakPolarHBondContact ND1-CB 3.48Å; H998-R1012 WeakPolarHBondContact O-CD 3.38Å; H998-R1012 PolarHBondContact O-NH1 3.28Å; E999-R1012 IonicContact OE1-NH1 2.8Å; L1001-R1012 HydrophobicContact CB-CB 4.49Å; L1001-R1012 HydrophobicContact CB-CG 3.84Å; L1001-R1012 HydrophobicContact CD1-CB 4.27Å; L1001-R1012 HydrophobicContact CD1-CG 4.45Å; I1006-R1012 HydrophobicContact CB-CG 4.16Å; I1006-R1012 HydrophobicContact CG2-CG 3.96Å; I1006-R1012 WeakPolarHBondContact O-CD 3.27Å; I1006-R1012 WeakPolarHBondContact O-CG 3.44Å; I1006-R1012 PolarHBondContact O-NE 2.98Å; N1007-R1012 PolarHBondContact O-NE 3.19Å; N1007-R1012 PolarHBondContact O-NH2 3.31Å; A1008-R1012 PolarHBondContact O-N 2.98Å; Y1009-R1012 PolarHBondContact O-N 3.37Å; R1012-L1015 PolarHBondContact O-N 2.9Å; R1012-I1016 WeakPolarHBondContact O-CG1 3.2Å; R1012-I1016 PolarHBondContact O-N 2.99Å; R1012-I1016 VanDerWaalsContact O-N 3.13Å
1013	H	58	Low	67.3	Low	78 Å²	78	68.9 Å²	68.9	36%	0.361	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-43.1	178.7	-166.9	79.7	0	0	0	112.4	H998 Y1009 H1011 K1017	H998-H1013 AromaticContact NE2-ND1 3.85Å; Y1009-H1013 HydrophobicContact CE1-CB 4.3Å; Y1009-H1013 WeakPolarHBondContact O-CB 3.19Å; Y1009-H1013 PolarHBondContact O-N 3.09Å; H1011-H1013 VanDerWaalsContact C-N 3.32Å; H1011-H1013 PolarHBondContact O-N 3.03Å; H1013-K1017 WeakPolarHBondContact O-CB 3.37Å; H1013-K1017 PolarHBondContact O-N 2.87Å
1014	K	69.4	Low	66.6	Low	114 Å²	114	64 Å²	64	50%	0.496	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-38.5	175.8	-85.2	-176.6	174.5	-174.9	0	113	L976 G1010 H1011 G1018	L976-K1014 HydrophobicContact CD1-CB 4.12Å; G1010-K1014 WeakPolarHBondContact O-CB 3.3Å; G1010-K1014 WeakPolarHBondContact O-CG 3.49Å; G1010-K1014 PolarHBondContact O-N 3.22Å; H1011-K1014 PolarHBondContact O-N 3.03Å; K1014-G1018 WeakPolarHBondContact O-CA 3.35Å; K1014-G1018 PolarHBondContact O-N 3.07Å
1015	L	75.2	Confident	65	Low	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-52.4	178	-69.7	164	0	0	0	110.9	F970 L971 L974 L976 L979 F983 L1001 I1006 H1011 R1012 G1018 V1019	F970-L1015 HydrophobicContact CE1-CD2 4.31Å; L971-L1015 HydrophobicContact CD2-CD2 3.34Å; L974-L1015 HydrophobicContact CD1-CD2 4.19Å; L976-L1015 HydrophobicContact CD1-CD1 4.48Å; L976-L1015 HydrophobicContact CD1-CD2 3.83Å; L976-L1015 HydrophobicContact CD1-CG 3.8Å; L979-L1015 HydrophobicContact CD1-CD1 4.08Å; F983-L1015 HydrophobicContact CE2-CD1 4.23Å; F983-L1015 HydrophobicContact CZ-CD1 4.12Å; F983-L1015 HydrophobicContact CZ-CD2 4.28Å; L1001-L1015 HydrophobicContact CD1-CB 4.43Å; I1006-L1015 HydrophobicContact CD1-CD1 3.78Å; I1006-L1015 HydrophobicContact CG2-CD1 4.42Å; H1011-L1015 VanDerWaalsContact O-CG 3.3Å; H1011-L1015 WeakPolarHBondContact O-CG 3.41Å; H1011-L1015 PolarHBondContact O-N 3.02Å; R1012-L1015 PolarHBondContact O-N 2.9Å; L1015-G1018 PolarHBondContact O-N 3.37Å; L1015-V1019 PolarHBondContact O-N 3.45Å
1016	I	70.4	Confident	63.8	Low	28 Å²	28	72.8 Å²	72.8	14%	0.144	39%	0.388	C	S	.	.	H	α-helix	trans	-59.7	-53.7	178.8	-63.6	165.8	0	0	0	110.5	L1001 R1012 G1018 V1019 E1020	L1001-I1016 HydrophobicContact CD1-CD1 4Å; L1001-I1016 HydrophobicContact CD1-CG1 3.84Å; R1012-I1016 WeakPolarHBondContact O-CG1 3.2Å; R1012-I1016 PolarHBondContact O-N 2.99Å; R1012-I1016 VanDerWaalsContact O-N 3.13Å; I1016-G1018 PolarHBondContact O-N 2.66Å; I1016-V1019 PolarHBondContact O-N 3.31Å; I1016-E1020 WeakPolarHBondContact O-CG 3.31Å; I1016-E1020 PolarHBondContact O-N 2.96Å
1017	K	70.3	Confident	61.5	Low	84 Å²	84	82.1 Å²	82.1	37%	0.365	43%	0.432	S	S	.	.	H	α-helix	trans	-62.8	-26.8	177.2	-86.5	-85.1	169.5	-99.5	0	114.1	H1013 E1020 R1021	H1013-K1017 WeakPolarHBondContact O-CB 3.37Å; H1013-K1017 PolarHBondContact O-N 2.87Å; K1017-E1020 WeakPolarHBondContact CD-OE2 3.29Å; K1017-E1020 WeakPolarHBondContact CE-OE2 3.46Å; K1017-E1020 IonicContact NZ-OE1 3.17Å; K1017-E1020 PolarHBondContact NZ-OE1 2.94Å; K1017-E1020 IonicContact NZ-OE2 2.92Å; K1017-E1020 PolarHBondContact NZ-OE2 3.4Å; K1017-R1021 VanDerWaalsContact O-CG 3.3Å; K1017-R1021 WeakPolarHBondContact O-CG 3.44Å; K1017-R1021 PolarHBondContact O-N 3.27Å
1018	G	71.3	Confident	60	Low	9 Å²	9	81 Å²	81	9%	0.093	45%	0.446	C	S	.	.	H	α-helix	trans	-70.7	-44.7	175.1	0	0	0	0	0	111.7	F970 K1014 L1015 I1016 R1021 L1022	F970-G1018 VanDerWaalsContact CE2-C 3.48Å; K1014-G1018 WeakPolarHBondContact O-CA 3.35Å; K1014-G1018 PolarHBondContact O-N 3.07Å; L1015-G1018 PolarHBondContact O-N 3.37Å; I1016-G1018 PolarHBondContact O-N 2.66Å; G1018-R1021 PolarHBondContact O-N 2.87Å; G1018-L1022 PolarHBondContact O-N 3.32Å
1019	V	71.1	Confident	58.2	Low	6 Å²	6	82.2 Å²	82.2	4%	0.036	46%	0.464	C	S	.	.	H	α-helix	trans	-75	-37.4	-175.1	95.1	0	0	0	0	110.6	F970 L990 L993 A994 L1015 I1016 R1021 L1022 L1023	F970-V1019 HydrophobicContact CE2-CB 4.41Å; F970-V1019 HydrophobicContact CE2-CG2 4.47Å; F970-V1019 HydrophobicContact CZ-CB 3.85Å; F970-V1019 HydrophobicContact CZ-CG2 4.12Å; L990-V1019 HydrophobicContact CD2-CG2 4.02Å; L993-V1019 HydrophobicContact CD2-CG2 4.35Å; L993-V1019 HydrophobicContact CG-CG2 4.35Å; A994-V1019 HydrophobicContact CB-CG1 4.32Å; L1015-V1019 PolarHBondContact O-N 3.45Å; I1016-V1019 PolarHBondContact O-N 3.31Å; V1019-R1021 VanDerWaalsContact C-N 3.27Å; V1019-R1021 PolarHBondContact O-N 3.45Å; V1019-L1022 PolarHBondContact O-N 2.86Å; V1019-L1022 VanDerWaalsContact O-N 3.15Å; V1019-L1023 WeakPolarHBondContact O-CG 3.44Å; V1019-L1023 PolarHBondContact O-N 3.46Å
1020	E	64.7	Low	56.7	Low	94 Å²	94	81.1 Å²	81.1	44%	0.439	47%	0.467	S	S	.	.	H	α-helix	trans	-54.5	-40.1	167.9	-73.2	174.1	168.3	0	0	112.7	I1016 K1017 G1024	I1016-E1020 WeakPolarHBondContact O-CG 3.31Å; I1016-E1020 PolarHBondContact O-N 2.96Å; K1017-E1020 WeakPolarHBondContact CD-OE2 3.29Å; K1017-E1020 WeakPolarHBondContact CE-OE2 3.46Å; K1017-E1020 IonicContact NZ-OE1 3.17Å; K1017-E1020 PolarHBondContact NZ-OE1 2.94Å; K1017-E1020 IonicContact NZ-OE2 2.92Å; K1017-E1020 PolarHBondContact NZ-OE2 3.4Å; E1020-G1024 PolarHBondContact O-N 3.47Å
1021	R	67	Low	55.6	Low	198 Å²	198	84.4 Å²	84.4	75%	0.747	48%	0.481	S	S	*	.	H	α-helix	trans	-73.6	-36.3	177.2	-76.1	176	-175.3	174.3	2.6	112.6	K1017 G1018 V1019 L1023 G1024	K1017-R1021 VanDerWaalsContact O-CG 3.3Å; K1017-R1021 WeakPolarHBondContact O-CG 3.44Å; K1017-R1021 PolarHBondContact O-N 3.27Å; G1018-R1021 PolarHBondContact O-N 2.87Å; V1019-R1021 VanDerWaalsContact C-N 3.27Å; V1019-R1021 PolarHBondContact O-N 3.45Å; R1021-L1023 VanDerWaalsContact C-N 3.29Å; R1021-L1023 PolarHBondContact O-N 3.32Å; R1021-G1024 PolarHBondContact O-N 3.42Å
1022	L	64.2	Low	53.6	Low	60 Å²	60	91.6 Å²	91.6	31%	0.314	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-37.1	177.7	-171.7	67.9	0	0	0	111.3	M965 F970 L990 G1018 V1019	M965-L1022 HydrophobicContact SD-CD1 3.9Å; F970-L1022 HydrophobicContact CD2-CD2 3.88Å; F970-L1022 HydrophobicContact CE2-CB 4.4Å; F970-L1022 HydrophobicContact CE2-CD2 4.26Å; L990-L1022 HydrophobicContact CD1-CD2 4.15Å; L990-L1022 HydrophobicContact CD2-CD2 4.21Å; G1018-L1022 PolarHBondContact O-N 3.32Å; V1019-L1022 PolarHBondContact O-N 2.86Å; V1019-L1022 VanDerWaalsContact O-N 3.15Å
1023	L	57.7	Low	51	Low	125 Å²	125	97.9 Å²	97.9	65%	0.654	54%	0.541	S	S	*	.	H	α-helix	trans	-82.7	-13.3	178.8	-63.1	169.7	0	0	0	113.9	A994 V1019 R1021 G1025	A994-L1023 HydrophobicContact CB-CD1 3.69Å; V1019-L1023 WeakPolarHBondContact O-CG 3.44Å; V1019-L1023 PolarHBondContact O-N 3.46Å; R1021-L1023 VanDerWaalsContact C-N 3.29Å; R1021-L1023 PolarHBondContact O-N 3.32Å; L1023-G1025 PolarHBondContact O-N 3.14Å
1024	G	54.5	Low	49.9	Very low	61 Å²	61	99.6 Å²	99.6	63%	0.629	56%	0.557	S	S	*	*			trans	-91.3	24.9	-173.8	0	0	0	0	0	116.5	E1020 R1021 Q1026	E1020-G1024 PolarHBondContact O-N 3.47Å; R1021-G1024 PolarHBondContact O-N 3.42Å; G1024-Q1026 PolarHBondContact O-N 3.4Å
1025	G	37.8	Very low	47.7	Very low	66 Å²	66	103.3 Å²	103.3	68%	0.68	57%	0.574	S	S	*	*			trans	-72.5	118.8	-170.2	0	0	0	0	0	116.1	L1023	L1023-G1025 PolarHBondContact O-N 3.14Å
1026	Q	33.3	Very low	45.4	Very low	181 Å²	181	111.1 Å²	111.1	85%	0.846	61%	0.61	S	S	*	*			trans	68.5	109.7	171.2	-64	-159.7	-1.6	0	0	119.4	G1024	G1024-Q1026 PolarHBondContact O-N 3.4Å
1027	Q	32	Very low	43.5	Very low	200 Å²	200	115.5 Å²	115.5	94%	0.935	64%	0.642	S	S	*	*				-163.9	142.6	101.7	-101.1	176.5	34.5	0	0	110.6
1028	G	34.7	Very low	41.5	Very low	86 Å²	86	115.8 Å²	115.8	89%	0.887	66%	0.66	S	S	*	*			trans	-112.9	129.3	-177.6	0	0	0	0	0	112.5
1029	G	25.8	Very low	39.8	Very low	74 Å²	74	123.2 Å²	123.2	76%	0.763	70%	0.697	S	S	*	*			trans	177.3	104.6	174.9	0	0	0	0	0	113.3
1030	N	26.3	Very low	38.5	Very low	114 Å²	114	129.7 Å²	129.7	61%	0.61	73%	0.727	S	S	*	*			trans	70.4	108.6	172.1	-151.6	-8.9	0	0	0	117.2	Y1032	N1030-Y1032 VanDerWaalsContact C-N 3.26Å; N1030-Y1032 PolarHBondContact O-N 3.18Å; N1030-Y1032 VanDerWaalsContact O-N 3.12Å
1031	P	31.9	Very low	38	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-12.5	-172.9	-22.4	33.8	0	0	0	117.2
1032	Y	26.7	Very low	37.7	Very low	213 Å²	213	119.2 Å²	119.2	84%	0.835	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	10.6	-169	-91.5	-85.1	0	0	0	115.9	N1030	N1030-Y1032 VanDerWaalsContact C-N 3.26Å; N1030-Y1032 PolarHBondContact O-N 3.18Å; N1030-Y1032 VanDerWaalsContact O-N 3.12Å
1033	L	29.9	Very low	38	Very low	153 Å²	153	120 Å²	120	80%	0.801	70%	0.703	S	S	*	*	S	Bend	trans	-123.4	10.2	177.2	-75.9	178.1	0	0	0	115.6
1034	T	33.6	Very low	38.8	Very low	113 Å²	113	116.4 Å²	116.4	69%	0.693	68%	0.684	S	S	*	*			trans	-136.2	77	178.8	43.1	0	0	0	0	113.3
1035	F	23.7	Very low	40	Very low	193 Å²	193	117.5 Å²	117.5	85%	0.846	67%	0.674	S	S	*	*			trans	-146.9	100	154.9	-104.9	-78	0	0	0	111.3
1036	H	26.8	Very low	42.1	Very low	164 Å²	164	118.6 Å²	118.6	76%	0.759	67%	0.665	S	S	*	*			trans	160.8	67.2	139.5	-89.9	-67.1	0	0	0	111.5
1037	C	30.3	Very low	44.7	Very low	120 Å²	120	110.9 Å²	110.9	81%	0.811	63%	0.629	S	S	*	*			trans	-124.1	74.6	162.7	-86.4	0	0	0	0	109.7
1038	A	29.4	Very low	47.3	Very low	90 Å²	90	104.2 Å²	104.2	74%	0.744	61%	0.605	S	S	*	*	S	Bend	trans	-146.7	47.4	171	0	0	0	0	0	110.2
1039	N	34.8	Very low	49.8	Very low	165 Å²	165	103.7 Å²	103.7	88%	0.882	59%	0.586	S	S	*	*			trans	-168.3	67.7	166.4	-106	-23.9	0	0	0	107.7	G1041	N1039-G1041 PolarHBondContact O-N 3.45Å
1040	Q	44.1	Very low	52.6	Low	142 Å²	142	106.9 Å²	106.9	66%	0.664	59%	0.585	S	S	*	*			trans	-72.4	94.7	-179.6	-71.7	-171.8	0.8	0	0	110.5
1041	G	53.1	Low	55.7	Low	39 Å²	39	104.5 Å²	104.5	40%	0.402	57%	0.573	S	S	.	*	S	Bend	trans	-81.2	-41	163.1	0	0	0	0	0	112.1	N1039 N1091	N1039-G1041 PolarHBondContact O-N 3.45Å; G1041-N1091 VanDerWaalsContact O-CA 3.25Å; G1041-N1091 WeakPolarHBondContact O-CA 3.14Å; G1041-N1091 VanDerWaalsContact O-CB 3.31Å; G1041-N1091 WeakPolarHBondContact O-CB 3.42Å; G1041-N1091 PolarHBondContact O-ND2 3.06Å; G1041-N1091 PolarHBondContact O-OD1 2.79Å
1042	T	60.6	Low	58.4	Low	32 Å²	32	107.6 Å²	107.6	20%	0.196	58%	0.575	C	S	.	*			trans	-125.2	128.8	-174.5	-48	0	0	0	0	110.6	V1089 V1090 N1091 I1129	T1042-V1089 HydrophobicContact CG2-CG1 3.6Å; T1042-V1090 CarbonylContact C-O 3.32Å; T1042-V1090 WeakPolarHBondContact CA-O 3.14Å; T1042-N1091 HydrophobicContact CG2-CB 4.29Å; T1042-N1091 PolarHBondContact OG1-ND2 3.46Å; T1042-I1129 VanDerWaalsContact CB-O 3.27Å; T1042-I1129 WeakPolarHBondContact CB-O 3.24Å; T1042-I1129 HydrophobicContact CG2-CG2 4.44Å; T1042-I1129 PolarHBondContact OG1-O 3.11Å
1043	I	71.2	Confident	61.2	Low	77 Å²	77	99.9 Å²	99.9	40%	0.395	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.9	169	-61	171.3	0	0	0	108	I1045 V1090	I1043-I1045 HydrophobicContact CG2-CG1 4.1Å; I1043-V1090 HydrophobicContact CB-CB 4.39Å; I1043-V1090 PolarHBondContact N-O 2.95Å; I1043-V1090 PolarHBondContact O-N 3.12Å
1044	L	74.7	Confident	64.1	Low	49 Å²	49	93.1 Å²	93.1	26%	0.257	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.6	169	-65.7	-178.8	0	0	0	108.8	Q1087 K1088 V1089 I1129 L1241	L1044-Q1087 HydrophobicContact CB-CB 4.39Å; L1044-K1088 WeakPolarHBondContact CA-O 3.19Å; L1044-V1089 HydrophobicContact CD2-CB 4.44Å; L1044-V1089 HydrophobicContact CD2-CG2 3.85Å; L1044-I1129 HydrophobicContact CD1-CG2 4.02Å; L1044-I1129 HydrophobicContact CD2-CD1 4.36Å; L1044-I1129 HydrophobicContact CD2-CG2 3.91Å; L1044-I1129 HydrophobicContact CG-CG2 4.13Å; L1044-L1241 HydrophobicContact CD1-CD2 4.01Å
1045	I	80.3	Confident	66.9	Low	84 Å²	84	92.3 Å²	92.3	43%	0.431	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.3	176.2	-55.4	-179.9	0	0	0	108.2	I1043 L1047 Q1087 K1088 V1090	I1043-I1045 HydrophobicContact CG2-CG1 4.1Å; I1045-L1047 PolarHBondContact O-N 3.22Å; I1045-Q1087 CarbonylContact O-C 3.55Å; I1045-Q1087 VanDerWaalsContact O-CA 3.28Å; I1045-Q1087 WeakPolarHBondContact O-CA 3.22Å; I1045-K1088 HydrophobicContact CB-CB 4.38Å; I1045-K1088 PolarHBondContact N-O 3.35Å; I1045-K1088 PolarHBondContact O-N 3.44Å; I1045-V1090 HydrophobicContact CD1-CG2 3.76Å; I1045-V1090 HydrophobicContact CG1-CG2 4.22Å
1046	D	81.7	Confident	70	Confident	90 Å²	90	86.3 Å²	86.3	48%	0.481	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.2	177.3	-65.6	-12.8	0	0	0	109.8	K1085 Q1087	D1046-K1085 WeakPolarHBondContact OD1-CE 3.13Å; D1046-K1085 IonicContact OD1-NZ 3.91Å; D1046-K1085 PolarHBondContact OD1-NZ 3.11Å; D1046-K1085 WeakPolarHBondContact OD2-CE 3.41Å; D1046-K1085 IonicContact OD2-NZ 2.7Å; D1046-K1085 PolarHBondContact OD2-NZ 2.85Å; D1046-Q1087 WeakPolarHBondContact OD1-CG 3.4Å; D1046-Q1087 PolarHBondContact OD1-NE2 2.09Å
1047	L	87.1	Confident	72.8	Confident	18 Å²	18	78.7 Å²	78.7	9%	0.094	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-85.8	135.9	174.2	-60.4	-177.5	0	0	0	109.6	I1045 E1053 Y1054 I1086 K1088 Y1240	I1045-L1047 PolarHBondContact O-N 3.22Å; L1047-E1053 HydrophobicContact CD1-CB 4.22Å; L1047-E1053 HydrophobicContact CD1-CG 3.92Å; L1047-Y1054 HydrophobicContact CB-CD2 4.03Å; L1047-Y1054 WeakPolarHBondContact O-CD2 3.2Å; L1047-I1086 HydrophobicContact CD1-CG2 4.01Å; L1047-I1086 PolarHBondContact N-O 2.76Å; L1047-K1088 HydrophobicContact CD1-CB 4.44Å; L1047-K1088 HydrophobicContact CD2-CB 4.21Å; L1047-K1088 HydrophobicContact CD2-CD 4.46Å; L1047-K1088 HydrophobicContact CG-CB 4.3Å; L1047-Y1240 HydrophobicContact CD1-CD1 4.24Å; L1047-Y1240 HydrophobicContact CD1-CE1 4.21Å
1048	S	86.8	Confident	75.5	Confident	60 Å²	60	75.4 Å²	75.4	42%	0.42	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-72.2	144	174.1	-175.2	0	0	0	0	110.5	D1050 D1051 Y1054	S1048-D1050 PolarHBondContact O-N 2.83Å; S1048-D1050 VanDerWaalsContact O-N 3.16Å; S1048-D1050 PolarHBondContact OG-N 3.02Å; S1048-D1051 WeakPolarHBondContact O-CB 3.21Å; S1048-D1051 PolarHBondContact O-N 3.41Å; S1048-Y1054 WeakPolarHBondContact O-CB 3.46Å
1049	P	86.9	Confident	78.2	Confident	76 Å²	76	78 Å²	78	49%	0.494	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.3	172.2	-25.9	36.1	0	0	0	114.6	D1051 Y1054 Q1055	P1049-D1051 VanDerWaalsContact C-N 3.28Å; P1049-Y1054 HydrophobicContact CB-CD1 4.5Å; P1049-Y1054 HydrophobicContact CB-CE1 4.32Å; P1049-Y1054 HydrophobicContact CG-CE2 4.35Å; P1049-Q1055 WeakPolarHBondContact O-CG 3.24Å; P1049-Q1055 PolarHBondContact O-NE2 3.03Å
1050	D	85.6	Confident	80.5	Confident	140 Å²	140	73.2 Å²	73.2	75%	0.749	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-7.6	174.8	-59.7	-48.1	0	0	0	113.2	S1048	S1048-D1050 PolarHBondContact O-N 2.83Å; S1048-D1050 VanDerWaalsContact O-N 3.16Å; S1048-D1050 PolarHBondContact OG-N 3.02Å
1051	D	91	Very high	82.2	Confident	65 Å²	65	66.5 Å²	66.5	35%	0.348	36%	0.356	S	S	.	.	S	Bend	trans	-74.6	134.6	176.8	-163.5	-29.8	0	0	0	110.6	S1048 P1049 E1053 Y1054 Q1055	S1048-D1051 WeakPolarHBondContact O-CB 3.21Å; S1048-D1051 PolarHBondContact O-N 3.41Å; P1049-D1051 VanDerWaalsContact C-N 3.28Å; D1051-E1053 PolarHBondContact O-N 3.29Å; D1051-E1053 PolarHBondContact OD1-N 3.39Å; D1051-Y1054 WeakPolarHBondContact O-CB 3.41Å; D1051-Y1054 PolarHBondContact O-N 3.47Å; D1051-Y1054 VanDerWaalsContact O-N 3.14Å; D1051-Q1055 WeakPolarHBondContact O-CG 3.21Å; D1051-Q1055 PolarHBondContact O-N 3.29Å
1052	K	87.4	Confident	83.7	Confident	176 Å²	176	65.5 Å²	65.5	77%	0.765	34%	0.341	S	S	*	.	H	α-helix	trans	-61.4	-30.7	174.4	-65.7	-176.2	178.1	-178.7	0	111.9	S1056	K1052-S1056 WeakPolarHBondContact O-CB 3.13Å; K1052-S1056 PolarHBondContact O-N 3Å
1053	E	87.1	Confident	84.5	Confident	51 Å²	51	68.1 Å²	68.1	24%	0.238	36%	0.361	C	S	.	.	H	α-helix	trans	-68.8	-40.6	175.6	-168.6	169.3	-170.3	0	0	111.3	L1047 D1051 V1057 K1088 Y1240	L1047-E1053 HydrophobicContact CD1-CB 4.22Å; L1047-E1053 HydrophobicContact CD1-CG 3.92Å; D1051-E1053 PolarHBondContact O-N 3.29Å; D1051-E1053 PolarHBondContact OD1-N 3.39Å; E1053-V1057 VanDerWaalsContact O-CG2 3.3Å; E1053-V1057 WeakPolarHBondContact O-CG2 3.37Å; E1053-V1057 PolarHBondContact O-N 2.88Å; E1053-V1057 VanDerWaalsContact O-N 3.15Å; E1053-K1088 WeakPolarHBondContact OE1-CE 3.41Å; E1053-K1088 IonicContact OE1-NZ 3.57Å; E1053-K1088 PolarHBondContact OE1-NZ 3.25Å; E1053-K1088 IonicContact OE2-NZ 2.74Å; E1053-K1088 PolarHBondContact OE2-NZ 2.91Å; E1053-Y1240 HydrophobicContact CG-CE1 4.26Å; E1053-Y1240 WeakPolarHBondContact OE1-CE1 3.3Å; E1053-Y1240 PolarHBondContact OE1-OH 2.97Å
1054	Y	91.1	Very high	84.4	Confident	12 Å²	12	66.5 Å²	66.5	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-51.2	172.9	-174.8	-72.2	0	0	0	110.8	L1047 S1048 P1049 D1051 S1056 V1057 E1058 I1083 I1086	L1047-Y1054 HydrophobicContact CB-CD2 4.03Å; L1047-Y1054 WeakPolarHBondContact O-CD2 3.2Å; S1048-Y1054 WeakPolarHBondContact O-CB 3.46Å; P1049-Y1054 HydrophobicContact CB-CD1 4.5Å; P1049-Y1054 HydrophobicContact CB-CE1 4.32Å; P1049-Y1054 HydrophobicContact CG-CE2 4.35Å; D1051-Y1054 WeakPolarHBondContact O-CB 3.41Å; D1051-Y1054 PolarHBondContact O-N 3.47Å; D1051-Y1054 VanDerWaalsContact O-N 3.14Å; Y1054-S1056 VanDerWaalsContact C-N 3.33Å; Y1054-S1056 PolarHBondContact O-N 2.86Å; Y1054-V1057 PolarHBondContact O-N 3.42Å; Y1054-E1058 HydrophobicContact CD1-CB 4.49Å; Y1054-E1058 HydrophobicContact CE1-CB 4.36Å; Y1054-E1058 PolarHBondContact O-N 3.37Å; Y1054-I1083 WeakPolarHBondContact OH-CG2 3.47Å; Y1054-I1086 HydrophobicContact CD1-CD1 4.03Å; Y1054-I1086 HydrophobicContact CD2-CB 3.77Å; Y1054-I1086 HydrophobicContact CD2-CD1 3.9Å; Y1054-I1086 HydrophobicContact CD2-CG1 3.93Å; Y1054-I1086 HydrophobicContact CE1-CD1 4.07Å; Y1054-I1086 HydrophobicContact CE2-CB 3.84Å; Y1054-I1086 HydrophobicContact CE2-CD1 3.95Å; Y1054-I1086 HydrophobicContact CE2-CG1 3.69Å; Y1054-I1086 HydrophobicContact CG-CD1 3.92Å; Y1054-I1086 HydrophobicContact CG-CG1 4.47Å
1055	Q	90.9	Very high	84.2	Confident	95 Å²	95	65.3 Å²	65.3	44%	0.444	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-40.6	-176.9	-69	170.6	10.2	0	0	112	P1049 D1051 E1058 E1059	P1049-Q1055 WeakPolarHBondContact O-CG 3.24Å; P1049-Q1055 PolarHBondContact O-NE2 3.03Å; D1051-Q1055 WeakPolarHBondContact O-CG 3.21Å; D1051-Q1055 PolarHBondContact O-N 3.29Å; Q1055-E1058 PolarHBondContact O-N 3.13Å; Q1055-E1059 WeakPolarHBondContact O-CB 3.45Å; Q1055-E1059 PolarHBondContact O-N 3.4Å
1056	S	89.1	Confident	83.6	Confident	67 Å²	67	70.5 Å²	70.5	47%	0.469	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-43.3	175.7	-172.5	0	0	0	0	112.5	K1052 Y1054 E1059 E1060	K1052-S1056 WeakPolarHBondContact O-CB 3.13Å; K1052-S1056 PolarHBondContact O-N 3Å; Y1054-S1056 VanDerWaalsContact C-N 3.33Å; Y1054-S1056 PolarHBondContact O-N 2.86Å; S1056-E1059 PolarHBondContact O-N 3.23Å; S1056-E1060 VanDerWaalsContact O-CB 3.32Å; S1056-E1060 WeakPolarHBondContact O-CB 3.13Å; S1056-E1060 PolarHBondContact O-N 3.26Å
1057	V	85.1	Confident	83	Confident	4 Å²	4	71.3 Å²	71.3	2%	0.024	36%	0.363	C	S	.	.	H	α-helix	trans	-71.1	-36.4	179.8	175.7	0	0	0	0	111	E1053 Y1054 M1061 I1086 Y1240 I1242	E1053-V1057 VanDerWaalsContact O-CG2 3.3Å; E1053-V1057 WeakPolarHBondContact O-CG2 3.37Å; E1053-V1057 PolarHBondContact O-N 2.88Å; E1053-V1057 VanDerWaalsContact O-N 3.15Å; Y1054-V1057 PolarHBondContact O-N 3.42Å; V1057-M1061 WeakPolarHBondContact O-CB 3.41Å; V1057-M1061 PolarHBondContact O-N 3.05Å; V1057-I1086 HydrophobicContact CB-CD1 4.04Å; V1057-I1086 HydrophobicContact CG1-CD1 3.95Å; V1057-I1086 HydrophobicContact CG1-CG2 4.2Å; V1057-Y1240 HydrophobicContact CB-CD2 4.49Å; V1057-Y1240 HydrophobicContact CG1-CD2 3.93Å; V1057-Y1240 HydrophobicContact CG1-CE2 4.47Å; V1057-Y1240 HydrophobicContact CG1-CG 4.36Å; V1057-Y1240 HydrophobicContact CG2-CD2 3.65Å; V1057-Y1240 HydrophobicContact CG2-CE1 4.3Å; V1057-Y1240 HydrophobicContact CG2-CE2 3.37Å; V1057-Y1240 HydrophobicContact CG2-CG 4.29Å; V1057-I1242 HydrophobicContact CG1-CD1 3.7Å; V1057-I1242 HydrophobicContact CG1-CG1 4.44Å
1058	E	87.6	Confident	82	Confident	51 Å²	51	73.2 Å²	73.2	24%	0.238	37%	0.371	C	S	.	.	H	α-helix	trans	-64.4	-48.6	171.4	175.1	163.8	-150.9	0	0	111.6	Y1054 Q1055 E1060 M1061 Q1062 I1083 I1086	Y1054-E1058 HydrophobicContact CD1-CB 4.49Å; Y1054-E1058 HydrophobicContact CE1-CB 4.36Å; Y1054-E1058 PolarHBondContact O-N 3.37Å; Q1055-E1058 PolarHBondContact O-N 3.13Å; E1058-E1060 PolarHBondContact O-N 3.05Å; E1058-M1061 PolarHBondContact O-N 3.38Å; E1058-Q1062 HydrophobicContact CG-CG 3.73Å; E1058-Q1062 WeakPolarHBondContact O-CB 3.33Å; E1058-Q1062 WeakPolarHBondContact O-CG 3.38Å; E1058-Q1062 PolarHBondContact O-N 3.47Å; E1058-Q1062 PolarHBondContact OE1-NE2 3.31Å; E1058-Q1062 VanDerWaalsContact OE1-NE2 3.09Å; E1058-I1083 HydrophobicContact CG-CG1 3.91Å; E1058-I1083 WeakPolarHBondContact OE1-CG1 3.18Å; E1058-I1086 HydrophobicContact CB-CD1 4.34Å
1059	E	86.5	Confident	80.9	Confident	144 Å²	144	78.6 Å²	78.6	67%	0.673	38%	0.382	S	S	*	.	H	α-helix	trans	-61.9	-43.9	-179.3	-173.8	174.1	-164.4	0	0	111.7	Q1055 S1056 M1061 Q1062 S1063	Q1055-E1059 WeakPolarHBondContact O-CB 3.45Å; Q1055-E1059 PolarHBondContact O-N 3.4Å; S1056-E1059 PolarHBondContact O-N 3.23Å; E1059-M1061 VanDerWaalsContact C-N 3.35Å; E1059-M1061 PolarHBondContact O-N 3.09Å; E1059-Q1062 PolarHBondContact O-N 3.4Å; E1059-S1063 WeakPolarHBondContact O-CB 3.04Å; E1059-S1063 PolarHBondContact O-N 2.67Å; E1059-S1063 PolarHBondContact O-OG 2.91Å
1060	E	81.9	Confident	79.6	Confident	66 Å²	66	76.7 Å²	76.7	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-63.4	-38.6	175.8	-176.1	169.8	-169.7	0	0	112	S1056 E1058 S1063 T1064 F1187 M1204	S1056-E1060 VanDerWaalsContact O-CB 3.32Å; S1056-E1060 WeakPolarHBondContact O-CB 3.13Å; S1056-E1060 PolarHBondContact O-N 3.26Å; E1058-E1060 PolarHBondContact O-N 3.05Å; E1060-S1063 PolarHBondContact O-OG 3.21Å; E1060-T1064 PolarHBondContact O-OG1 3.22Å; E1060-F1187 HydrophobicContact CG-CZ 4.42Å; E1060-F1187 WeakPolarHBondContact OE2-CZ 3.46Å; E1060-M1204 HydrophobicContact CG-CE 3.8Å
1061	M	80.1	Confident	78.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.8	-42.2	175.4	179.7	168.8	163.6	0	0	113	V1057 E1058 E1059 T1064 I1065 Y1081 I1083 F1119 M1185 I1242 Y1244	V1057-M1061 WeakPolarHBondContact O-CB 3.41Å; V1057-M1061 PolarHBondContact O-N 3.05Å; E1058-M1061 PolarHBondContact O-N 3.38Å; E1059-M1061 VanDerWaalsContact C-N 3.35Å; E1059-M1061 PolarHBondContact O-N 3.09Å; M1061-T1064 PolarHBondContact O-OG1 2.81Å; M1061-I1065 WeakPolarHBondContact O-CG1 3.32Å; M1061-Y1081 HydrophobicContact CE-CD2 3.44Å; M1061-Y1081 VanDerWaalsContact CE-CD2 3.44Å; M1061-Y1081 HydrophobicContact CE-CE2 4.12Å; M1061-Y1081 HydrophobicContact CE-CG 4.28Å; M1061-I1083 HydrophobicContact CE-CD1 3.48Å; M1061-I1083 VanDerWaalsContact CE-CD1 3.48Å; M1061-I1083 HydrophobicContact SD-CD1 3.75Å; M1061-F1119 HydrophobicContact CB-CE1 3.73Å; M1061-F1119 HydrophobicContact CB-CZ 3.56Å; M1061-F1119 HydrophobicContact CG-CD1 4.45Å; M1061-F1119 HydrophobicContact CG-CE1 3.77Å; M1061-F1119 HydrophobicContact CG-CZ 4Å; M1061-F1119 HydrophobicContact SD-CE1 3.98Å; M1061-M1185 HydrophobicContact CE-CE 3.4Å; M1061-M1185 HydrophobicContact CE-CG 4.43Å; M1061-M1185 HydrophobicContact CE-SD 3.61Å; M1061-M1185 HydrophobicContact SD-SD 4.04Å; M1061-I1242 HydrophobicContact CE-CG2 4.05Å; M1061-I1242 HydrophobicContact SD-CB 4.3Å; M1061-I1242 HydrophobicContact SD-CD1 3.58Å; M1061-I1242 VanDerWaalsContact SD-CD1 3.58Å; M1061-I1242 HydrophobicContact SD-CG2 3.66Å; M1061-Y1244 HydrophobicContact CE-CD1 4.12Å; M1061-Y1244 HydrophobicContact CE-CD2 4.48Å; M1061-Y1244 HydrophobicContact CE-CG 3.97Å
1062	Q	84.1	Confident	76.4	Confident	18 Å²	18	73.6 Å²	73.6	8%	0.084	39%	0.385	C	S	.	.	H	α-helix	trans	-76.8	-38.4	-175.5	-62.7	-84.8	24.5	0	0	111.8	E1058 E1059 T1064 I1065 Y1081	E1058-Q1062 HydrophobicContact CG-CG 3.73Å; E1058-Q1062 WeakPolarHBondContact O-CB 3.33Å; E1058-Q1062 WeakPolarHBondContact O-CG 3.38Å; E1058-Q1062 PolarHBondContact O-N 3.47Å; E1058-Q1062 PolarHBondContact OE1-NE2 3.31Å; E1058-Q1062 VanDerWaalsContact OE1-NE2 3.09Å; E1059-Q1062 PolarHBondContact O-N 3.4Å; Q1062-T1064 PolarHBondContact O-N 3.42Å; Q1062-T1064 VanDerWaalsContact O-N 3.13Å; Q1062-I1065 PolarHBondContact O-N 3.02Å; Q1062-Y1081 PolarHBondContact NE2-O 3.04Å; Q1062-Y1081 PolarHBondContact OE1-O 3.44Å
1063	S	78.6	Confident	74.8	Confident	88 Å²	88	71 Å²	71	62%	0.615	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.9	-179.8	58.3	0	0	0	0	114.3	E1059 E1060	E1059-S1063 WeakPolarHBondContact O-CB 3.04Å; E1059-S1063 PolarHBondContact O-N 2.67Å; E1059-S1063 PolarHBondContact O-OG 2.91Å; E1060-S1063 PolarHBondContact O-OG 3.21Å
1064	T	69	Low	73.4	Confident	42 Å²	42	72 Å²	72	26%	0.258	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-4.5	-175.3	51.3	0	0	0	0	114.5	E1060 M1061 Q1062 M1204 H1206	E1060-T1064 PolarHBondContact O-OG1 3.22Å; M1061-T1064 PolarHBondContact O-OG1 2.81Å; Q1062-T1064 PolarHBondContact O-N 3.42Å; Q1062-T1064 VanDerWaalsContact O-N 3.13Å; T1064-M1204 HydrophobicContact CG2-CE 3.32Å; T1064-H1206 VanDerWaalsContact CB-NE2 3.28Å; T1064-H1206 WeakPolarHBondContact CB-NE2 3.34Å; T1064-H1206 PolarHBondContact OG1-CE1 3.21Å; T1064-H1206 PolarHBondContact OG1-NE2 3.42Å; T1064-H1206 VanDerWaalsContact OG1-NE2 3.11Å
1065	I	71.3	Confident	72.1	Confident	25 Å²	25	72.4 Å²	72.4	13%	0.128	40%	0.404	C	S	.	.			trans	-68.6	136.4	167.4	-55.3	164.9	0	0	0	109.4	M1061 Q1062 F1078 S1079 Y1081	M1061-I1065 WeakPolarHBondContact O-CG1 3.32Å; Q1062-I1065 PolarHBondContact O-N 3.02Å; I1065-F1078 HydrophobicContact CG2-CE2 4.28Å; I1065-S1079 WeakPolarHBondContact CG2-O 3.41Å; I1065-Y1081 HydrophobicContact CD1-CD1 4.41Å; I1065-Y1081 HydrophobicContact CD1-CD2 3.24Å; I1065-Y1081 HydrophobicContact CD1-CE2 3.67Å; I1065-Y1081 HydrophobicContact CD1-CG 3.67Å; I1065-Y1081 HydrophobicContact CG1-CD2 3.9Å; I1065-Y1081 HydrophobicContact CG1-CE2 3.8Å
1066	R	67.7	Low	71.1	Confident	193 Å²	193	69 Å²	69	73%	0.728	39%	0.394	S	S	*	.			trans	-113.3	158.6	169.3	-66.6	-177.6	171.7	-153	-9.5	109.7	H1068	R1066-H1068 PolarHBondContact O-N 3.37Å; R1066-H1068 VanDerWaalsContact O-N 3.14Å
1067	E	68.5	Low	70.3	Confident	107 Å²	107	68 Å²	68	50%	0.5	39%	0.386	S	S	.	.			trans	-58	119.7	172.4	-168.6	-167.9	174.1	0	0	109.9	R1069 V1077 F1078	E1067-R1069 VanDerWaalsContact CD-NH2 3.35Å; E1067-R1069 IonicContact OE1-CZ 2.74Å; E1067-R1069 IonicContact OE1-NE 3.16Å; E1067-R1069 PolarHBondContact OE1-NE 3.45Å; E1067-R1069 IonicContact OE1-NH2 3.83Å; E1067-R1069 PolarHBondContact OE1-NH2 3.43Å; E1067-R1069 IonicContact OE2-CZ 2.85Å; E1067-R1069 IonicContact OE2-NE 3.98Å; E1067-R1069 IonicContact OE2-NH2 3.37Å; E1067-R1069 PolarHBondContact OE2-NH2 2.85Å; E1067-V1077 HydrophobicContact CG-CG1 3.88Å; E1067-V1077 WeakPolarHBondContact OE1-CG1 3.3Å; E1067-F1078 WeakPolarHBondContact CA-O 3.47Å
1068	H	66.2	Low	69.9	Low	58 Å²	58	68 Å²	68	27%	0.269	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.7	178.9	179.9	-79.9	0	0	0	109.2	R1066 V1077 F1078	R1066-H1068 PolarHBondContact O-N 3.37Å; R1066-H1068 VanDerWaalsContact O-N 3.14Å; H1068-V1077 VanDerWaalsContact O-CA 3.31Å; H1068-V1077 WeakPolarHBondContact O-CA 3.3Å; H1068-F1078 HydrophobicContact CB-CD1 4.09Å; H1068-F1078 HydrophobicContact CB-CE1 3.46Å; H1068-F1078 VanDerWaalsContact CB-CE1 3.46Å; H1068-F1078 HydrophobicContact CB-CE2 3.93Å; H1068-F1078 HydrophobicContact CB-CZ 3.32Å; H1068-F1078 AromaticContact CG-CE1 3.52Å; H1068-F1078 AromaticContact CG-CZ 3.61Å; H1068-F1078 PolarHBondContact N-O 3.39Å; H1068-F1078 AromaticContact ND1-CE1 3.45Å; H1068-F1078 WeakPolarHBondContact ND1-CE1 3.32Å; H1068-F1078 PolarHBondContact O-N 3Å
1069	R	64.3	Low	69.5	Low	172 Å²	172	68.9 Å²	68.9	65%	0.649	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	107.6	175.6	-58.4	-170.6	178.1	172.9	5.5	108.8	E1067 V1077	E1067-R1069 VanDerWaalsContact CD-NH2 3.35Å; E1067-R1069 IonicContact OE1-CZ 2.74Å; E1067-R1069 IonicContact OE1-NE 3.16Å; E1067-R1069 PolarHBondContact OE1-NE 3.45Å; E1067-R1069 IonicContact OE1-NH2 3.83Å; E1067-R1069 PolarHBondContact OE1-NH2 3.43Å; E1067-R1069 IonicContact OE2-CZ 2.85Å; E1067-R1069 IonicContact OE2-NE 3.98Å; E1067-R1069 IonicContact OE2-NH2 3.37Å; E1067-R1069 PolarHBondContact OE2-NH2 2.85Å; R1069-V1077 HydrophobicContact CG-CG1 4.13Å; R1069-V1077 HydrophobicContact CG-CG2 3.99Å
1070	D	58.4	Low	69.3	Low	36 Å²	36	68.1 Å²	68.1	19%	0.193	39%	0.388	C	S	.	.			trans	-70.5	132.6	169.7	-146.2	-30.6	0	0	0	108.4	G1072 R1176	D1070-G1072 PolarHBondContact O-N 3.17Å; D1070-R1176 IonicContact OD1-NH1 3.77Å; D1070-R1176 WeakPolarHBondContact OD2-CB 3.08Å; D1070-R1176 WeakPolarHBondContact OD2-CD 3.47Å
1071	G	54.5	Low	69.5	Low	70 Å²	70	65.4 Å²	65.4	72%	0.722	38%	0.375	S	S	*	.			trans	-75.5	49.1	-158.4	0	0	0	0	0	116.4	N1073	G1071-N1073 VanDerWaalsContact C-N 3.29Å; G1071-N1073 PolarHBondContact O-N 2.91Å
1072	G	55.3	Low	70	Confident	71 Å²	71	68.5 Å²	68.5	73%	0.732	39%	0.391	S	S	*	.	S	Bend	trans	85	-12.4	179.6	0	0	0	0	0	115.2	D1070 A1074	D1070-G1072 PolarHBondContact O-N 3.17Å; G1072-A1074 PolarHBondContact O-N 3.03Å
1073	N	53.8	Low	70.3	Confident	121 Å²	121	68.3 Å²	68.3	65%	0.647	39%	0.39	S	S	*	.	S	Bend	trans	-96.3	86.6	-178.1	-73.2	-28.2	0	0	0	111.9	G1071 G1075	G1071-N1073 VanDerWaalsContact C-N 3.29Å; G1071-N1073 PolarHBondContact O-N 2.91Å; N1073-G1075 VanDerWaalsContact C-N 3.28Å; N1073-G1075 PolarHBondContact O-N 2.82Å; N1073-G1075 VanDerWaalsContact O-N 3.16Å
1074	A	57.8	Low	70.8	Confident	73 Å²	73	67.7 Å²	67.7	60%	0.603	38%	0.38	S	S	*	.	S	Bend	trans	60.1	19.9	168.3	0	0	0	0	0	117.5	G1072 D1175	G1072-A1074 PolarHBondContact O-N 3.03Å; A1074-D1175 WeakPolarHBondContact O-CA 3.32Å
1075	G	63.3	Low	71.8	Confident	19 Å²	19	69 Å²	69	20%	0.196	38%	0.382	C	S	.	.			trans	-131.8	154.8	170.7	0	0	0	0	0	111.6	N1073	N1073-G1075 VanDerWaalsContact C-N 3.28Å; N1073-G1075 PolarHBondContact O-N 2.82Å; N1073-G1075 VanDerWaalsContact O-N 3.16Å
1076	G	69	Low	72.7	Confident	23 Å²	23	67.8 Å²	67.8	24%	0.237	38%	0.375	C	S	.	.			trans	-103.8	-171.7	177.5	0	0	0	0	0	114.8	S1177 Y1179	G1076-S1177 PolarHBondContact O-OG 3.46Å; G1076-Y1179 VanDerWaalsContact C-OH 3.23Å; G1076-Y1179 VanDerWaalsContact CA-OH 3.25Å; G1076-Y1179 WeakPolarHBondContact CA-OH 3.4Å
1077	V	73.4	Confident	73.6	Confident	48 Å²	48	59.6 Å²	59.6	29%	0.291	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	146.3	178	-175.5	0	0	0	0	110.7	E1067 H1068 R1069 Y1179 P1249	E1067-V1077 HydrophobicContact CG-CG1 3.88Å; E1067-V1077 WeakPolarHBondContact OE1-CG1 3.3Å; H1068-V1077 VanDerWaalsContact O-CA 3.31Å; H1068-V1077 WeakPolarHBondContact O-CA 3.3Å; R1069-V1077 HydrophobicContact CG-CG1 4.13Å; R1069-V1077 HydrophobicContact CG-CG2 3.99Å; V1077-Y1179 PolarHBondContact N-OH 2.88Å; V1077-Y1179 PolarHBondContact O-OH 3.11Å; V1077-P1249 HydrophobicContact CB-CG 4.13Å; V1077-P1249 HydrophobicContact CG1-CG 4.32Å; V1077-P1249 WeakPolarHBondContact O-CD 3.31Å; V1077-P1249 WeakPolarHBondContact O-CG 3.36Å
1078	F	77.5	Confident	74.3	Confident	3 Å²	3	57.4 Å²	57.4	1%	0.013	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	160.7	164.9	68.6	-89	0	0	0	111.3	I1065 E1067 H1068 Y1081 Y1179 P1209 I1246 L1247	I1065-F1078 HydrophobicContact CG2-CE2 4.28Å; E1067-F1078 WeakPolarHBondContact CA-O 3.47Å; H1068-F1078 HydrophobicContact CB-CD1 4.09Å; H1068-F1078 HydrophobicContact CB-CE1 3.46Å; H1068-F1078 VanDerWaalsContact CB-CE1 3.46Å; H1068-F1078 HydrophobicContact CB-CE2 3.93Å; H1068-F1078 HydrophobicContact CB-CZ 3.32Å; H1068-F1078 AromaticContact CG-CE1 3.52Å; H1068-F1078 AromaticContact CG-CZ 3.61Å; H1068-F1078 PolarHBondContact N-O 3.39Å; H1068-F1078 AromaticContact ND1-CE1 3.45Å; H1068-F1078 WeakPolarHBondContact ND1-CE1 3.32Å; H1068-F1078 PolarHBondContact O-N 3Å; F1078-Y1081 AromaticContact CD2-CE1 3.86Å; F1078-Y1081 HydrophobicContact CD2-CE1 3.86Å; F1078-Y1081 AromaticContact CE2-CE1 3.61Å; F1078-Y1081 HydrophobicContact CE2-CE1 3.61Å; F1078-Y1081 AromaticContact CE2-CZ 3.93Å; F1078-Y1081 HydrophobicContact CZ-CE1 4.38Å; F1078-Y1179 HydrophobicContact CB-CE1 4.39Å; F1078-P1209 HydrophobicContact CE1-CG 3.52Å; F1078-P1209 HydrophobicContact CE2-CG 4.06Å; F1078-P1209 HydrophobicContact CZ-CG 3.2Å; F1078-I1246 HydrophobicContact CB-CG2 3.51Å; F1078-I1246 HydrophobicContact CD1-CG2 3.77Å; F1078-I1246 HydrophobicContact CD2-CG2 4.12Å; F1078-I1246 HydrophobicContact CG-CG2 3.51Å; F1078-L1247 WeakPolarHBondContact CB-O 3.31Å
1079	S	77.7	Confident	75	Confident	69 Å²	69	54.8 Å²	54.8	48%	0.483	32%	0.322	S	S	.	.	S	Bend	trans	-141.9	0.7	177.4	56.1	0	0	0	0	114	I1065	I1065-S1079 WeakPolarHBondContact CG2-O 3.41Å
1080	R	82.4	Confident	75.5	Confident	129 Å²	129	49.4 Å²	49.4	49%	0.487	31%	0.308	S	S	.	.			trans	-149.9	156.6	-179.1	-160.9	178.1	174.8	82.9	4.1	110.9	L1247	R1080-L1247 HydrophobicContact CB-CD1 4.09Å; R1080-L1247 HydrophobicContact CG-CD1 4.08Å; R1080-L1247 PolarHBondContact O-N 2.77Å
1081	Y	87.4	Confident	76.1	Confident	9 Å²	9	48.2 Å²	48.2	4%	0.035	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.2	171.1	-63.4	-36.6	0	0	0	110.9	M1061 Q1062 I1065 F1078 M1185 P1209 Y1244 Q1245 I1246	M1061-Y1081 HydrophobicContact CE-CD2 3.44Å; M1061-Y1081 VanDerWaalsContact CE-CD2 3.44Å; M1061-Y1081 HydrophobicContact CE-CE2 4.12Å; M1061-Y1081 HydrophobicContact CE-CG 4.28Å; Q1062-Y1081 PolarHBondContact NE2-O 3.04Å; Q1062-Y1081 PolarHBondContact OE1-O 3.44Å; I1065-Y1081 HydrophobicContact CD1-CD1 4.41Å; I1065-Y1081 HydrophobicContact CD1-CD2 3.24Å; I1065-Y1081 HydrophobicContact CD1-CE2 3.67Å; I1065-Y1081 HydrophobicContact CD1-CG 3.67Å; I1065-Y1081 HydrophobicContact CG1-CD2 3.9Å; I1065-Y1081 HydrophobicContact CG1-CE2 3.8Å; F1078-Y1081 AromaticContact CD2-CE1 3.86Å; F1078-Y1081 HydrophobicContact CD2-CE1 3.86Å; F1078-Y1081 AromaticContact CE2-CE1 3.61Å; F1078-Y1081 HydrophobicContact CE2-CE1 3.61Å; F1078-Y1081 AromaticContact CE2-CZ 3.93Å; F1078-Y1081 HydrophobicContact CZ-CE1 4.38Å; Y1081-M1185 HydrophobicContact CD2-CE 4.31Å; Y1081-M1185 HydrophobicContact CE2-CE 3.9Å; Y1081-P1209 HydrophobicContact CE1-CG 4.47Å; Y1081-Y1244 AromaticContact CD1-CD2 3.55Å; Y1081-Y1244 HydrophobicContact CD1-CD2 3.55Å; Y1081-Y1244 AromaticContact CD1-CE2 3.5Å; Y1081-Y1244 HydrophobicContact CD1-CE2 3.5Å; Y1081-Y1244 VanDerWaalsContact CD1-CE2 3.5Å; Y1081-Y1244 AromaticContact CD2-CD2 3.9Å; Y1081-Y1244 HydrophobicContact CD2-CD2 3.9Å; Y1081-Y1244 HydrophobicContact CD2-CE2 4.06Å; Y1081-Y1244 HydrophobicContact CE1-CD2 4.16Å; Y1081-Y1244 AromaticContact CE1-CE2 3.62Å; Y1081-Y1244 HydrophobicContact CE1-CE2 3.62Å; Y1081-Y1244 HydrophobicContact CE2-CD2 4.47Å; Y1081-Y1244 HydrophobicContact CE2-CE2 4.18Å; Y1081-Y1244 AromaticContact CG-CD2 3.41Å; Y1081-Y1244 HydrophobicContact CG-CD2 3.41Å; Y1081-Y1244 VanDerWaalsContact CG-CD2 3.41Å; Y1081-Y1244 AromaticContact CG-CE2 3.74Å; Y1081-Y1244 HydrophobicContact CG-CE2 3.74Å; Y1081-Y1244 HydrophobicContact CG-CG 4.31Å; Y1081-Y1244 AromaticContact CZ-CE2 3.97Å; Y1081-Q1245 WeakPolarHBondContact CA-O 3.36Å; Y1081-I1246 HydrophobicContact CD1-CG1 4.42Å; Y1081-I1246 HydrophobicContact CE1-CG1 4.26Å
1082	N	89.3	Confident	76.7	Confident	64 Å²	64	52.3 Å²	52.3	34%	0.342	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	107.7	166.6	179.5	28.8	0	0	0	107.5	I1084 Y1244 Q1245 L1247	N1082-I1084 WeakPolarHBondContact ND2-CD1 3.44Å; N1082-I1084 PolarHBondContact O-N 2.85Å; N1082-Y1244 CarbonylContact O-C 3.44Å; N1082-Y1244 WeakPolarHBondContact O-CA 3.18Å; N1082-Y1244 WeakPolarHBondContact O-CB 3.28Å; N1082-Q1245 HydrophobicContact CB-CB 4.22Å; N1082-Q1245 PolarHBondContact N-O 2.92Å; N1082-Q1245 PolarHBondContact O-N 3.31Å; N1082-L1247 HydrophobicContact CB-CD1 4.12Å; N1082-L1247 HydrophobicContact CB-CD2 4.07Å; N1082-L1247 HydrophobicContact CB-CG 3.88Å
1083	I	90.6	Very high	77.2	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.072	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.8	-179	-49.1	-53.9	0	0	0	108.5	Y1054 E1058 M1061 I1086 I1242	Y1054-I1083 WeakPolarHBondContact OH-CG2 3.47Å; E1058-I1083 HydrophobicContact CG-CG1 3.91Å; E1058-I1083 WeakPolarHBondContact OE1-CG1 3.18Å; M1061-I1083 HydrophobicContact CE-CD1 3.48Å; M1061-I1083 VanDerWaalsContact CE-CD1 3.48Å; M1061-I1083 HydrophobicContact SD-CD1 3.75Å; I1083-I1086 HydrophobicContact CG2-CD1 4.15Å; I1083-I1086 HydrophobicContact CG2-CG1 3.78Å; I1083-I1242 HydrophobicContact CD1-CG2 4.38Å; I1083-I1242 HydrophobicContact CG2-CG2 4.03Å
1084	I	89.8	Confident	77.8	Confident	76 Å²	76	51.1 Å²	51.1	39%	0.39	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-36.6	-178.9	-52	-59.3	0	0	0	110.6	N1082 T1243	N1082-I1084 WeakPolarHBondContact ND2-CD1 3.44Å; N1082-I1084 PolarHBondContact O-N 2.85Å; I1084-T1243 HydrophobicContact CB-CG2 4.05Å; I1084-T1243 HydrophobicContact CG1-CG2 4.48Å; I1084-T1243 HydrophobicContact CG2-CG2 4.5Å; I1084-T1243 PolarHBondContact N-O 3.47Å
1085	K	89.9	Confident	78.4	Confident	68 Å²	68	53 Å²	53	30%	0.296	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	136.6	-174.4	-155.5	-178.9	-170.8	-166	0	111.5	D1046 Q1087 T1243	D1046-K1085 WeakPolarHBondContact OD1-CE 3.13Å; D1046-K1085 IonicContact OD1-NZ 3.91Å; D1046-K1085 PolarHBondContact OD1-NZ 3.11Å; D1046-K1085 WeakPolarHBondContact OD2-CE 3.41Å; D1046-K1085 IonicContact OD2-NZ 2.7Å; D1046-K1085 PolarHBondContact OD2-NZ 2.85Å; K1085-Q1087 HydrophobicContact CD-CG 3.81Å; K1085-Q1087 HydrophobicContact CG-CG 3.96Å; K1085-T1243 PolarHBondContact N-O 2.65Å; K1085-T1243 VanDerWaalsContact N-O 3.1Å; K1085-T1243 PolarHBondContact O-N 2.77Å
1086	I	89.8	Confident	78.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.9	166.1	-57.4	178.5	0	0	0	107.3	L1047 Y1054 V1057 E1058 I1083 Y1240 I1242	L1047-I1086 HydrophobicContact CD1-CG2 4.01Å; L1047-I1086 PolarHBondContact N-O 2.76Å; Y1054-I1086 HydrophobicContact CD1-CD1 4.03Å; Y1054-I1086 HydrophobicContact CD2-CB 3.77Å; Y1054-I1086 HydrophobicContact CD2-CD1 3.9Å; Y1054-I1086 HydrophobicContact CD2-CG1 3.93Å; Y1054-I1086 HydrophobicContact CE1-CD1 4.07Å; Y1054-I1086 HydrophobicContact CE2-CB 3.84Å; Y1054-I1086 HydrophobicContact CE2-CD1 3.95Å; Y1054-I1086 HydrophobicContact CE2-CG1 3.69Å; Y1054-I1086 HydrophobicContact CG-CD1 3.92Å; Y1054-I1086 HydrophobicContact CG-CG1 4.47Å; V1057-I1086 HydrophobicContact CB-CD1 4.04Å; V1057-I1086 HydrophobicContact CG1-CD1 3.95Å; V1057-I1086 HydrophobicContact CG1-CG2 4.2Å; E1058-I1086 HydrophobicContact CB-CD1 4.34Å; I1083-I1086 HydrophobicContact CG2-CD1 4.15Å; I1083-I1086 HydrophobicContact CG2-CG1 3.78Å; I1086-Y1240 HydrophobicContact CG2-CD1 4.26Å; I1086-Y1240 HydrophobicContact CG2-CG 4.26Å; I1086-I1242 HydrophobicContact CG1-CG1 4.35Å; I1086-I1242 HydrophobicContact CG1-CG2 4.18Å; I1086-I1242 HydrophobicContact CG2-CG1 4.33Å
1087	Q	87	Confident	78.8	Confident	22 Å²	22	59.4 Å²	59.4	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.2	179.8	-51.6	-175.1	-94.7	0	0	109.3	L1044 I1045 D1046 K1085 Y1240 L1241	L1044-Q1087 HydrophobicContact CB-CB 4.39Å; I1045-Q1087 CarbonylContact O-C 3.55Å; I1045-Q1087 VanDerWaalsContact O-CA 3.28Å; I1045-Q1087 WeakPolarHBondContact O-CA 3.22Å; D1046-Q1087 WeakPolarHBondContact OD1-CG 3.4Å; D1046-Q1087 PolarHBondContact OD1-NE2 2.09Å; K1085-Q1087 HydrophobicContact CD-CG 3.81Å; K1085-Q1087 HydrophobicContact CG-CG 3.96Å; Q1087-Y1240 CarbonylContact O-C 3.58Å; Q1087-Y1240 VanDerWaalsContact O-CA 3.32Å; Q1087-Y1240 WeakPolarHBondContact O-CA 3.37Å; Q1087-L1241 HydrophobicContact CB-CB 4.39Å; Q1087-L1241 PolarHBondContact N-O 3.18Å; Q1087-L1241 PolarHBondContact O-N 2.94Å
1088	K	83.7	Confident	78.7	Confident	60 Å²	60	57.3 Å²	57.3	26%	0.261	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	128.3	176.8	-170.6	169.7	-172.3	167	0	110.5	L1044 I1045 L1047 E1053 V1090 Y1240	L1044-K1088 WeakPolarHBondContact CA-O 3.19Å; I1045-K1088 HydrophobicContact CB-CB 4.38Å; I1045-K1088 PolarHBondContact N-O 3.35Å; I1045-K1088 PolarHBondContact O-N 3.44Å; L1047-K1088 HydrophobicContact CD1-CB 4.44Å; L1047-K1088 HydrophobicContact CD2-CB 4.21Å; L1047-K1088 HydrophobicContact CD2-CD 4.46Å; L1047-K1088 HydrophobicContact CG-CB 4.3Å; E1053-K1088 WeakPolarHBondContact OE1-CE 3.41Å; E1053-K1088 IonicContact OE1-NZ 3.57Å; E1053-K1088 PolarHBondContact OE1-NZ 3.25Å; E1053-K1088 IonicContact OE2-NZ 2.74Å; E1053-K1088 PolarHBondContact OE2-NZ 2.91Å; K1088-V1090 HydrophobicContact CG-CG2 4.4Å; K1088-Y1240 HydrophobicContact CB-CD1 4Å; K1088-Y1240 HydrophobicContact CB-CE1 4.18Å; K1088-Y1240 HydrophobicContact CD-CE1 4.15Å; K1088-Y1240 HydrophobicContact CG-CD1 4.07Å; K1088-Y1240 HydrophobicContact CG-CE1 3.85Å
1089	V	79.9	Confident	78.8	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	113.8	-177.6	-175.7	0	0	0	0	108.3	T1042 L1044 I1129 Y1237 P1238 E1239 L1241	T1042-V1089 HydrophobicContact CG2-CG1 3.6Å; L1044-V1089 HydrophobicContact CD2-CB 4.44Å; L1044-V1089 HydrophobicContact CD2-CG2 3.85Å; V1089-I1129 HydrophobicContact CB-CD1 4.4Å; V1089-I1129 HydrophobicContact CG1-CD1 3.83Å; V1089-I1129 HydrophobicContact CG2-CD1 3.58Å; V1089-Y1237 PolarHBondContact O-OH 3.31Å; V1089-P1238 WeakPolarHBondContact CB-O 3.25Å; V1089-P1238 WeakPolarHBondContact CG1-O 3.39Å; V1089-E1239 PolarHBondContact N-O 2.64Å; V1089-L1241 HydrophobicContact CG2-CB 4.31Å
1090	V	74.8	Confident	78.8	Confident	59 Å²	59	62.4 Å²	62.4	36%	0.358	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	102.5	-179.9	-178.9	0	0	0	0	108.9	T1042 I1043 I1045 K1088	T1042-V1090 CarbonylContact C-O 3.32Å; T1042-V1090 WeakPolarHBondContact CA-O 3.14Å; I1043-V1090 HydrophobicContact CB-CB 4.39Å; I1043-V1090 PolarHBondContact N-O 2.95Å; I1043-V1090 PolarHBondContact O-N 3.12Å; I1045-V1090 HydrophobicContact CD1-CG2 3.76Å; I1045-V1090 HydrophobicContact CG1-CG2 4.22Å; K1088-V1090 HydrophobicContact CG-CG2 4.4Å
1091	N	71.3	Confident	78.3	Confident	12 Å²	12	58.4 Å²	58.4	6%	0.064	27%	0.268	C	S	.	.			trans	-129.4	106.9	172.9	-178.7	-43.8	0	0	0	109.8	G1041 T1042 K1093 L1094 R1095 Y1237	G1041-N1091 VanDerWaalsContact O-CA 3.25Å; G1041-N1091 WeakPolarHBondContact O-CA 3.14Å; G1041-N1091 VanDerWaalsContact O-CB 3.31Å; G1041-N1091 WeakPolarHBondContact O-CB 3.42Å; G1041-N1091 PolarHBondContact O-ND2 3.06Å; G1041-N1091 PolarHBondContact O-OD1 2.79Å; T1042-N1091 HydrophobicContact CG2-CB 4.29Å; T1042-N1091 PolarHBondContact OG1-ND2 3.46Å; N1091-K1093 PolarHBondContact O-N 2.91Å; N1091-K1093 PolarHBondContact OD1-N 2.96Å; N1091-L1094 HydrophobicContact CB-CB 3.89Å; N1091-L1094 PolarHBondContact O-N 3.33Å; N1091-L1094 VanDerWaalsContact OD1-CB 3.3Å; N1091-L1094 WeakPolarHBondContact OD1-CB 3.26Å; N1091-L1094 PolarHBondContact OD1-N 3.38Å; N1091-R1095 WeakPolarHBondContact O-CB 3.33Å; N1091-R1095 PolarHBondContact O-N 3.43Å; N1091-Y1237 PolarHBondContact N-OH 3.27Å
1092	K	67.3	Low	78	Confident	155 Å²	155	59.4 Å²	59.4	67%	0.674	27%	0.273	S	S	*	.	H	α-helix	trans	-58.6	-51.4	-173.8	-176.7	173.7	177	-179.4	0	112.1	L1094 R1095 E1096	K1092-L1094 VanDerWaalsContact C-N 3.31Å; K1092-L1094 PolarHBondContact O-N 2.89Å; K1092-R1095 PolarHBondContact O-N 2.92Å; K1092-E1096 WeakPolarHBondContact CE-OE1 3.05Å; K1092-E1096 VanDerWaalsContact CG-OE1 3.27Å; K1092-E1096 WeakPolarHBondContact CG-OE1 3.01Å; K1092-E1096 WeakPolarHBondContact O-CB 3.34Å; K1092-E1096 VanDerWaalsContact O-CG 3.3Å; K1092-E1096 WeakPolarHBondContact O-CG 2.83Å; K1092-E1096 PolarHBondContact O-N 3.39Å
1093	K	64.9	Low	77.6	Confident	154 Å²	154	62.6 Å²	62.6	67%	0.67	28%	0.284	S	S	*	.	H	α-helix	trans	-62.8	-34.3	179.9	-66.5	-173.9	177.6	-176.8	0	113.2	N1091 R1097	N1091-K1093 PolarHBondContact O-N 2.91Å; N1091-K1093 PolarHBondContact OD1-N 2.96Å; K1093-R1097 WeakPolarHBondContact O-CG 3.3Å; K1093-R1097 PolarHBondContact O-N 3.06Å; K1093-R1097 PolarHBondContact O-NE 3.01Å
1094	L	67.1	Low	77.1	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	30%	0.297	C	S	.	.	H	α-helix	trans	-76.1	-38	177.9	-165.1	66	0	0	0	111.3	N1091 K1092 Y1098 F1133 Y1237 P1238	N1091-L1094 HydrophobicContact CB-CB 3.89Å; N1091-L1094 PolarHBondContact O-N 3.33Å; N1091-L1094 VanDerWaalsContact OD1-CB 3.3Å; N1091-L1094 WeakPolarHBondContact OD1-CB 3.26Å; N1091-L1094 PolarHBondContact OD1-N 3.38Å; K1092-L1094 VanDerWaalsContact C-N 3.31Å; K1092-L1094 PolarHBondContact O-N 2.89Å; L1094-Y1098 WeakPolarHBondContact O-CB 3.48Å; L1094-Y1098 PolarHBondContact O-N 3.03Å; L1094-F1133 HydrophobicContact CD1-CB 3.95Å; L1094-F1133 HydrophobicContact CD1-CD2 3.9Å; L1094-F1133 HydrophobicContact CD1-CG 4.35Å; L1094-F1133 HydrophobicContact CD2-CD2 4.01Å; L1094-Y1237 HydrophobicContact CB-CD2 4.26Å; L1094-Y1237 HydrophobicContact CB-CE2 4.15Å; L1094-Y1237 HydrophobicContact CD2-CD2 4.17Å; L1094-Y1237 HydrophobicContact CD2-CE2 4.36Å; L1094-Y1237 HydrophobicContact CG-CD2 3.93Å; L1094-Y1237 HydrophobicContact CG-CE2 4.26Å; L1094-P1238 HydrophobicContact CD2-CG 3.94Å
1095	R	71.1	Confident	76.3	Confident	113 Å²	113	61.9 Å²	61.9	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-41.4	175.2	-177.2	58.4	174.2	-116	1.4	111.6	N1091 K1092 Y1098 T1099 Y1237 E1239	N1091-R1095 WeakPolarHBondContact O-CB 3.33Å; N1091-R1095 PolarHBondContact O-N 3.43Å; K1092-R1095 PolarHBondContact O-N 2.92Å; R1095-Y1098 PolarHBondContact O-N 3.09Å; R1095-T1099 WeakPolarHBondContact O-CB 3.47Å; R1095-T1099 PolarHBondContact O-N 2.79Å; R1095-T1099 PolarHBondContact O-OG1 3.39Å; R1095-Y1237 HydrophobicContact CB-CD2 4.36Å; R1095-Y1237 HydrophobicContact CB-CE2 3.71Å; R1095-E1239 IonicContact NH1-OE1 3.19Å; R1095-E1239 PolarHBondContact NH1-OE1 3.33Å
1096	E	72.1	Confident	75.8	Confident	101 Å²	101	58.9 Å²	58.9	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-50.2	175.2	-74.8	163.2	173.9	0	0	111.5	K1092 Y1098 T1099 H1100	K1092-E1096 WeakPolarHBondContact CE-OE1 3.05Å; K1092-E1096 VanDerWaalsContact CG-OE1 3.27Å; K1092-E1096 WeakPolarHBondContact CG-OE1 3.01Å; K1092-E1096 WeakPolarHBondContact O-CB 3.34Å; K1092-E1096 VanDerWaalsContact O-CG 3.3Å; K1092-E1096 WeakPolarHBondContact O-CG 2.83Å; K1092-E1096 PolarHBondContact O-N 3.39Å; E1096-Y1098 PolarHBondContact O-N 3.05Å; E1096-T1099 PolarHBondContact O-N 3.1Å; E1096-H1100 PolarHBondContact O-N 3.28Å
1097	R	67.3	Low	75.4	Confident	76 Å²	76	63.9 Å²	63.9	29%	0.287	29%	0.294	S	S	.	.	H	α-helix	trans	-62.6	-42.9	177.1	-71.9	-173.9	-64.1	176.4	9.2	112.6	K1093 T1099 H1100 R1101 F1133 E1135 Q1235	K1093-R1097 WeakPolarHBondContact O-CG 3.3Å; K1093-R1097 PolarHBondContact O-N 3.06Å; K1093-R1097 PolarHBondContact O-NE 3.01Å; R1097-T1099 PolarHBondContact O-N 3.39Å; R1097-H1100 WeakPolarHBondContact O-CB 3.35Å; R1097-H1100 PolarHBondContact O-N 3.05Å; R1097-R1101 PolarHBondContact O-N 3.45Å; R1097-F1133 PolarHBondContact NH2-O 3.18Å; R1097-E1135 VanDerWaalsContact NH1-CG 3.32Å; R1097-E1135 IonicContact NH1-OE1 2.65Å; R1097-E1135 PolarHBondContact NH1-OE1 2.99Å; R1097-Q1235 PolarHBondContact O-OE1 3.04Å
1098	Y	72.8	Confident	74.8	Confident	3 Å²	3	67.3 Å²	67.3	1%	0.012	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-46.5	174.1	-179.6	-95.3	0	0	0	111.7	L1094 R1095 E1096 H1100 R1101 Q1102 E1115 R1189 T1191 Y1237	L1094-Y1098 WeakPolarHBondContact O-CB 3.48Å; L1094-Y1098 PolarHBondContact O-N 3.03Å; R1095-Y1098 PolarHBondContact O-N 3.09Å; E1096-Y1098 PolarHBondContact O-N 3.05Å; Y1098-H1100 VanDerWaalsContact C-N 3.33Å; Y1098-H1100 PolarHBondContact O-N 3.11Å; Y1098-R1101 PolarHBondContact O-N 3.27Å; Y1098-Q1102 HydrophobicContact CE1-CB 4.32Å; Y1098-Q1102 HydrophobicContact CE1-CG 4.48Å; Y1098-Q1102 WeakPolarHBondContact O-CB 3.17Å; Y1098-Q1102 PolarHBondContact O-N 3.29Å; Y1098-E1115 WeakPolarHBondContact CE1-OE1 3.36Å; Y1098-E1115 PolarHBondContact OH-OE1 3.23Å; Y1098-R1189 HydrophobicContact CE1-CG 4.2Å; Y1098-R1189 WeakPolarHBondContact CE2-O 3.34Å; Y1098-R1189 WeakPolarHBondContact OH-CG 3.25Å; Y1098-T1191 HydrophobicContact CE2-CG2 3.83Å; Y1098-T1191 PolarHBondContact OH-N 3.24Å; Y1098-Y1237 HydrophobicContact CG-CG 4.46Å
1099	T	78.2	Confident	74.3	Confident	58 Å²	58	66.1 Å²	66.1	36%	0.356	31%	0.306	S	S	.	.	H	α-helix	trans	-65.2	-36	179.5	-51.3	0	0	0	0	111.6	R1095 E1096 R1097 K1103	R1095-T1099 WeakPolarHBondContact O-CB 3.47Å; R1095-T1099 PolarHBondContact O-N 2.79Å; R1095-T1099 PolarHBondContact O-OG1 3.39Å; E1096-T1099 PolarHBondContact O-N 3.1Å; R1097-T1099 PolarHBondContact O-N 3.39Å; T1099-K1103 WeakPolarHBondContact O-CB 3.4Å; T1099-K1103 PolarHBondContact O-N 2.83Å
1100	H	78.1	Confident	74.2	Confident	122 Å²	122	73 Å²	73	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-61.3	-49.5	172.2	-169.7	-79	0	0	0	111.5	E1096 R1097 Y1098 K1103 E1104	E1096-H1100 PolarHBondContact O-N 3.28Å; R1097-H1100 WeakPolarHBondContact O-CB 3.35Å; R1097-H1100 PolarHBondContact O-N 3.05Å; Y1098-H1100 VanDerWaalsContact C-N 3.33Å; Y1098-H1100 PolarHBondContact O-N 3.11Å; H1100-K1103 WeakPolarHBondContact O-CB 3.48Å; H1100-K1103 PolarHBondContact O-N 3.46Å; H1100-E1104 IonicContact CE1-OE1 3.72Å; H1100-E1104 PolarHBondContact CE1-OE1 2.93Å; H1100-E1104 IonicContact ND1-OE1 2.73Å; H1100-E1104 PolarHBondContact ND1-OE1 2.99Å; H1100-E1104 PolarHBondContact O-N 3.25Å
1101	R	72.6	Confident	74.2	Confident	45 Å²	45	76.1 Å²	76.1	17%	0.17	35%	0.352	C	S	.	.	H	α-helix	trans	-69.1	-36.3	-179.6	-173.3	55	179.7	149.8	9	112.8	R1097 Y1098 K1103 E1104 I1105 E1108 T1191 G1233 Q1235	R1097-R1101 PolarHBondContact O-N 3.45Å; Y1098-R1101 PolarHBondContact O-N 3.27Å; R1101-K1103 VanDerWaalsContact C-N 3.27Å; R1101-K1103 PolarHBondContact O-N 2.84Å; R1101-E1104 WeakPolarHBondContact CD-OE2 3.41Å; R1101-E1104 IonicContact CZ-OE2 3.91Å; R1101-E1104 IonicContact NE-OE2 3.79Å; R1101-E1104 IonicContact NH1-OE2 2.66Å; R1101-E1104 PolarHBondContact NH1-OE2 3.48Å; R1101-E1104 PolarHBondContact O-N 3.3Å; R1101-I1105 HydrophobicContact CG-CD1 4.11Å; R1101-I1105 WeakPolarHBondContact O-CG1 3.39Å; R1101-I1105 PolarHBondContact O-N 2.8Å; R1101-E1108 IonicContact NH1-OE1 2.8Å; R1101-T1191 HydrophobicContact CG-CG2 4.41Å; R1101-G1233 PolarHBondContact NH2-O 2.88Å; R1101-G1233 VanDerWaalsContact NH2-O 3.16Å; R1101-Q1235 HydrophobicContact CB-CB 4.41Å; R1101-Q1235 HydrophobicContact CB-CG 4.38Å; R1101-Q1235 HydrophobicContact CG-CB 4.2Å; R1101-Q1235 HydrophobicContact CG-CG 4.19Å
1102	Q	80.1	Confident	74.4	Confident	29 Å²	29	81.2 Å²	81.2	14%	0.136	38%	0.376	C	S	.	.	H	α-helix	trans	-57.4	-41.4	171.4	-176.3	-154.8	42.8	0	0	110.9	Y1098 A1106 H1113 E1115 T1191	Y1098-Q1102 HydrophobicContact CE1-CB 4.32Å; Y1098-Q1102 HydrophobicContact CE1-CG 4.48Å; Y1098-Q1102 WeakPolarHBondContact O-CB 3.17Å; Y1098-Q1102 PolarHBondContact O-N 3.29Å; Q1102-A1106 WeakPolarHBondContact O-CB 3.42Å; Q1102-A1106 PolarHBondContact O-N 3.02Å; Q1102-H1113 HydrophobicContact CG-CB 3.8Å; Q1102-H1113 PolarHBondContact NE2-ND1 3.04Å; Q1102-E1115 PolarHBondContact NE2-OE1 2.9Å; Q1102-T1191 HydrophobicContact CB-CG2 4.37Å
1103	K	81.8	Confident	74.5	Confident	132 Å²	132	77.9 Å²	77.9	57%	0.574	36%	0.362	S	S	*	.	H	α-helix	trans	-69.3	-45.9	176.1	-170.9	179.2	178	-175.8	0	112.8	T1099 H1100 R1101 I1105 A1106 D1107	T1099-K1103 WeakPolarHBondContact O-CB 3.4Å; T1099-K1103 PolarHBondContact O-N 2.83Å; H1100-K1103 WeakPolarHBondContact O-CB 3.48Å; H1100-K1103 PolarHBondContact O-N 3.46Å; R1101-K1103 VanDerWaalsContact C-N 3.27Å; R1101-K1103 PolarHBondContact O-N 2.84Å; K1103-I1105 VanDerWaalsContact C-N 3.28Å; K1103-I1105 PolarHBondContact O-N 3.16Å; K1103-A1106 WeakPolarHBondContact O-CB 3.35Å; K1103-A1106 PolarHBondContact O-N 3.21Å; K1103-A1106 VanDerWaalsContact O-N 3.08Å; K1103-D1107 VanDerWaalsContact O-CG 3.32Å; K1103-D1107 PolarHBondContact O-N 3.03Å
1104	E	80.1	Confident	74.7	Confident	73 Å²	73	71.8 Å²	71.8	34%	0.341	34%	0.337	S	S	.	.	H	α-helix	trans	-55.3	-44.3	173.8	-70.3	175.8	167	0	0	111.8	H1100 R1101 D1107 E1108	H1100-E1104 IonicContact CE1-OE1 3.72Å; H1100-E1104 PolarHBondContact CE1-OE1 2.93Å; H1100-E1104 IonicContact ND1-OE1 2.73Å; H1100-E1104 PolarHBondContact ND1-OE1 2.99Å; H1100-E1104 PolarHBondContact O-N 3.25Å; R1101-E1104 WeakPolarHBondContact CD-OE2 3.41Å; R1101-E1104 IonicContact CZ-OE2 3.91Å; R1101-E1104 IonicContact NE-OE2 3.79Å; R1101-E1104 IonicContact NH1-OE2 2.66Å; R1101-E1104 PolarHBondContact NH1-OE2 3.48Å; R1101-E1104 PolarHBondContact O-N 3.3Å; E1104-D1107 PolarHBondContact O-N 2.97Å; E1104-E1108 WeakPolarHBondContact O-CB 3.45Å; E1104-E1108 WeakPolarHBondContact O-CG 3.38Å; E1104-E1108 PolarHBondContact O-N 3.18Å
1105	I	73.4	Confident	74.9	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-67.3	-36.8	177.4	-72.6	168.2	0	0	0	111.1	R1101 K1103 E1108 N1109 T1191 L1192	R1101-I1105 HydrophobicContact CG-CD1 4.11Å; R1101-I1105 WeakPolarHBondContact O-CG1 3.39Å; R1101-I1105 PolarHBondContact O-N 2.8Å; K1103-I1105 VanDerWaalsContact C-N 3.28Å; K1103-I1105 PolarHBondContact O-N 3.16Å; I1105-E1108 PolarHBondContact O-N 3.47Å; I1105-N1109 WeakPolarHBondContact O-CB 3.44Å; I1105-N1109 PolarHBondContact O-N 2.85Å; I1105-T1191 HydrophobicContact CD1-CG2 3.75Å; I1105-T1191 WeakPolarHBondContact CD1-OG1 3.42Å; I1105-L1192 WeakPolarHBondContact CG2-O 3.39Å
1106	A	78.8	Confident	74.8	Confident	5 Å²	5	72 Å²	72	4%	0.041	34%	0.339	C	S	.	.	H	α-helix	trans	-63.5	-47.1	173.9	0	0	0	0	0	112	Q1102 K1103 E1108 N1109 H1110 N1111 H1113	Q1102-A1106 WeakPolarHBondContact O-CB 3.42Å; Q1102-A1106 PolarHBondContact O-N 3.02Å; K1103-A1106 WeakPolarHBondContact O-CB 3.35Å; K1103-A1106 PolarHBondContact O-N 3.21Å; K1103-A1106 VanDerWaalsContact O-N 3.08Å; A1106-E1108 VanDerWaalsContact C-N 3.31Å; A1106-E1108 PolarHBondContact O-N 3.42Å; A1106-N1109 CarbonylContact O-C 3.34Å; A1106-N1109 PolarHBondContact O-N 3.21Å; A1106-H1110 PolarHBondContact O-N 3.2Å; A1106-N1111 VanDerWaalsContact O-CA 3.26Å; A1106-N1111 WeakPolarHBondContact O-CA 3.39Å; A1106-N1111 PolarHBondContact O-N 3.02Å; A1106-H1113 VanDerWaalsContact CB-CD2 3.48Å; A1106-H1113 WeakPolarHBondContact CB-CD2 3.47Å
1107	D	80.8	Confident	74.7	Confident	106 Å²	106	68.4 Å²	68.4	57%	0.567	32%	0.322	S	S	*	.	H	α-helix	trans	-61	-41.1	176.7	-66.5	-22.6	0	0	0	110.6	K1103 E1104 N1109	K1103-D1107 VanDerWaalsContact O-CG 3.32Å; K1103-D1107 PolarHBondContact O-N 3.03Å; E1104-D1107 PolarHBondContact O-N 2.97Å; D1107-N1109 VanDerWaalsContact C-N 3.3Å; D1107-N1109 PolarHBondContact O-N 3.07Å
1108	E	75.4	Confident	74.7	Confident	94 Å²	94	66.2 Å²	66.2	44%	0.439	32%	0.316	S	S	.	.	H	α-helix	trans	-67.5	-24.8	172.6	-74.9	177.8	-155.6	0	0	113.2	R1101 E1104 I1105 A1106 K1194	R1101-E1108 IonicContact NH1-OE1 2.8Å; E1104-E1108 WeakPolarHBondContact O-CB 3.45Å; E1104-E1108 WeakPolarHBondContact O-CG 3.38Å; E1104-E1108 PolarHBondContact O-N 3.18Å; I1105-E1108 PolarHBondContact O-N 3.47Å; A1106-E1108 VanDerWaalsContact C-N 3.31Å; A1106-E1108 PolarHBondContact O-N 3.42Å; E1108-K1194 VanDerWaalsContact O-CD 3.3Å; E1108-K1194 WeakPolarHBondContact O-CD 3.32Å; E1108-K1194 WeakPolarHBondContact O-CE 3.31Å; E1108-K1194 PolarHBondContact O-NZ 2.85Å
1109	N	72.8	Confident	74.5	Confident	34 Å²	34	66.2 Å²	66.2	18%	0.182	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	45.9	-166.5	-167	37.9	0	0	0	114.3	I1105 A1106 D1107 N1111 H1112	I1105-N1109 WeakPolarHBondContact O-CB 3.44Å; I1105-N1109 PolarHBondContact O-N 2.85Å; A1106-N1109 CarbonylContact O-C 3.34Å; A1106-N1109 PolarHBondContact O-N 3.21Å; D1107-N1109 VanDerWaalsContact C-N 3.3Å; D1107-N1109 PolarHBondContact O-N 3.07Å; N1109-N1111 VanDerWaalsContact C-N 3.33Å; N1109-N1111 PolarHBondContact O-N 3Å; N1109-H1112 PolarHBondContact ND2-O 3.48Å; N1109-H1112 WeakPolarHBondContact O-CB 3.47Å; N1109-H1112 PolarHBondContact O-N 3.36Å
1110	H	77.9	Confident	74.1	Confident	149 Å²	149	65.6 Å²	65.6	69%	0.69	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	46.4	175.5	-46.3	101.1	0	0	0	113.1	A1106 H1112	A1106-H1110 PolarHBondContact O-N 3.2Å; H1110-H1112 PolarHBondContact O-N 3.08Å; H1110-H1112 PolarHBondContact O-ND1 3.37Å
1111	N	75.2	Confident	73.2	Confident	124 Å²	124	59.9 Å²	59.9	66%	0.663	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	17.1	-176.1	-60.9	-12.1	0	0	0	115.4	A1106 N1109	A1106-N1111 VanDerWaalsContact O-CA 3.26Å; A1106-N1111 WeakPolarHBondContact O-CA 3.39Å; A1106-N1111 PolarHBondContact O-N 3.02Å; N1109-N1111 VanDerWaalsContact C-N 3.33Å; N1109-N1111 PolarHBondContact O-N 3Å
1112	H	73.6	Confident	72.6	Confident	119 Å²	119	58.4 Å²	58.4	55%	0.551	28%	0.28	S	S	*	.			trans	-98.7	110.7	175.7	-72.3	67.7	0	0	0	111.8	N1109 H1110 N1114	N1109-H1112 PolarHBondContact ND2-O 3.48Å; N1109-H1112 WeakPolarHBondContact O-CB 3.47Å; N1109-H1112 PolarHBondContact O-N 3.36Å; H1110-H1112 PolarHBondContact O-N 3.08Å; H1110-H1112 PolarHBondContact O-ND1 3.37Å; H1112-N1114 PolarHBondContact O-N 3.45Å
1113	H	69.7	Low	71.2	Confident	84 Å²	84	59.1 Å²	59.1	39%	0.389	29%	0.287	S	S	.	.			trans	-61.8	-17.3	-178.1	-61.4	-163.8	0	0	0	114.1	Q1102 A1106 E1115 T1191	Q1102-H1113 HydrophobicContact CG-CB 3.8Å; Q1102-H1113 PolarHBondContact NE2-ND1 3.04Å; A1106-H1113 VanDerWaalsContact CB-CD2 3.48Å; A1106-H1113 WeakPolarHBondContact CB-CD2 3.47Å; H1113-E1115 VanDerWaalsContact C-N 3.31Å; H1113-E1115 HydrophobicContact CB-CG 4.01Å; H1113-E1115 PolarHBondContact O-N 2.95Å; H1113-T1191 PolarHBondContact O-OG1 2.98Å
1114	N	70.5	Confident	69.8	Low	26 Å²	26	58.7 Å²	58.7	14%	0.139	29%	0.285	C	S	.	.			trans	47.1	46.2	177.4	-158.4	24	0	0	0	114.6	H1112 R1116 L1192	H1112-N1114 PolarHBondContact O-N 3.45Å; N1114-R1116 PolarHBondContact OD1-NH1 3.45Å; N1114-R1116 PolarHBondContact OD1-NH2 3.38Å; N1114-L1192 WeakPolarHBondContact CB-O 3.46Å; N1114-L1192 PolarHBondContact ND2-O 2.86Å; N1114-L1192 PolarHBondContact O-N 3.3Å
1115	E	70.1	Confident	69	Low	49 Å²	49	55.2 Å²	55.2	23%	0.229	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	149.4	-178.6	-57.1	-162.4	137.3	0	0	113.2	Y1098 Q1102 H1113 R1189 V1190	Y1098-E1115 WeakPolarHBondContact CE1-OE1 3.36Å; Y1098-E1115 PolarHBondContact OH-OE1 3.23Å; Q1102-E1115 PolarHBondContact NE2-OE1 2.9Å; H1113-E1115 VanDerWaalsContact C-N 3.31Å; H1113-E1115 HydrophobicContact CB-CG 4.01Å; H1113-E1115 PolarHBondContact O-N 2.95Å; E1115-R1189 WeakPolarHBondContact OE1-CD 3.27Å; E1115-R1189 IonicContact OE2-CZ 3.61Å; E1115-R1189 IonicContact OE2-NH1 2.92Å; E1115-R1189 PolarHBondContact OE2-NH1 3.28Å; E1115-V1190 CarbonylContact C-O 3.58Å; E1115-V1190 WeakPolarHBondContact CA-O 3.37Å
1116	R	70.6	Confident	68.4	Low	82 Å²	82	60.2 Å²	60.2	31%	0.309	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153.7	169.4	-63.7	-62	-178.1	-68	-8.5	110.5	N1114 V1190 L1192 A1201	N1114-R1116 PolarHBondContact OD1-NH1 3.45Å; N1114-R1116 PolarHBondContact OD1-NH2 3.38Å; R1116-V1190 PolarHBondContact N-O 3.29Å; R1116-V1190 PolarHBondContact O-N 3.32Å; R1116-L1192 HydrophobicContact CB-CD1 4.4Å; R1116-L1192 HydrophobicContact CG-CD1 3.76Å; R1116-A1201 PolarHBondContact NE-O 2.76Å
1117	M	69.4	Low	67.4	Low	26 Å²	26	62 Å²	62	13%	0.128	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.4	175.7	-49	-48.7	-74.8	0	0	110.6	F1187 C1188 R1189 M1204	M1117-F1187 HydrophobicContact CB-CD2 4.48Å; M1117-F1187 HydrophobicContact CB-CE1 4.2Å; M1117-F1187 HydrophobicContact CB-CE2 3.6Å; M1117-F1187 HydrophobicContact CB-CZ 3.47Å; M1117-F1187 VanDerWaalsContact CB-CZ 3.47Å; M1117-F1187 HydrophobicContact CE-CD1 3.63Å; M1117-F1187 HydrophobicContact CE-CE1 3.16Å; M1117-F1187 HydrophobicContact CE-CZ 3.72Å; M1117-F1187 HydrophobicContact CG-CE1 4.18Å; M1117-F1187 HydrophobicContact CG-CE2 4.37Å; M1117-F1187 HydrophobicContact CG-CZ 3.73Å; M1117-C1188 WeakPolarHBondContact CA-O 3.48Å; M1117-R1189 HydrophobicContact CE-CB 3.82Å; M1117-R1189 HydrophobicContact CE-CG 4.12Å; M1117-R1189 HydrophobicContact SD-CB 3.99Å; M1117-R1189 HydrophobicContact SD-CG 3.74Å; M1117-M1204 HydrophobicContact CB-SD 4.11Å
1118	L	67	Low	66.4	Low	29 Å²	29	58.2 Å²	58.2	15%	0.152	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	135.9	-177.3	-65.9	174.6	0	0	0	111.4	I1148 C1188 V1190 A1205	L1118-I1148 HydrophobicContact CD1-CD1 3.89Å; L1118-I1148 HydrophobicContact CD1-CG2 4.37Å; L1118-I1148 HydrophobicContact CD2-CD1 4.41Å; L1118-I1148 HydrophobicContact CD2-CG2 3.93Å; L1118-C1188 PolarHBondContact N-O 2.87Å; L1118-C1188 PolarHBondContact O-N 2.84Å; L1118-V1190 HydrophobicContact CD1-CG2 3.82Å; L1118-V1190 HydrophobicContact CG-CG2 4.45Å; L1118-A1205 HydrophobicContact CD2-CB 4.35Å
1119	F	68.9	Low	65.7	Low	4 Å²	4	54 Å²	54	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.3	172.7	-69.6	-85.9	0	0	0	111	M1061 M1185 L1186 F1187 M1204 H1206 I1242	M1061-F1119 HydrophobicContact CB-CE1 3.73Å; M1061-F1119 HydrophobicContact CB-CZ 3.56Å; M1061-F1119 HydrophobicContact CG-CD1 4.45Å; M1061-F1119 HydrophobicContact CG-CE1 3.77Å; M1061-F1119 HydrophobicContact CG-CZ 4Å; M1061-F1119 HydrophobicContact SD-CE1 3.98Å; F1119-M1185 HydrophobicContact CB-SD 4.12Å; F1119-M1185 HydrophobicContact CD1-SD 3.57Å; F1119-M1185 VanDerWaalsContact CD1-SD 3.57Å; F1119-M1185 HydrophobicContact CE1-SD 4.4Å; F1119-M1185 HydrophobicContact CG-SD 4.21Å; F1119-L1186 CarbonylContact C-O 3.57Å; F1119-L1186 WeakPolarHBondContact CA-O 3.42Å; F1119-F1187 HydrophobicContact CD1-CB 4.38Å; F1119-F1187 AromaticContact CD1-CD2 3.69Å; F1119-F1187 HydrophobicContact CD1-CD2 3.69Å; F1119-F1187 HydrophobicContact CD1-CE2 4.47Å; F1119-F1187 AromaticContact CD2-CD2 4Å; F1119-F1187 HydrophobicContact CD2-CD2 4Å; F1119-F1187 HydrophobicContact CD2-CE2 4.11Å; F1119-F1187 HydrophobicContact CE1-CB 4.24Å; F1119-F1187 AromaticContact CE1-CD2 3.33Å; F1119-F1187 HydrophobicContact CE1-CD2 3.33Å; F1119-F1187 AromaticContact CE1-CE2 3.89Å; F1119-F1187 HydrophobicContact CE1-CE2 3.89Å; F1119-F1187 HydrophobicContact CE1-CG 4.13Å; F1119-F1187 AromaticContact CE2-CD2 3.67Å; F1119-F1187 HydrophobicContact CE2-CD2 3.67Å; F1119-F1187 AromaticContact CE2-CE2 3.47Å; F1119-F1187 HydrophobicContact CE2-CE2 3.47Å; F1119-F1187 VanDerWaalsContact CE2-CE2 3.47Å; F1119-F1187 HydrophobicContact CG-CD2 4.01Å; F1119-F1187 AromaticContact CZ-CD2 3.32Å; F1119-F1187 HydrophobicContact CZ-CD2 3.32Å; F1119-F1187 AromaticContact CZ-CE2 3.34Å; F1119-F1187 HydrophobicContact CZ-CE2 3.34Å; F1119-F1187 HydrophobicContact CZ-CG 4.39Å; F1119-F1187 HydrophobicContact CZ-CZ 4.4Å; F1119-M1204 HydrophobicContact CD2-CE 4.35Å; F1119-M1204 HydrophobicContact CD2-SD 4.15Å; F1119-M1204 HydrophobicContact CE2-CE 3.69Å; F1119-M1204 HydrophobicContact CE2-SD 3.82Å; F1119-H1206 AromaticContact CD2-CE1 3.2Å; F1119-H1206 WeakPolarHBondContact CD2-CE1 3.41Å; F1119-H1206 AromaticContact CD2-ND1 3.64Å; F1119-H1206 AromaticContact CD2-NE2 3.94Å; F1119-H1206 AromaticContact CE2-CE1 3.68Å; F1119-H1206 AromaticContact CG-CE1 3.84Å; F1119-H1206 AromaticContact CG-ND1 3.83Å; F1119-I1242 HydrophobicContact CD1-CD1 4.4Å; F1119-I1242 HydrophobicContact CE1-CD1 3.8Å
1120	H	68.4	Low	64.9	Low	45 Å²	45	58.4 Å²	58.4	21%	0.208	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	120.7	-171.5	-171.1	68.2	0	0	0	113.1	S1122 F1144 M1185 L1186	H1120-S1122 WeakPolarHBondContact NE2-CB 3.22Å; H1120-F1144 HydrophobicContact CB-CE1 4.47Å; H1120-F1144 AromaticContact CD2-CE1 3.45Å; H1120-F1144 VanDerWaalsContact CD2-CE1 3.45Å; H1120-F1144 WeakPolarHBondContact CD2-CE1 3.43Å; H1120-F1144 AromaticContact CD2-CZ 3.72Å; H1120-F1144 AromaticContact CE1-CE1 3.5Å; H1120-F1144 AromaticContact CE1-CZ 3.94Å; H1120-F1144 AromaticContact CG-CE1 3.66Å; H1120-F1144 AromaticContact ND1-CE1 3.7Å; H1120-F1144 AromaticContact NE2-CE1 3.34Å; H1120-F1144 VanDerWaalsContact NE2-CE1 3.34Å; H1120-F1144 WeakPolarHBondContact NE2-CE1 3.39Å; H1120-F1144 AromaticContact NE2-CZ 3.4Å; H1120-F1144 WeakPolarHBondContact NE2-CZ 3.49Å; H1120-M1185 WeakPolarHBondContact O-CA 3.3Å; H1120-L1186 PolarHBondContact N-O 2.82Å; H1120-L1186 PolarHBondContact O-N 3.32Å
1121	G	59.7	Low	63.7	Low	1 Å²	1	59.8 Å²	59.8	1%	0.01	29%	0.293	C	S	.	.			trans	-94.1	9.8	-173.8	0	0	0	0	0	117.6	H1212 S1213	G1121-H1212 VanDerWaalsContact CA-CD2 3.46Å; G1121-H1212 WeakPolarHBondContact CA-CD2 3.38Å; G1121-H1212 VanDerWaalsContact O-CA 3.29Å; G1121-H1212 WeakPolarHBondContact O-CA 3.44Å; G1121-S1213 PolarHBondContact O-N 2.82Å
1122	S	59.5	Low	62.5	Low	15 Å²	15	54.8 Å²	54.8	11%	0.105	27%	0.271	C	S	.	.			trans	-43.3	141.4	-165.3	156.7	0	0	0	0	116.1	H1120 F1124 I1125	H1120-S1122 WeakPolarHBondContact NE2-CB 3.22Å; S1122-F1124 PolarHBondContact O-N 2.62Å; S1122-F1124 WeakPolarHBondContact OG-CB 3.44Å; S1122-F1124 WeakPolarHBondContact OG-CD2 3.26Å; S1122-F1124 PolarHBondContact OG-N 2.99Å; S1122-I1125 VanDerWaalsContact O-CD1 3.29Å; S1122-I1125 WeakPolarHBondContact O-CD1 3.48Å; S1122-I1125 WeakPolarHBondContact O-CG1 3.44Å; S1122-I1125 PolarHBondContact O-N 2.99Å
1123	P	50.8	Low	61.5	Low	43 Å²	43	50.9 Å²	50.9	28%	0.279	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-19.8	170.3	-27.3	36.3	0	0	0	114.7	S1219	P1123-S1219 VanDerWaalsContact CB-OG 3.3Å; P1123-S1219 WeakPolarHBondContact CB-OG 3.48Å; P1123-S1219 VanDerWaalsContact CG-OG 3.27Å; P1123-S1219 WeakPolarHBondContact CG-OG 3.4Å
1124	F	52.8	Low	60.1	Low	123 Å²	123	49.8 Å²	49.8	54%	0.539	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	7.7	-175.7	-52.1	-69.8	0	0	0	114.1	S1122 N1126 A1127 I1128	S1122-F1124 PolarHBondContact O-N 2.62Å; S1122-F1124 WeakPolarHBondContact OG-CB 3.44Å; S1122-F1124 WeakPolarHBondContact OG-CD2 3.26Å; S1122-F1124 PolarHBondContact OG-N 2.99Å; F1124-N1126 PolarHBondContact O-N 3.21Å; F1124-N1126 VanDerWaalsContact O-N 3.11Å; F1124-A1127 WeakPolarHBondContact O-CA 3.41Å; F1124-A1127 WeakPolarHBondContact O-CB 3.16Å; F1124-A1127 PolarHBondContact O-N 3.22Å; F1124-I1128 HydrophobicContact CB-CD1 4.38Å; F1124-I1128 WeakPolarHBondContact O-CG1 3.36Å; F1124-I1128 PolarHBondContact O-N 3.22Å
1125	I	64.4	Low	58.6	Low	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-45.6	-45.4	-179.6	-77.1	163.9	0	0	0	112.8	S1122 A1127 I1128 I1129 Q1184 L1186 L1241	S1122-I1125 VanDerWaalsContact O-CD1 3.29Å; S1122-I1125 WeakPolarHBondContact O-CD1 3.48Å; S1122-I1125 WeakPolarHBondContact O-CG1 3.44Å; S1122-I1125 PolarHBondContact O-N 2.99Å; I1125-A1127 VanDerWaalsContact C-N 3.33Å; I1125-A1127 PolarHBondContact O-N 3.3Å; I1125-I1128 PolarHBondContact O-N 3.42Å; I1125-I1129 WeakPolarHBondContact O-CG1 3.4Å; I1125-I1129 PolarHBondContact O-N 3.42Å; I1125-Q1184 HydrophobicContact CD1-CB 4.29Å; I1125-Q1184 WeakPolarHBondContact CD1-O 3.18Å; I1125-Q1184 HydrophobicContact CG2-CB 4.41Å; I1125-L1186 HydrophobicContact CB-CD1 4.48Å; I1125-L1186 HydrophobicContact CD1-CG 4.48Å; I1125-L1186 HydrophobicContact CG1-CD1 3.9Å; I1125-L1186 HydrophobicContact CG1-CG 3.93Å; I1125-L1186 HydrophobicContact CG2-CD1 4.41Å; I1125-L1186 HydrophobicContact CG2-CD2 4.35Å; I1125-L1186 HydrophobicContact CG2-CG 4.2Å; I1125-L1241 HydrophobicContact CG2-CD1 3.53Å
1126	N	60	Low	57.1	Low	106 Å²	106	63.6 Å²	63.6	57%	0.567	30%	0.304	S	S	*	.	H	α-helix	trans	-62.5	-38.9	179.7	-159	30.7	0	0	0	112.1	F1124 H1130	F1124-N1126 PolarHBondContact O-N 3.21Å; F1124-N1126 VanDerWaalsContact O-N 3.11Å; N1126-H1130 WeakPolarHBondContact O-CB 3.33Å; N1126-H1130 PolarHBondContact O-CD2 3.13Å; N1126-H1130 VanDerWaalsContact O-CD2 3.29Å; N1126-H1130 PolarHBondContact O-N 2.6Å; N1126-H1130 VanDerWaalsContact O-N 3.12Å; N1126-H1130 PolarHBondContact OD1-CD2 2.57Å
1127	A	57.4	Low	55.7	Low	43 Å²	43	66 Å²	66	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-71.5	-40.3	175	0	0	0	0	0	112.1	F1124 I1125 I1129 K1131	F1124-A1127 WeakPolarHBondContact O-CA 3.41Å; F1124-A1127 WeakPolarHBondContact O-CB 3.16Å; F1124-A1127 PolarHBondContact O-N 3.22Å; I1125-A1127 VanDerWaalsContact C-N 3.33Å; I1125-A1127 PolarHBondContact O-N 3.3Å; A1127-I1129 PolarHBondContact O-N 3.14Å; A1127-K1131 WeakPolarHBondContact O-CA 3.41Å; A1127-K1131 VanDerWaalsContact O-CB 3.27Å; A1127-K1131 WeakPolarHBondContact O-CB 3.19Å; A1127-K1131 PolarHBondContact O-N 3Å
1128	I	60	Low	54.2	Low	26 Å²	26	66.5 Å²	66.5	13%	0.133	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-46.4	178.1	-66	165.7	0	0	0	110.6	F1124 I1125 G1132 F1133 L1186	F1124-I1128 HydrophobicContact CB-CD1 4.38Å; F1124-I1128 WeakPolarHBondContact O-CG1 3.36Å; F1124-I1128 PolarHBondContact O-N 3.22Å; I1125-I1128 PolarHBondContact O-N 3.42Å; I1128-G1132 WeakPolarHBondContact O-CA 3.46Å; I1128-G1132 PolarHBondContact O-N 3.3Å; I1128-F1133 HydrophobicContact CG2-CE2 4Å; I1128-F1133 HydrophobicContact CG2-CZ 4.28Å; I1128-L1186 HydrophobicContact CB-CD1 4.29Å; I1128-L1186 HydrophobicContact CD1-CD1 4.25Å; I1128-L1186 HydrophobicContact CG2-CD1 3.85Å
1129	I	60.9	Low	53.3	Low	4 Å²	4	69.3 Å²	69.3	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-69.9	-51.2	-178.9	-70.9	-63.2	0	0	0	112.1	T1042 L1044 V1089 I1125 A1127 L1186 L1241	T1042-I1129 VanDerWaalsContact CB-O 3.27Å; T1042-I1129 WeakPolarHBondContact CB-O 3.24Å; T1042-I1129 HydrophobicContact CG2-CG2 4.44Å; T1042-I1129 PolarHBondContact OG1-O 3.11Å; L1044-I1129 HydrophobicContact CD1-CG2 4.02Å; L1044-I1129 HydrophobicContact CD2-CD1 4.36Å; L1044-I1129 HydrophobicContact CD2-CG2 3.91Å; L1044-I1129 HydrophobicContact CG-CG2 4.13Å; V1089-I1129 HydrophobicContact CB-CD1 4.4Å; V1089-I1129 HydrophobicContact CG1-CD1 3.83Å; V1089-I1129 HydrophobicContact CG2-CD1 3.58Å; I1125-I1129 WeakPolarHBondContact O-CG1 3.4Å; I1125-I1129 PolarHBondContact O-N 3.42Å; A1127-I1129 PolarHBondContact O-N 3.14Å; I1129-L1186 HydrophobicContact CD1-CD2 3.63Å; I1129-L1186 HydrophobicContact CG1-CD2 3.92Å; I1129-L1241 HydrophobicContact CG1-CD2 4.48Å
1130	H	56.8	Low	52.1	Low	127 Å²	127	72.6 Å²	72.6	59%	0.588	35%	0.353	S	S	*	.	H	α-helix	trans	-87.1	-23.3	-170.4	-69.1	-79.5	0	0	0	114.9	N1126	N1126-H1130 WeakPolarHBondContact O-CB 3.33Å; N1126-H1130 PolarHBondContact O-CD2 3.13Å; N1126-H1130 VanDerWaalsContact O-CD2 3.29Å; N1126-H1130 PolarHBondContact O-N 2.6Å; N1126-H1130 VanDerWaalsContact O-N 3.12Å; N1126-H1130 PolarHBondContact OD1-CD2 2.57Å
1131	K	51.5	Low	50.7	Low	178 Å²	178	71.8 Å²	71.8	77%	0.774	36%	0.356	S	S	*	.	H	α-helix	trans	-103.2	-20.6	177.1	-55.8	-172.6	176.8	-174.6	0	113.3	A1127	A1127-K1131 WeakPolarHBondContact O-CA 3.41Å; A1127-K1131 VanDerWaalsContact O-CB 3.27Å; A1127-K1131 WeakPolarHBondContact O-CB 3.19Å; A1127-K1131 PolarHBondContact O-N 3Å
1132	G	50.4	Low	49.6	Very low	19 Å²	19	73.1 Å²	73.1	20%	0.196	37%	0.371	C	S	.	.			trans	69.1	170.9	-177.9	0	0	0	0	0	113.9	I1128 D1134	I1128-G1132 WeakPolarHBondContact O-CA 3.46Å; I1128-G1132 PolarHBondContact O-N 3.3Å; G1132-D1134 PolarHBondContact O-N 2.85Å
1133	F	52	Low	48.6	Very low	38 Å²	38	77.8 Å²	77.8	17%	0.167	39%	0.392	C	S	.	.			trans	-76.6	88.7	170.9	-70.3	-87.5	0	0	0	110.2	L1094 R1097 I1128 A1138 P1238	L1094-F1133 HydrophobicContact CD1-CB 3.95Å; L1094-F1133 HydrophobicContact CD1-CD2 3.9Å; L1094-F1133 HydrophobicContact CD1-CG 4.35Å; L1094-F1133 HydrophobicContact CD2-CD2 4.01Å; R1097-F1133 PolarHBondContact NH2-O 3.18Å; I1128-F1133 HydrophobicContact CG2-CE2 4Å; I1128-F1133 HydrophobicContact CG2-CZ 4.28Å; F1133-A1138 HydrophobicContact CB-CB 4.06Å; F1133-P1238 HydrophobicContact CE2-CG 4.37Å
1134	D	42.1	Very low	48.2	Very low	61 Å²	61	78 Å²	78	33%	0.326	39%	0.388	S	S	.	.			trans	-67.2	142.4	168.5	167.9	37.9	0	0	0	111	G1132 R1136 H1137 A1138	G1132-D1134 PolarHBondContact O-N 2.85Å; D1134-R1136 PolarHBondContact O-N 3.16Å; D1134-R1136 VanDerWaalsContact O-N 3.14Å; D1134-R1136 IonicContact OD2-NE 3.76Å; D1134-H1137 CarbonylContact O-C 3.54Å; D1134-H1137 WeakPolarHBondContact O-CA 3.46Å; D1134-H1137 PolarHBondContact O-N 2.81Å; D1134-H1137 IonicContact OD2-CE1 3.18Å; D1134-H1137 IonicContact OD2-ND1 3.16Å; D1134-H1137 PolarHBondContact OD2-ND1 2.56Å; D1134-A1138 WeakPolarHBondContact O-CA 3.49Å; D1134-A1138 WeakPolarHBondContact O-CB 3.32Å; D1134-A1138 PolarHBondContact O-N 3.29Å
1135	E	37.7	Very low	47.6	Very low	150 Å²	150	72.9 Å²	72.9	70%	0.701	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.8	-172.4	-66.5	-175.6	165.6	0	0	114.2	R1097 H1137	R1097-E1135 VanDerWaalsContact NH1-CG 3.32Å; R1097-E1135 IonicContact NH1-OE1 2.65Å; R1097-E1135 PolarHBondContact NH1-OE1 2.99Å; E1135-H1137 PolarHBondContact O-N 3.23Å
1136	R	38.3	Very low	46.2	Very low	215 Å²	215	76 Å²	76	81%	0.811	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-11.3	171.6	-67.3	177.3	-72.8	-149.9	-5.2	113.8	D1134	D1134-R1136 PolarHBondContact O-N 3.16Å; D1134-R1136 VanDerWaalsContact O-N 3.14Å; D1134-R1136 IonicContact OD2-NE 3.76Å
1137	H	41.5	Very low	45.2	Very low	133 Å²	133	72.2 Å²	72.2	62%	0.616	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	-6.8	-177.2	-58.8	95	0	0	0	113.2	D1134 E1135 Y1139	D1134-H1137 CarbonylContact O-C 3.54Å; D1134-H1137 WeakPolarHBondContact O-CA 3.46Å; D1134-H1137 PolarHBondContact O-N 2.81Å; D1134-H1137 IonicContact OD2-CE1 3.18Å; D1134-H1137 IonicContact OD2-ND1 3.16Å; D1134-H1137 PolarHBondContact OD2-ND1 2.56Å; E1135-H1137 PolarHBondContact O-N 3.23Å; H1137-Y1139 PolarHBondContact O-N 3.08Å
1138	A	39	Very low	44.5	Very low	35 Å²	35	72.4 Å²	72.4	29%	0.289	38%	0.377	S	S	.	.			trans	-79.1	33	-168.7	0	0	0	0	0	114.1	F1133 D1134	F1133-A1138 HydrophobicContact CB-CB 4.06Å; D1134-A1138 WeakPolarHBondContact O-CA 3.49Å; D1134-A1138 WeakPolarHBondContact O-CB 3.32Å; D1134-A1138 PolarHBondContact O-N 3.29Å
1139	Y	47.7	Very low	43.5	Very low	89 Å²	89	73.5 Å²	73.5	35%	0.349	38%	0.38	S	S	.	.			trans	-137.7	46.8	-172.8	-125.8	-94.1	0	0	0	115	H1137 G1141 I1230 Y1231 R1232 G1233	H1137-Y1139 PolarHBondContact O-N 3.08Å; Y1139-G1141 PolarHBondContact O-N 3.17Å; Y1139-I1230 HydrophobicContact CD1-CB 4.27Å; Y1139-I1230 HydrophobicContact CD1-CG2 3.31Å; Y1139-I1230 HydrophobicContact CE1-CG2 3.98Å; Y1139-I1230 HydrophobicContact CG-CG2 3.84Å; Y1139-Y1231 WeakPolarHBondContact CE1-O 3.43Å; Y1139-R1232 WeakPolarHBondContact OH-CA 3.46Å; Y1139-G1233 PolarHBondContact OH-N 3.01Å
1140	I	42.6	Very low	42.5	Very low	73 Å²	73	79.1 Å²	79.1	37%	0.374	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	29.7	173.8	-44.2	-178.5	0	0	0	111.2	G1142 M1143 F1144	I1140-G1142 PolarHBondContact O-N 2.86Å; I1140-G1142 VanDerWaalsContact O-N 3.14Å; I1140-M1143 HydrophobicContact CG2-CB 3.91Å; I1140-M1143 HydrophobicContact CG2-CG 4.45Å; I1140-M1143 PolarHBondContact O-N 3.5Å; I1140-F1144 HydrophobicContact CB-CD2 3.78Å; I1140-F1144 HydrophobicContact CB-CE2 3.9Å; I1140-F1144 HydrophobicContact CD1-CE2 4.45Å; I1140-F1144 HydrophobicContact CG2-CD2 3.61Å; I1140-F1144 HydrophobicContact CG2-CE2 3.71Å; I1140-F1144 WeakPolarHBondContact O-CD2 3.44Å; I1140-F1144 PolarHBondContact O-N 2.9Å
1141	G	39.2	Very low	41.6	Very low	27 Å²	27	77.2 Å²	77.2	28%	0.278	41%	0.41	S	S	.	.	H	α-helix	trans	-58.8	-24.8	174.7	0	0	0	0	0	113.1	Y1139 G1145	Y1139-G1141 PolarHBondContact O-N 3.17Å; G1141-G1145 PolarHBondContact O-N 3.24Å
1142	G	37.1	Very low	40.7	Very low	30 Å²	30	75.6 Å²	75.6	31%	0.309	41%	0.406	S	S	.	.	H	α-helix	trans	-67.5	-41.6	175.6	0	0	0	0	0	114.8	I1140 A1146	I1140-G1142 PolarHBondContact O-N 2.86Å; I1140-G1142 VanDerWaalsContact O-N 3.14Å; G1142-A1146 WeakPolarHBondContact O-CB 3.48Å; G1142-A1146 PolarHBondContact O-N 3.14Å
1143	M	39.4	Very low	40	Very low	112 Å²	112	82 Å²	82	55%	0.552	44%	0.436	S	S	*	.	H	α-helix	trans	-93	-37.2	-177.3	-67.2	178.9	70.2	0	0	113.2	I1140 G1147	I1140-M1143 HydrophobicContact CG2-CB 3.91Å; I1140-M1143 HydrophobicContact CG2-CG 4.45Å; I1140-M1143 PolarHBondContact O-N 3.5Å; M1143-G1147 PolarHBondContact O-N 2.78Å
1144	F	42.2	Very low	39.4	Very low	47 Å²	47	81.5 Å²	81.5	21%	0.206	44%	0.437	C	S	.	.	H	α-helix	trans	-71.1	-38.4	177.9	-75.3	-80	0	0	0	112.3	H1120 I1140	H1120-F1144 HydrophobicContact CB-CE1 4.47Å; H1120-F1144 AromaticContact CD2-CE1 3.45Å; H1120-F1144 VanDerWaalsContact CD2-CE1 3.45Å; H1120-F1144 WeakPolarHBondContact CD2-CE1 3.43Å; H1120-F1144 AromaticContact CD2-CZ 3.72Å; H1120-F1144 AromaticContact CE1-CE1 3.5Å; H1120-F1144 AromaticContact CE1-CZ 3.94Å; H1120-F1144 AromaticContact CG-CE1 3.66Å; H1120-F1144 AromaticContact ND1-CE1 3.7Å; H1120-F1144 AromaticContact NE2-CE1 3.34Å; H1120-F1144 VanDerWaalsContact NE2-CE1 3.34Å; H1120-F1144 WeakPolarHBondContact NE2-CE1 3.39Å; H1120-F1144 AromaticContact NE2-CZ 3.4Å; H1120-F1144 WeakPolarHBondContact NE2-CZ 3.49Å; I1140-F1144 HydrophobicContact CB-CD2 3.78Å; I1140-F1144 HydrophobicContact CB-CE2 3.9Å; I1140-F1144 HydrophobicContact CD1-CE2 4.45Å; I1140-F1144 HydrophobicContact CG2-CD2 3.61Å; I1140-F1144 HydrophobicContact CG2-CE2 3.71Å; I1140-F1144 WeakPolarHBondContact O-CD2 3.44Å; I1140-F1144 PolarHBondContact O-N 2.9Å
1145	G	38.8	Very low	39.1	Very low	16 Å²	16	83.2 Å²	83.2	17%	0.165	45%	0.453	C	S	.	.	H	α-helix	trans	-75.6	-59.2	176.2	0	0	0	0	0	112.9	G1141 G1147 I1148 Y1149	G1141-G1145 PolarHBondContact O-N 3.24Å; G1145-G1147 VanDerWaalsContact C-N 3.28Å; G1145-G1147 PolarHBondContact O-N 3.38Å; G1145-I1148 PolarHBondContact O-N 3.45Å; G1145-Y1149 VanDerWaalsContact O-CD2 3.31Å; G1145-Y1149 WeakPolarHBondContact O-CD2 3.23Å
1146	A	34.6	Very low	38.9	Very low	67 Å²	67	82.7 Å²	82.7	55%	0.554	45%	0.449	S	S	*	.	H	α-helix	trans	-68.8	-22.1	-168.2	0	0	0	0	0	114.7	G1142	G1142-A1146 WeakPolarHBondContact O-CB 3.48Å; G1142-A1146 PolarHBondContact O-N 3.14Å
1147	G	40.5	Very low	38.9	Very low	26 Å²	26	72.7 Å²	72.7	27%	0.268	41%	0.412	S	S	.	.	H	α-helix	trans	-81.1	-25.5	179	0	0	0	0	0	114.8	M1143 G1145 S1157	M1143-G1147 PolarHBondContact O-N 2.78Å; G1145-G1147 VanDerWaalsContact C-N 3.28Å; G1145-G1147 PolarHBondContact O-N 3.38Å; G1147-S1157 WeakPolarHBondContact O-CB 3.28Å
1148	I	41.3	Very low	38.5	Very low	48 Å²	48	69.4 Å²	69.4	25%	0.246	40%	0.399	C	S	.	.	H	α-helix	trans	-104.4	-26	-165	-71.6	178.9	0	0	0	113.4	L1118 G1145 F1150 A1205	L1118-I1148 HydrophobicContact CD1-CD1 3.89Å; L1118-I1148 HydrophobicContact CD1-CG2 4.37Å; L1118-I1148 HydrophobicContact CD2-CD1 4.41Å; L1118-I1148 HydrophobicContact CD2-CG2 3.93Å; G1145-I1148 PolarHBondContact O-N 3.45Å; I1148-F1150 VanDerWaalsContact C-N 3.32Å; I1148-F1150 PolarHBondContact O-N 3.47Å; I1148-F1150 VanDerWaalsContact O-N 3.14Å; I1148-A1205 HydrophobicContact CG1-CB 4.44Å; I1148-A1205 HydrophobicContact CG2-CB 3.78Å
1149	Y	39.3	Very low	38.3	Very low	48 Å²	48	72.2 Å²	72.2	19%	0.188	41%	0.406	C	S	.	.	S	Bend	trans	-69.2	-15.9	-165.8	-95.2	-64.7	0	0	0	117.7	G1145 L1192 F1196	G1145-Y1149 VanDerWaalsContact O-CD2 3.31Å; G1145-Y1149 WeakPolarHBondContact O-CD2 3.23Å; Y1149-L1192 WeakPolarHBondContact OH-CD1 2.8Å; Y1149-L1192 WeakPolarHBondContact OH-CD2 3.25Å; Y1149-F1196 AromaticContact CD1-CD1 3.88Å; Y1149-F1196 HydrophobicContact CD1-CD1 3.88Å; Y1149-F1196 AromaticContact CD1-CE1 3.85Å; Y1149-F1196 HydrophobicContact CD1-CE1 3.85Å; Y1149-F1196 HydrophobicContact CD2-CD1 4.46Å; Y1149-F1196 AromaticContact CD2-CE1 3.66Å; Y1149-F1196 HydrophobicContact CD2-CE1 3.66Å; Y1149-F1196 HydrophobicContact CD2-CZ 4.04Å; Y1149-F1196 AromaticContact CE1-CD1 3.29Å; Y1149-F1196 HydrophobicContact CE1-CD1 3.29Å; Y1149-F1196 AromaticContact CE1-CE1 3.5Å; Y1149-F1196 HydrophobicContact CE1-CE1 3.5Å; Y1149-F1196 AromaticContact CE1-CG 3.95Å; Y1149-F1196 HydrophobicContact CE1-CG 3.95Å; Y1149-F1196 HydrophobicContact CE1-CZ 4.3Å; Y1149-F1196 AromaticContact CE2-CD1 3.95Å; Y1149-F1196 HydrophobicContact CE2-CD1 3.95Å; Y1149-F1196 AromaticContact CE2-CE1 3.29Å; Y1149-F1196 HydrophobicContact CE2-CE1 3.29Å; Y1149-F1196 HydrophobicContact CE2-CE2 4.11Å; Y1149-F1196 AromaticContact CE2-CZ 3.38Å; Y1149-F1196 HydrophobicContact CE2-CZ 3.38Å; Y1149-F1196 HydrophobicContact CG-CD1 4.43Å; Y1149-F1196 AromaticContact CG-CE1 3.93Å; Y1149-F1196 HydrophobicContact CG-CE1 3.93Å; Y1149-F1196 AromaticContact CZ-CD1 3.32Å; Y1149-F1196 AromaticContact CZ-CE1 3.18Å; Y1149-F1196 AromaticContact CZ-CE2 3.95Å; Y1149-F1196 AromaticContact CZ-CG 3.76Å; Y1149-F1196 AromaticContact CZ-CZ 3.52Å; Y1149-F1196 WeakPolarHBondContact OH-CD1 3.49Å; Y1149-F1196 WeakPolarHBondContact OH-CD2 3.33Å; Y1149-F1196 WeakPolarHBondContact OH-CE2 3.36Å; Y1149-F1196 WeakPolarHBondContact OH-CG 3.17Å
1150	F	40.8	Very low	37.8	Very low	123 Å²	123	74.5 Å²	74.5	54%	0.539	42%	0.415	S	S	.	.			trans	-143.8	76.8	-178	-60.3	-74.5	0	0	0	112.3	I1148 E1152 S1157	I1148-F1150 VanDerWaalsContact C-N 3.32Å; I1148-F1150 PolarHBondContact O-N 3.47Å; I1148-F1150 VanDerWaalsContact O-N 3.14Å; F1150-E1152 PolarHBondContact O-N 2.97Å; F1150-S1157 PolarHBondContact O-OG 3.24Å
1151	A	38.3	Very low	37.3	Very low	86 Å²	86	75 Å²	75	71%	0.711	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	72.4	164.2	0	0	0	0	0	110.9
1152	E	32.8	Very low	37.1	Very low	145 Å²	145	83 Å²	83	68%	0.678	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-173.3	-36.3	145.8	-106.9	162	-166.9	0	0	110.5	F1150	F1150-E1152 PolarHBondContact O-N 2.97Å
1153	N	35.8	Very low	36.9	Very low	153 Å²	153	82.5 Å²	82.5	82%	0.818	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	10.1	-168.7	-70.3	-47	0	0	0	117.2
1154	S	38.8	Very low	36.6	Very low	28 Å²	28	83.8 Å²	83.8	20%	0.196	45%	0.447	C	S	.	.			trans	-89.7	123.9	172.6	165.7	0	0	0	0	111.8	K1156 S1157 N1158	S1154-K1156 PolarHBondContact O-N 3.38Å; S1154-K1156 PolarHBondContact OG-N 2.96Å; S1154-S1157 VanDerWaalsContact CB-OG 3.26Å; S1154-S1157 WeakPolarHBondContact CB-OG 3.39Å; S1154-S1157 PolarHBondContact O-N 3.29Å; S1154-S1157 PolarHBondContact O-OG 3.32Å; S1154-S1157 PolarHBondContact OG-N 3.21Å; S1154-N1158 PolarHBondContact O-N 2.57Å
1155	S	34.8	Very low	36.6	Very low	96 Å²	96	85 Å²	85	67%	0.671	47%	0.473	S	S	*	.	H	α-helix	trans	-63.3	-27.2	178.7	55.1	0	0	0	0	113.2	Q1159	S1155-Q1159 WeakPolarHBondContact O-CG 3.42Å; S1155-Q1159 PolarHBondContact O-N 3.26Å
1156	K	35	Very low	36.8	Very low	139 Å²	139	85.1 Å²	85.1	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-80.8	-36.1	174	-80.4	-173.6	174.4	-178.5	0	113.3	S1154 Q1159 Y1160	S1154-K1156 PolarHBondContact O-N 3.38Å; S1154-K1156 PolarHBondContact OG-N 2.96Å; K1156-Q1159 WeakPolarHBondContact O-CB 3.45Å; K1156-Q1159 PolarHBondContact O-N 2.98Å; K1156-Y1160 WeakPolarHBondContact O-CD2 3.48Å; K1156-Y1160 PolarHBondContact O-N 3.27Å
1157	S	37.6	Very low	37.5	Very low	5 Å²	5	82.8 Å²	82.8	4%	0.035	46%	0.456	C	S	.	.	H	α-helix	trans	-70.2	-37.9	175.4	58.8	0	0	0	0	111	G1147 F1150 S1154 Q1159 Y1160 V1161	G1147-S1157 WeakPolarHBondContact O-CB 3.28Å; F1150-S1157 PolarHBondContact O-OG 3.24Å; S1154-S1157 VanDerWaalsContact CB-OG 3.26Å; S1154-S1157 WeakPolarHBondContact CB-OG 3.39Å; S1154-S1157 PolarHBondContact O-N 3.29Å; S1154-S1157 PolarHBondContact O-OG 3.32Å; S1154-S1157 PolarHBondContact OG-N 3.21Å; S1157-Q1159 VanDerWaalsContact C-N 3.25Å; S1157-Q1159 PolarHBondContact O-N 2.93Å; S1157-Y1160 CarbonylContact O-C 3.36Å; S1157-Y1160 WeakPolarHBondContact O-CA 3.43Å; S1157-Y1160 PolarHBondContact O-N 3Å; S1157-V1161 WeakPolarHBondContact O-CG2 3.44Å; S1157-V1161 PolarHBondContact O-N 3.23Å
1158	N	33.1	Very low	38	Very low	65 Å²	65	86.4 Å²	86.4	35%	0.348	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-29.5	172.3	-76	-18	0	0	0	112.8	S1154 Y1160 V1161 Y1162	S1154-N1158 PolarHBondContact O-N 2.57Å; N1158-Y1160 VanDerWaalsContact C-N 3.25Å; N1158-Y1160 PolarHBondContact O-N 3.33Å; N1158-V1161 PolarHBondContact O-N 2.85Å; N1158-Y1162 WeakPolarHBondContact O-CB 3.48Å; N1158-Y1162 PolarHBondContact O-N 3.39Å
1159	Q	35.5	Very low	38.9	Very low	94 Å²	94	84.5 Å²	84.5	44%	0.439	47%	0.466	S	S	.	.	H	α-helix	trans	-70.5	-11.8	169.1	-78.7	175.6	-8.9	0	0	114.7	S1155 K1156 S1157 G1163 I1164	S1155-Q1159 WeakPolarHBondContact O-CG 3.42Å; S1155-Q1159 PolarHBondContact O-N 3.26Å; K1156-Q1159 WeakPolarHBondContact O-CB 3.45Å; K1156-Q1159 PolarHBondContact O-N 2.98Å; S1157-Q1159 VanDerWaalsContact C-N 3.25Å; S1157-Q1159 PolarHBondContact O-N 2.93Å; Q1159-G1163 CarbonylContact O-C 3.49Å; Q1159-G1163 WeakPolarHBondContact O-CA 3.32Å; Q1159-G1163 PolarHBondContact O-N 2.9Å; Q1159-G1163 VanDerWaalsContact O-N 3.07Å; Q1159-I1164 HydrophobicContact CB-CD1 4.41Å; Q1159-I1164 HydrophobicContact CB-CG1 4.25Å; Q1159-I1164 HydrophobicContact CG-CD1 4.1Å; Q1159-I1164 HydrophobicContact CG-CG1 4.09Å; Q1159-I1164 PolarHBondContact O-N 3.03Å
1160	Y	36.2	Very low	40	Very low	137 Å²	137	82.2 Å²	82.2	54%	0.537	46%	0.457	S	S	.	.	H	α-helix	trans	-102.6	-29.2	170.4	-68.8	-67.4	0	0	0	112.8	K1156 S1157 N1158 H1211	K1156-Y1160 WeakPolarHBondContact O-CD2 3.48Å; K1156-Y1160 PolarHBondContact O-N 3.27Å; S1157-Y1160 CarbonylContact O-C 3.36Å; S1157-Y1160 WeakPolarHBondContact O-CA 3.43Å; S1157-Y1160 PolarHBondContact O-N 3Å; N1158-Y1160 VanDerWaalsContact C-N 3.25Å; N1158-Y1160 PolarHBondContact O-N 3.33Å; Y1160-H1211 PolarHBondContact O-CE1 2.89Å
1161	V	33.5	Very low	40.8	Very low	83 Å²	83	78.7 Å²	78.7	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-71.2	-39.5	172	175.3	0	0	0	0	111.1	S1157 N1158	S1157-V1161 WeakPolarHBondContact O-CG2 3.44Å; S1157-V1161 PolarHBondContact O-N 3.23Å; N1158-V1161 PolarHBondContact O-N 2.85Å
1162	Y	35.1	Very low	42.2	Very low	194 Å²	194	78.5 Å²	78.5	76%	0.761	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-12.4	175.4	-70.7	-83.5	0	0	0	114.3	N1158	N1158-Y1162 WeakPolarHBondContact O-CB 3.48Å; N1158-Y1162 PolarHBondContact O-N 3.39Å
1163	G	32.8	Very low	44	Very low	20 Å²	20	75.9 Å²	75.9	21%	0.206	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	110.1	167.3	0	0	0	0	0	116.5	Q1159 G1165 G1166	Q1159-G1163 CarbonylContact O-C 3.49Å; Q1159-G1163 WeakPolarHBondContact O-CA 3.32Å; Q1159-G1163 PolarHBondContact O-N 2.9Å; Q1159-G1163 VanDerWaalsContact O-N 3.07Å; G1163-G1165 VanDerWaalsContact C-N 3.29Å; G1163-G1165 PolarHBondContact O-N 3Å; G1163-G1166 PolarHBondContact O-N 3.27Å; G1163-G1166 VanDerWaalsContact O-N 3.13Å
1164	I	33	Very low	45.6	Very low	140 Å²	140	76.6 Å²	76.6	72%	0.718	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	97.8	149.6	-62.9	178.2	0	0	0	106.7	Q1159	Q1159-I1164 HydrophobicContact CB-CD1 4.41Å; Q1159-I1164 HydrophobicContact CB-CG1 4.25Å; Q1159-I1164 HydrophobicContact CG-CD1 4.1Å; Q1159-I1164 HydrophobicContact CG-CG1 4.09Å; Q1159-I1164 PolarHBondContact O-N 3.03Å
1165	G	41.7	Very low	46.9	Very low	73 Å²	73	77 Å²	77	75%	0.753	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	36.5	-170.7	0	0	0	0	0	114.1	G1163 G1167	G1163-G1165 VanDerWaalsContact C-N 3.29Å; G1163-G1165 PolarHBondContact O-N 3Å; G1165-G1167 PolarHBondContact O-N 3.37Å
1166	G	42.9	Very low	48.6	Very low	17 Å²	17	76 Å²	76	18%	0.175	40%	0.401	C	S	.	.			trans	-36	121.7	-175.2	0	0	0	0	0	114.9	G1163 R1176	G1163-G1166 PolarHBondContact O-N 3.27Å; G1163-G1166 VanDerWaalsContact O-N 3.13Å; G1166-R1176 PolarHBondContact O-NH2 3.31Å
1167	G	49.2	Very low	50.5	Low	18 Å²	18	69.4 Å²	69.4	19%	0.186	37%	0.373	C	S	.	.			trans	-41.5	134.5	-163.4	0	0	0	0	0	114.4	G1165 G1169 R1176	G1165-G1167 PolarHBondContact O-N 3.37Å; G1167-G1169 PolarHBondContact O-N 3.06Å; G1167-R1176 WeakPolarHBondContact O-CG 3.3Å; G1167-R1176 PolarHBondContact O-NE 3.38Å
1168	T	51.1	Low	52.4	Low	102 Å²	102	69.2 Å²	69.2	63%	0.626	37%	0.371	S	S	*	.			trans	-70.8	0.8	-173.4	49.4	0	0	0	0	114.3
1169	G	59.1	Low	54.7	Low	9 Å²	9	68.2 Å²	68.2	9%	0.093	36%	0.363	C	S	.	.			trans	76.8	-154.6	-178.8	0	0	0	0	0	113.2	G1167 P1171 D1175	G1167-G1169 PolarHBondContact O-N 3.06Å; G1169-P1171 VanDerWaalsContact O-CD 3.27Å; G1169-P1171 WeakPolarHBondContact O-CD 3.39Å; G1169-D1175 CarbonylContact C-O 3.4Å; G1169-D1175 WeakPolarHBondContact CA-O 3.29Å
1170	C	63.1	Low	56.9	Low	0 Å²	0	69.4 Å²	69.4	0%	0	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-62.3	118.5	169.9	173	0	0	0	0	109.4	T1172 H1173 K1174 D1175 C1178 C1181	C1170-T1172 PolarHBondContact O-N 3.16Å; C1170-T1172 VanDerWaalsContact O-N 3.14Å; C1170-H1173 HydrophobicContact CB-CB 4.39Å; C1170-H1173 PolarHBondContact O-N 3.38Å; C1170-H1173 PolarHBondContact SG-ND1 3.32Å; C1170-K1174 VanDerWaalsContact O-CA 3.31Å; C1170-K1174 WeakPolarHBondContact O-CA 3.4Å; C1170-K1174 PolarHBondContact O-N 3.4Å; C1170-D1175 PolarHBondContact N-O 3.1Å; C1170-C1178 HydrophobicContact CB-CB 3.41Å; C1170-C1178 VanDerWaalsContact CB-CB 3.41Å; C1170-C1181 PolarHBondContact SG-SG 3.5Å
1171	P	58.2	Low	59.1	Low	48 Å²	48	64 Å²	64	31%	0.312	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.5	-175.9	-25	35.3	0	0	0	113.9	G1169	G1169-P1171 VanDerWaalsContact O-CD 3.27Å; G1169-P1171 WeakPolarHBondContact O-CD 3.39Å
1172	T	66.3	Low	61.5	Low	83 Å²	83	63.7 Å²	63.7	51%	0.509	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-45.8	179.6	-49.7	0	0	0	0	112.1	C1170 R1217	C1170-T1172 PolarHBondContact O-N 3.16Å; C1170-T1172 VanDerWaalsContact O-N 3.14Å; T1172-R1217 PolarHBondContact OG1-NH1 3.49Å
1173	H	71.6	Confident	63.8	Low	90 Å²	90	54.6 Å²	54.6	42%	0.417	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-7.5	-173.9	-57.5	119.8	0	0	0	113.6	C1170 D1175 C1178 C1181	C1170-H1173 HydrophobicContact CB-CB 4.39Å; C1170-H1173 PolarHBondContact O-N 3.38Å; C1170-H1173 PolarHBondContact SG-ND1 3.32Å; H1173-D1175 HydrophobicContact CB-CB 4.5Å; H1173-D1175 PolarHBondContact O-N 2.8Å; H1173-D1175 VanDerWaalsContact O-N 3.14Å; H1173-C1178 PolarHBondContact ND1-SG 2.91Å; H1173-C1178 VanDerWaalsContact ND1-SG 3.4Å; H1173-C1181 PolarHBondContact ND1-SG 3.21Å
1174	K	68.9	Low	66.1	Low	167 Å²	167	55.1 Å²	55.1	73%	0.726	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	27.5	-175.5	-57.8	-177.6	-179.1	178.9	0	114	C1170	C1170-K1174 VanDerWaalsContact O-CA 3.31Å; C1170-K1174 WeakPolarHBondContact O-CA 3.4Å; C1170-K1174 PolarHBondContact O-N 3.4Å
1175	D	67.6	Low	68.3	Low	38 Å²	38	48.5 Å²	48.5	20%	0.203	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-111.2	124.4	-179.2	174.8	-2.9	0	0	0	110	A1074 G1169 C1170 H1173 S1177 C1178	A1074-D1175 WeakPolarHBondContact O-CA 3.32Å; G1169-D1175 CarbonylContact C-O 3.4Å; G1169-D1175 WeakPolarHBondContact CA-O 3.29Å; C1170-D1175 PolarHBondContact N-O 3.1Å; H1173-D1175 HydrophobicContact CB-CB 4.5Å; H1173-D1175 PolarHBondContact O-N 2.8Å; H1173-D1175 VanDerWaalsContact O-N 3.14Å; D1175-S1177 WeakPolarHBondContact OD1-CA 3.3Å; D1175-S1177 PolarHBondContact OD1-N 3.4Å; D1175-C1178 HydrophobicContact CB-CB 4.01Å; D1175-C1178 VanDerWaalsContact CG-N 3.28Å; D1175-C1178 WeakPolarHBondContact O-CB 3.43Å; D1175-C1178 PolarHBondContact O-N 2.79Å; D1175-C1178 PolarHBondContact OD1-N 3.26Å; D1175-C1178 VanDerWaalsContact OD1-N 3.11Å; D1175-C1178 WeakPolarHBondContact OD2-CA 3.28Å; D1175-C1178 PolarHBondContact OD2-N 3.08Å
1176	R	68.9	Low	69.9	Low	73 Å²	73	45 Å²	45	28%	0.275	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-38.3	179.3	-75.1	-179.5	168.7	164.4	-0.1	113.4	D1070 G1166 G1167 R1183	D1070-R1176 IonicContact OD1-NH1 3.77Å; D1070-R1176 WeakPolarHBondContact OD2-CB 3.08Å; D1070-R1176 WeakPolarHBondContact OD2-CD 3.47Å; G1166-R1176 PolarHBondContact O-NH2 3.31Å; G1167-R1176 WeakPolarHBondContact O-CG 3.3Å; G1167-R1176 PolarHBondContact O-NE 3.38Å; R1176-R1183 PolarHBondContact O-NH2 2.88Å
1177	S	75.6	Confident	71.7	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.007	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	23.7	178.5	-61.7	0	0	0	0	112.6	G1076 D1175 Y1179	G1076-S1177 PolarHBondContact O-OG 3.46Å; D1175-S1177 WeakPolarHBondContact OD1-CA 3.3Å; D1175-S1177 PolarHBondContact OD1-N 3.4Å; S1177-Y1179 PolarHBondContact O-N 2.75Å
1178	C	76.3	Confident	73.1	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.226	C	C	.	.			trans	-38.7	106.8	-178.8	178.5	0	0	0	0	113.4	C1170 H1173 D1175 L1180	C1170-C1178 HydrophobicContact CB-CB 3.41Å; C1170-C1178 VanDerWaalsContact CB-CB 3.41Å; H1173-C1178 PolarHBondContact ND1-SG 2.91Å; H1173-C1178 VanDerWaalsContact ND1-SG 3.4Å; D1175-C1178 HydrophobicContact CB-CB 4.01Å; D1175-C1178 VanDerWaalsContact CG-N 3.28Å; D1175-C1178 WeakPolarHBondContact O-CB 3.43Å; D1175-C1178 PolarHBondContact O-N 2.79Å; D1175-C1178 PolarHBondContact OD1-N 3.26Å; D1175-C1178 VanDerWaalsContact OD1-N 3.11Å; D1175-C1178 WeakPolarHBondContact OD2-CA 3.28Å; D1175-C1178 PolarHBondContact OD2-N 3.08Å; C1178-L1180 VanDerWaalsContact C-N 3.26Å; C1178-L1180 PolarHBondContact O-N 3.27Å
1179	Y	82.8	Confident	74.2	Confident	45 Å²	45	42 Å²	42	18%	0.176	21%	0.206	C	C	.	.	S	Bend	trans	-74.8	-14.1	-178.9	-52.3	-77.6	0	0	0	113.4	G1076 V1077 F1078 S1177 Q1245 I1246 K1248	G1076-Y1179 VanDerWaalsContact C-OH 3.23Å; G1076-Y1179 VanDerWaalsContact CA-OH 3.25Å; G1076-Y1179 WeakPolarHBondContact CA-OH 3.4Å; V1077-Y1179 PolarHBondContact N-OH 2.88Å; V1077-Y1179 PolarHBondContact O-OH 3.11Å; F1078-Y1179 HydrophobicContact CB-CE1 4.39Å; S1177-Y1179 PolarHBondContact O-N 2.75Å; Y1179-Q1245 VanDerWaalsContact O-CG 3.25Å; Y1179-Q1245 WeakPolarHBondContact O-CG 3.45Å; Y1179-Q1245 PolarHBondContact O-NE2 3.49Å; Y1179-I1246 HydrophobicContact CD1-CB 4.16Å; Y1179-I1246 HydrophobicContact CD1-CG2 3.77Å; Y1179-I1246 HydrophobicContact CE1-CG2 3.85Å; Y1179-K1248 HydrophobicContact CD1-CB 3.66Å; Y1179-K1248 HydrophobicContact CD1-CG 4.28Å; Y1179-K1248 HydrophobicContact CD2-CB 4.37Å; Y1179-K1248 HydrophobicContact CD2-CD 4.44Å; Y1179-K1248 HydrophobicContact CD2-CG 4.34Å; Y1179-K1248 VanDerWaalsContact CE1-CA 3.47Å; Y1179-K1248 HydrophobicContact CE1-CB 3.83Å; Y1179-K1248 HydrophobicContact CE1-CG 4.07Å; Y1179-K1248 HydrophobicContact CE2-CD 4.44Å; Y1179-K1248 HydrophobicContact CE2-CG 4.14Å; Y1179-K1248 HydrophobicContact CG-CB 3.93Å; Y1179-K1248 HydrophobicContact CG-CG 4.39Å
1180	L	81.6	Confident	74.9	Confident	119 Å²	119	42.4 Å²	42.4	62%	0.623	21%	0.207	S	C	*	.	S	Bend	trans	-84.9	-36	-175.6	-59.7	177.9	0	0	0	112.7	C1178 Q1245	C1178-L1180 VanDerWaalsContact C-N 3.26Å; C1178-L1180 PolarHBondContact O-N 3.27Å; L1180-Q1245 PolarHBondContact O-NE2 2.93Å
1181	C	82	Confident	75.2	Confident	22 Å²	22	42.4 Å²	42.4	15%	0.149	21%	0.207	C	C	.	.	S	Bend	trans	-93.1	132.8	-169	-67.9	0	0	0	0	113.3	C1170 H1173 V1214	C1170-C1181 PolarHBondContact SG-SG 3.5Å; H1173-C1181 PolarHBondContact ND1-SG 3.21Å; C1181-V1214 HydrophobicContact CB-CG1 3.89Å
1182	H	84.9	Confident	75.7	Confident	78 Å²	78	40.8 Å²	40.8	36%	0.361	20%	0.195	S	C	.	.			trans	-66.6	137.9	168.6	-58.5	118.4	0	0	0	111.4	I1215 T1243	H1182-I1215 HydrophobicContact CB-CB 4.48Å; H1182-I1215 HydrophobicContact CB-CD1 4.07Å; H1182-I1215 HydrophobicContact CB-CG1 4.34Å; H1182-I1215 PolarHBondContact O-N 3.48Å; H1182-T1243 HydrophobicContact CB-CG2 4.33Å
1183	R	82.6	Confident	75.6	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.008	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	156.7	-177.5	-68.2	176.2	-176.3	-96.2	17.9	110.8	R1176 P1209 H1212 S1213 V1214 T1243 Y1244	R1176-R1183 PolarHBondContact O-NH2 2.88Å; R1183-P1209 VanDerWaalsContact CZ-O 3.32Å; R1183-P1209 PolarHBondContact NH1-O 2.96Å; R1183-H1212 HydrophobicContact CB-CB 4.39Å; R1183-H1212 PolarHBondContact NH1-O 3.26Å; R1183-S1213 CarbonylContact C-O 3.57Å; R1183-S1213 WeakPolarHBondContact CA-O 3.27Å; R1183-S1213 WeakPolarHBondContact CB-O 3.48Å; R1183-V1214 HydrophobicContact CG-CG2 4.11Å; R1183-T1243 CarbonylContact O-C 3.59Å; R1183-T1243 VanDerWaalsContact O-CA 3.3Å; R1183-T1243 WeakPolarHBondContact O-CA 3.22Å; R1183-Y1244 HydrophobicContact CB-CD1 4.29Å; R1183-Y1244 HydrophobicContact CB-CE1 3.56Å; R1183-Y1244 HydrophobicContact CB-CE2 4.33Å; R1183-Y1244 WeakPolarHBondContact CB-OH 3.27Å; R1183-Y1244 VanDerWaalsContact CD-OH 3.29Å; R1183-Y1244 WeakPolarHBondContact CD-OH 3.28Å; R1183-Y1244 PolarHBondContact N-O 2.98Å; R1183-Y1244 WeakPolarHBondContact O-CD1 3.33Å; R1183-Y1244 PolarHBondContact O-N 3.17Å
1184	Q	80.1	Confident	74.9	Confident	31 Å²	31	38.7 Å²	38.7	15%	0.145	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.1	177	-76.6	173.7	-27.2	0	0	110.9	I1125 S1213 I1215 L1241 I1242	I1125-Q1184 HydrophobicContact CD1-CB 4.29Å; I1125-Q1184 WeakPolarHBondContact CD1-O 3.18Å; I1125-Q1184 HydrophobicContact CG2-CB 4.41Å; Q1184-S1213 PolarHBondContact N-O 3.43Å; Q1184-I1215 HydrophobicContact CG-CD1 3.98Å; Q1184-I1215 HydrophobicContact CG-CG1 3.73Å; Q1184-L1241 HydrophobicContact CB-CD1 4.1Å; Q1184-L1241 HydrophobicContact CG-CD1 4.23Å; Q1184-I1242 CarbonylContact C-O 3.59Å; Q1184-I1242 WeakPolarHBondContact CA-O 3.36Å
1185	M	79.6	Confident	74.3	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	155.8	166.5	67.2	173.4	78.2	0	0	110.4	M1061 Y1081 F1119 H1120 H1212 I1242 Y1244	M1061-M1185 HydrophobicContact CE-CE 3.4Å; M1061-M1185 HydrophobicContact CE-CG 4.43Å; M1061-M1185 HydrophobicContact CE-SD 3.61Å; M1061-M1185 HydrophobicContact SD-SD 4.04Å; Y1081-M1185 HydrophobicContact CD2-CE 4.31Å; Y1081-M1185 HydrophobicContact CE2-CE 3.9Å; F1119-M1185 HydrophobicContact CB-SD 4.12Å; F1119-M1185 HydrophobicContact CD1-SD 3.57Å; F1119-M1185 VanDerWaalsContact CD1-SD 3.57Å; F1119-M1185 HydrophobicContact CE1-SD 4.4Å; F1119-M1185 HydrophobicContact CG-SD 4.21Å; H1120-M1185 WeakPolarHBondContact O-CA 3.3Å; M1185-H1212 WeakPolarHBondContact CE-ND1 3.43Å; M1185-I1242 HydrophobicContact CG-CB 4.11Å; M1185-I1242 PolarHBondContact N-O 3.24Å; M1185-I1242 PolarHBondContact O-N 2.95Å; M1185-Y1244 HydrophobicContact CB-CE1 4.48Å; M1185-Y1244 HydrophobicContact CE-CD1 3.69Å; M1185-Y1244 HydrophobicContact CE-CE1 3.25Å; M1185-Y1244 HydrophobicContact CE-CE2 4.2Å; M1185-Y1244 HydrophobicContact CE-CG 4.37Å; M1185-Y1244 HydrophobicContact CG-CD1 4.38Å; M1185-Y1244 HydrophobicContact CG-CE1 4.26Å
1186	L	76.3	Confident	73.7	Confident	1 Å²	1	38 Å²	38	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	139	172.1	-67.6	169.2	0	0	0	110.2	F1119 H1120 I1125 I1128 I1129 P1238 Y1240 L1241	F1119-L1186 CarbonylContact C-O 3.57Å; F1119-L1186 WeakPolarHBondContact CA-O 3.42Å; H1120-L1186 PolarHBondContact N-O 2.82Å; H1120-L1186 PolarHBondContact O-N 3.32Å; I1125-L1186 HydrophobicContact CB-CD1 4.48Å; I1125-L1186 HydrophobicContact CD1-CG 4.48Å; I1125-L1186 HydrophobicContact CG1-CD1 3.9Å; I1125-L1186 HydrophobicContact CG1-CG 3.93Å; I1125-L1186 HydrophobicContact CG2-CD1 4.41Å; I1125-L1186 HydrophobicContact CG2-CD2 4.35Å; I1125-L1186 HydrophobicContact CG2-CG 4.2Å; I1128-L1186 HydrophobicContact CB-CD1 4.29Å; I1128-L1186 HydrophobicContact CD1-CD1 4.25Å; I1128-L1186 HydrophobicContact CG2-CD1 3.85Å; I1129-L1186 HydrophobicContact CD1-CD2 3.63Å; I1129-L1186 HydrophobicContact CG1-CD2 3.92Å; L1186-P1238 HydrophobicContact CD1-CB 4.38Å; L1186-P1238 HydrophobicContact CD2-CB 4.34Å; L1186-Y1240 WeakPolarHBondContact CA-O 3.43Å; L1186-L1241 HydrophobicContact CD2-CB 4.02Å; L1186-L1241 HydrophobicContact CD2-CD1 3.88Å
1187	F	80.6	Confident	72.7	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.1	163.2	-171.5	-116.9	0	0	0	108.3	E1060 M1117 F1119 M1204 E1239 Y1240 I1242	E1060-F1187 HydrophobicContact CG-CZ 4.42Å; E1060-F1187 WeakPolarHBondContact OE2-CZ 3.46Å; M1117-F1187 HydrophobicContact CB-CD2 4.48Å; M1117-F1187 HydrophobicContact CB-CE1 4.2Å; M1117-F1187 HydrophobicContact CB-CE2 3.6Å; M1117-F1187 HydrophobicContact CB-CZ 3.47Å; M1117-F1187 VanDerWaalsContact CB-CZ 3.47Å; M1117-F1187 HydrophobicContact CE-CD1 3.63Å; M1117-F1187 HydrophobicContact CE-CE1 3.16Å; M1117-F1187 HydrophobicContact CE-CZ 3.72Å; M1117-F1187 HydrophobicContact CG-CE1 4.18Å; M1117-F1187 HydrophobicContact CG-CE2 4.37Å; M1117-F1187 HydrophobicContact CG-CZ 3.73Å; F1119-F1187 HydrophobicContact CD1-CB 4.38Å; F1119-F1187 AromaticContact CD1-CD2 3.69Å; F1119-F1187 HydrophobicContact CD1-CD2 3.69Å; F1119-F1187 HydrophobicContact CD1-CE2 4.47Å; F1119-F1187 AromaticContact CD2-CD2 4Å; F1119-F1187 HydrophobicContact CD2-CD2 4Å; F1119-F1187 HydrophobicContact CD2-CE2 4.11Å; F1119-F1187 HydrophobicContact CE1-CB 4.24Å; F1119-F1187 AromaticContact CE1-CD2 3.33Å; F1119-F1187 HydrophobicContact CE1-CD2 3.33Å; F1119-F1187 AromaticContact CE1-CE2 3.89Å; F1119-F1187 HydrophobicContact CE1-CE2 3.89Å; F1119-F1187 HydrophobicContact CE1-CG 4.13Å; F1119-F1187 AromaticContact CE2-CD2 3.67Å; F1119-F1187 HydrophobicContact CE2-CD2 3.67Å; F1119-F1187 AromaticContact CE2-CE2 3.47Å; F1119-F1187 HydrophobicContact CE2-CE2 3.47Å; F1119-F1187 VanDerWaalsContact CE2-CE2 3.47Å; F1119-F1187 HydrophobicContact CG-CD2 4.01Å; F1119-F1187 AromaticContact CZ-CD2 3.32Å; F1119-F1187 HydrophobicContact CZ-CD2 3.32Å; F1119-F1187 AromaticContact CZ-CE2 3.34Å; F1119-F1187 HydrophobicContact CZ-CE2 3.34Å; F1119-F1187 HydrophobicContact CZ-CG 4.39Å; F1119-F1187 HydrophobicContact CZ-CZ 4.4Å; F1187-M1204 HydrophobicContact CE2-SD 4.3Å; F1187-E1239 PolarHBondContact O-N 2.93Å; F1187-Y1240 HydrophobicContact CB-CD2 4.11Å; F1187-Y1240 AromaticContact CD1-CD2 3.44Å; F1187-Y1240 HydrophobicContact CD1-CD2 3.44Å; F1187-Y1240 VanDerWaalsContact CD1-CD2 3.44Å; F1187-Y1240 AromaticContact CD1-CE2 3.72Å; F1187-Y1240 HydrophobicContact CD1-CE2 3.72Å; F1187-Y1240 HydrophobicContact CE1-CD2 4.15Å; F1187-Y1240 HydrophobicContact CE1-CE2 4.02Å; F1187-Y1240 HydrophobicContact CG-CD2 4.18Å; F1187-Y1240 PolarHBondContact N-O 2.68Å; F1187-Y1240 PolarHBondContact O-N 2.82Å; F1187-I1242 HydrophobicContact CB-CD1 4.33Å
1188	C	77.1	Confident	71.4	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.074	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132	-173.7	-65.3	0	0	0	0	111.1	M1117 L1118 Y1237	M1117-C1188 WeakPolarHBondContact CA-O 3.48Å; L1118-C1188 PolarHBondContact N-O 2.87Å; L1118-C1188 PolarHBondContact O-N 2.84Å; C1188-Y1237 CarbonylContact C-O 3.45Å; C1188-Y1237 WeakPolarHBondContact CA-O 3.15Å
1189	R	75.6	Confident	69.9	Low	59 Å²	59	57.1 Å²	57.1	22%	0.223	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.5	168.2	-166.3	178.9	-69.6	-83.3	-12.1	109.6	Y1098 E1115 M1117 A1236 Y1237 E1239	Y1098-R1189 HydrophobicContact CE1-CG 4.2Å; Y1098-R1189 WeakPolarHBondContact CE2-O 3.34Å; Y1098-R1189 WeakPolarHBondContact OH-CG 3.25Å; E1115-R1189 WeakPolarHBondContact OE1-CD 3.27Å; E1115-R1189 IonicContact OE2-CZ 3.61Å; E1115-R1189 IonicContact OE2-NH1 2.92Å; E1115-R1189 PolarHBondContact OE2-NH1 3.28Å; M1117-R1189 HydrophobicContact CE-CB 3.82Å; M1117-R1189 HydrophobicContact CE-CG 4.12Å; M1117-R1189 HydrophobicContact SD-CB 3.99Å; M1117-R1189 HydrophobicContact SD-CG 3.74Å; R1189-A1236 CarbonylContact O-C 3.56Å; R1189-A1236 WeakPolarHBondContact O-CA 3.48Å; R1189-Y1237 PolarHBondContact N-O 2.96Å; R1189-Y1237 PolarHBondContact O-N 3.5Å; R1189-E1239 IonicContact CZ-OE2 2.75Å; R1189-E1239 IonicContact NE-OE1 2.76Å; R1189-E1239 IonicContact NE-OE2 3.61Å; R1189-E1239 PolarHBondContact NE-OE2 3.3Å; R1189-E1239 IonicContact NH2-OE1 3.83Å; R1189-E1239 IonicContact NH2-OE2 3.26Å; R1189-E1239 PolarHBondContact NH2-OE2 3.15Å
1190	V	72.6	Confident	68	Low	16 Å²	16	59.7 Å²	59.7	10%	0.097	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.7	-176.8	-167.7	0	0	0	0	109.6	E1115 R1116 L1118 L1192 Q1235 A1236	E1115-V1190 CarbonylContact C-O 3.58Å; E1115-V1190 WeakPolarHBondContact CA-O 3.37Å; R1116-V1190 PolarHBondContact N-O 3.29Å; R1116-V1190 PolarHBondContact O-N 3.32Å; L1118-V1190 HydrophobicContact CD1-CG2 3.82Å; L1118-V1190 HydrophobicContact CG-CG2 4.45Å; V1190-L1192 HydrophobicContact CB-CD2 4.49Å; V1190-L1192 HydrophobicContact CG1-CD2 3.71Å; V1190-Q1235 WeakPolarHBondContact CG1-O 3.38Å; V1190-A1236 HydrophobicContact CG1-CB 4.44Å; V1190-A1236 HydrophobicContact CG2-CB 3.74Å
1191	T	69.8	Low	66.4	Low	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.7	175.4	173.2	0	0	0	0	109.7	Y1098 R1101 Q1102 I1105 H1113	Y1098-T1191 HydrophobicContact CE2-CG2 3.83Å; Y1098-T1191 PolarHBondContact OH-N 3.24Å; R1101-T1191 HydrophobicContact CG-CG2 4.41Å; Q1102-T1191 HydrophobicContact CB-CG2 4.37Å; I1105-T1191 HydrophobicContact CD1-CG2 3.75Å; I1105-T1191 WeakPolarHBondContact CD1-OG1 3.42Å; H1113-T1191 PolarHBondContact O-OG1 2.98Å
1192	L	69.3	Low	64.5	Low	14 Å²	14	62.2 Å²	62.2	7%	0.073	32%	0.322	C	S	.	.			trans	-117.9	131.3	-164.7	-55.4	-180	0	0	0	113	I1105 N1114 R1116 Y1149 V1190 E1234	I1105-L1192 WeakPolarHBondContact CG2-O 3.39Å; N1114-L1192 WeakPolarHBondContact CB-O 3.46Å; N1114-L1192 PolarHBondContact ND2-O 2.86Å; N1114-L1192 PolarHBondContact O-N 3.3Å; R1116-L1192 HydrophobicContact CB-CD1 4.4Å; R1116-L1192 HydrophobicContact CG-CD1 3.76Å; Y1149-L1192 WeakPolarHBondContact OH-CD1 2.8Å; Y1149-L1192 WeakPolarHBondContact OH-CD2 3.25Å; V1190-L1192 HydrophobicContact CB-CD2 4.49Å; V1190-L1192 HydrophobicContact CG1-CD2 3.71Å; L1192-E1234 WeakPolarHBondContact CA-OE1 3.28Å
1193	G	63.2	Low	62.7	Low	9 Å²	9	66.1 Å²	66.1	9%	0.093	34%	0.339	C	S	.	.			trans	-74.7	168.4	-172.7	0	0	0	0	0	115.4	S1195 F1196 E1234	G1193-S1195 PolarHBondContact O-N 3.26Å; G1193-F1196 PolarHBondContact O-N 2.91Å; G1193-E1234 PolarHBondContact N-OE1 3.4Å
1194	K	58.1	Low	61	Low	121 Å²	121	68.4 Å²	68.4	53%	0.526	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-18.1	-173.7	-137.8	173.9	-175.8	167.7	0	115.5	E1108 F1196	E1108-K1194 VanDerWaalsContact O-CD 3.3Å; E1108-K1194 WeakPolarHBondContact O-CD 3.32Å; E1108-K1194 WeakPolarHBondContact O-CE 3.31Å; E1108-K1194 PolarHBondContact O-NZ 2.85Å; K1194-F1196 PolarHBondContact O-N 2.99Å
1195	S	54.7	Low	59.6	Low	114 Å²	114	68 Å²	68	80%	0.797	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.3	176.7	-55.1	0	0	0	0	113.9	G1193 L1197	G1193-S1195 PolarHBondContact O-N 3.26Å; S1195-L1197 PolarHBondContact O-N 3.27Å
1196	F	55.5	Low	58.3	Low	75 Å²	75	70.6 Å²	70.6	33%	0.329	36%	0.364	S	S	.	.	S	Bend	trans	-95.9	90.2	-179.9	-64.8	-75.3	0	0	0	110.9	Y1149 G1193 K1194 E1234	Y1149-F1196 AromaticContact CD1-CD1 3.88Å; Y1149-F1196 HydrophobicContact CD1-CD1 3.88Å; Y1149-F1196 AromaticContact CD1-CE1 3.85Å; Y1149-F1196 HydrophobicContact CD1-CE1 3.85Å; Y1149-F1196 HydrophobicContact CD2-CD1 4.46Å; Y1149-F1196 AromaticContact CD2-CE1 3.66Å; Y1149-F1196 HydrophobicContact CD2-CE1 3.66Å; Y1149-F1196 HydrophobicContact CD2-CZ 4.04Å; Y1149-F1196 AromaticContact CE1-CD1 3.29Å; Y1149-F1196 HydrophobicContact CE1-CD1 3.29Å; Y1149-F1196 AromaticContact CE1-CE1 3.5Å; Y1149-F1196 HydrophobicContact CE1-CE1 3.5Å; Y1149-F1196 AromaticContact CE1-CG 3.95Å; Y1149-F1196 HydrophobicContact CE1-CG 3.95Å; Y1149-F1196 HydrophobicContact CE1-CZ 4.3Å; Y1149-F1196 AromaticContact CE2-CD1 3.95Å; Y1149-F1196 HydrophobicContact CE2-CD1 3.95Å; Y1149-F1196 AromaticContact CE2-CE1 3.29Å; Y1149-F1196 HydrophobicContact CE2-CE1 3.29Å; Y1149-F1196 HydrophobicContact CE2-CE2 4.11Å; Y1149-F1196 AromaticContact CE2-CZ 3.38Å; Y1149-F1196 HydrophobicContact CE2-CZ 3.38Å; Y1149-F1196 HydrophobicContact CG-CD1 4.43Å; Y1149-F1196 AromaticContact CG-CE1 3.93Å; Y1149-F1196 HydrophobicContact CG-CE1 3.93Å; Y1149-F1196 AromaticContact CZ-CD1 3.32Å; Y1149-F1196 AromaticContact CZ-CE1 3.18Å; Y1149-F1196 AromaticContact CZ-CE2 3.95Å; Y1149-F1196 AromaticContact CZ-CG 3.76Å; Y1149-F1196 AromaticContact CZ-CZ 3.52Å; Y1149-F1196 WeakPolarHBondContact OH-CD1 3.49Å; Y1149-F1196 WeakPolarHBondContact OH-CD2 3.33Å; Y1149-F1196 WeakPolarHBondContact OH-CE2 3.36Å; Y1149-F1196 WeakPolarHBondContact OH-CG 3.17Å; G1193-F1196 PolarHBondContact O-N 2.91Å; K1194-F1196 PolarHBondContact O-N 2.99Å; F1196-E1234 WeakPolarHBondContact CD2-OE1 3.34Å; F1196-E1234 WeakPolarHBondContact CE2-OE1 3.41Å
1197	L	48.5	Very low	57.3	Low	155 Å²	155	71.9 Å²	71.9	81%	0.812	37%	0.374	S	S	*	.			trans	-59.4	138.3	177.1	-81.5	164.1	0	0	0	111.8	S1195 F1199	S1195-L1197 PolarHBondContact O-N 3.27Å; L1197-F1199 PolarHBondContact O-N 2.75Å
1198	Q	47.1	Very low	56.1	Low	141 Å²	141	73.2 Å²	73.2	66%	0.659	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-11.6	-158.8	-125.9	167.8	-9.7	0	0	117.4
1199	F	45.2	Very low	55.1	Low	182 Å²	182	72.8 Å²	72.8	80%	0.798	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-6.6	-163.5	-83.2	-84.4	0	0	0	116.5	L1197	L1197-F1199 PolarHBondContact O-N 2.75Å
1200	S	44.3	Very low	54.3	Low	99 Å²	99	71 Å²	71	69%	0.692	38%	0.381	S	S	*	.	S	Bend	trans	-110.7	-7.2	-175.7	-54.9	0	0	0	0	115.2
1201	A	46.8	Very low	53.4	Low	32 Å²	32	73.6 Å²	73.6	26%	0.264	39%	0.391	S	S	.	.			trans	-109.9	51.8	-173	0	0	0	0	0	113	R1116	R1116-A1201 PolarHBondContact NE-O 2.76Å
1202	M	41.4	Very low	53.4	Low	161 Å²	161	73.8 Å²	73.8	79%	0.793	39%	0.392	S	S	*	.			trans	-105.8	12.9	-174	-67.1	-171.1	79.5	0	0	115.4
1203	K	47.3	Very low	53.2	Low	161 Å²	161	73.7 Å²	73.7	70%	0.7	39%	0.393	S	S	*	.	S	Bend	trans	-137.3	136.4	176	-68	175.5	-175.9	162.1	0	110.3
1204	M	48.3	Very low	53.4	Low	50 Å²	50	74.4 Å²	74.4	25%	0.246	40%	0.395	C	S	.	.			trans	-63.4	137.3	168.7	-74.6	-158.2	-67.8	0	0	110	E1060 T1064 M1117 F1119 F1187	E1060-M1204 HydrophobicContact CG-CE 3.8Å; T1064-M1204 HydrophobicContact CG2-CE 3.32Å; M1117-M1204 HydrophobicContact CB-SD 4.11Å; F1119-M1204 HydrophobicContact CD2-CE 4.35Å; F1119-M1204 HydrophobicContact CD2-SD 4.15Å; F1119-M1204 HydrophobicContact CE2-CE 3.69Å; F1119-M1204 HydrophobicContact CE2-SD 3.82Å; F1187-M1204 HydrophobicContact CE2-SD 4.3Å
1205	A	49.8	Very low	53.7	Low	22 Å²	22	72.3 Å²	72.3	18%	0.182	39%	0.389	C	S	.	.			trans	-97.1	130.9	172.8	0	0	0	0	0	109.6	L1118 I1148	L1118-A1205 HydrophobicContact CD2-CB 4.35Å; I1148-A1205 HydrophobicContact CG1-CB 4.44Å; I1148-A1205 HydrophobicContact CG2-CB 3.78Å
1206	H	52.8	Low	53.7	Low	56 Å²	56	70.6 Å²	70.6	26%	0.259	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-109.3	140.5	169.6	-60.9	-102.6	0	0	0	108.8	T1064 F1119	T1064-H1206 VanDerWaalsContact CB-NE2 3.28Å; T1064-H1206 WeakPolarHBondContact CB-NE2 3.34Å; T1064-H1206 PolarHBondContact OG1-CE1 3.21Å; T1064-H1206 PolarHBondContact OG1-NE2 3.42Å; T1064-H1206 VanDerWaalsContact OG1-NE2 3.11Å; F1119-H1206 AromaticContact CD2-CE1 3.2Å; F1119-H1206 WeakPolarHBondContact CD2-CE1 3.41Å; F1119-H1206 AromaticContact CD2-ND1 3.64Å; F1119-H1206 AromaticContact CD2-NE2 3.94Å; F1119-H1206 AromaticContact CE2-CE1 3.68Å; F1119-H1206 AromaticContact CG-CE1 3.84Å; F1119-H1206 AromaticContact CG-ND1 3.83Å
1207	A	55.4	Low	53.4	Low	27 Å²	27	74.4 Å²	74.4	22%	0.223	40%	0.402	C	S	.	.			trans	-69	148.2	159.2	0	0	0	0	0	109.7	H1212	A1207-H1212 WeakPolarHBondContact CB-NE2 3.25Å; A1207-H1212 PolarHBondContact O-CE1 3.32Å; A1207-H1212 PolarHBondContact O-NE2 3.23Å
1208	P	55.8	Low	53.2	Low	32 Å²	32	72 Å²	72	21%	0.208	40%	0.395	C	S	.	.			trans	-73.1	140.1	172.7	26.3	-29	0	0	0	109.8	G1210 H1211	P1208-G1210 PolarHBondContact O-N 2.88Å; P1208-H1211 PolarHBondContact O-N 3.09Å
1209	P	56	Low	52.9	Low	2 Å²	2	67.8 Å²	67.8	1%	0.013	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-65.9	-12.2	-166.5	21.8	-31.7	0	0	0	115.7	F1078 Y1081 R1183 H1211 H1212 I1246	F1078-P1209 HydrophobicContact CE1-CG 3.52Å; F1078-P1209 HydrophobicContact CE2-CG 4.06Å; F1078-P1209 HydrophobicContact CZ-CG 3.2Å; Y1081-P1209 HydrophobicContact CE1-CG 4.47Å; R1183-P1209 VanDerWaalsContact CZ-O 3.32Å; R1183-P1209 PolarHBondContact NH1-O 2.96Å; P1209-H1211 PolarHBondContact O-N 2.98Å; P1209-H1211 VanDerWaalsContact O-N 3.16Å; P1209-H1212 WeakPolarHBondContact O-CB 3.46Å; P1209-H1212 PolarHBondContact O-N 3.24Å; P1209-I1246 HydrophobicContact CB-CD1 3.95Å; P1209-I1246 HydrophobicContact CG-CD1 4.15Å
1210	G	57.9	Low	52.3	Low	22 Å²	22	64.1 Å²	64.1	23%	0.227	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-56.8	-22.8	166.1	0	0	0	0	0	113.9	P1208	P1208-G1210 PolarHBondContact O-N 2.88Å
1211	H	55.1	Low	51.9	Low	70 Å²	70	67.1 Å²	67.1	32%	0.324	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-94.8	-4.5	174.4	-65	90.7	0	0	0	114	Y1160 P1208 P1209	Y1160-H1211 PolarHBondContact O-CE1 2.89Å; P1208-H1211 PolarHBondContact O-N 3.09Å; P1209-H1211 PolarHBondContact O-N 2.98Å; P1209-H1211 VanDerWaalsContact O-N 3.16Å
1212	H	69	Low	51.1	Low	4 Å²	4	67.6 Å²	67.6	2%	0.019	39%	0.39	C	S	.	.	S	Bend	trans	-82.8	125.5	-173.8	-66.9	-172.2	0	0	0	110.9	G1121 R1183 M1185 A1207 P1209 V1214 Y1244	G1121-H1212 VanDerWaalsContact CA-CD2 3.46Å; G1121-H1212 WeakPolarHBondContact CA-CD2 3.38Å; G1121-H1212 VanDerWaalsContact O-CA 3.29Å; G1121-H1212 WeakPolarHBondContact O-CA 3.44Å; R1183-H1212 HydrophobicContact CB-CB 4.39Å; R1183-H1212 PolarHBondContact NH1-O 3.26Å; M1185-H1212 WeakPolarHBondContact CE-ND1 3.43Å; A1207-H1212 WeakPolarHBondContact CB-NE2 3.25Å; A1207-H1212 PolarHBondContact O-CE1 3.32Å; A1207-H1212 PolarHBondContact O-NE2 3.23Å; P1209-H1212 WeakPolarHBondContact O-CB 3.46Å; P1209-H1212 PolarHBondContact O-N 3.24Å; H1212-V1214 PolarHBondContact O-N 3.25Å; H1212-Y1244 VanDerWaalsContact CB-OH 3.28Å; H1212-Y1244 WeakPolarHBondContact CB-OH 3.31Å; H1212-Y1244 AromaticContact ND1-CZ 3.64Å; H1212-Y1244 PolarHBondContact ND1-OH 3.36Å
1213	S	65.3	Low	50.6	Low	13 Å²	13	65.5 Å²	65.5	9%	0.091	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-50.4	131.1	-178.3	-169.2	0	0	0	0	112.1	G1121 R1183 Q1184	G1121-S1213 PolarHBondContact O-N 2.82Å; R1183-S1213 CarbonylContact C-O 3.57Å; R1183-S1213 WeakPolarHBondContact CA-O 3.27Å; R1183-S1213 WeakPolarHBondContact CB-O 3.48Å; Q1184-S1213 PolarHBondContact N-O 3.43Å
1214	V	67.7	Low	49.5	Very low	23 Å²	23	62.8 Å²	62.8	14%	0.139	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-89.8	135.1	175.1	173.8	0	0	0	0	108.6	C1181 R1183 H1212 G1216 R1217	C1181-V1214 HydrophobicContact CB-CG1 3.89Å; R1183-V1214 HydrophobicContact CG-CG2 4.11Å; H1212-V1214 PolarHBondContact O-N 3.25Å; V1214-G1216 PolarHBondContact O-N 3.33Å; V1214-R1217 PolarHBondContact O-N 3.12Å
1215	I	64.2	Low	48.6	Very low	78 Å²	78	69.2 Å²	69.2	40%	0.4	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.1	-177.7	-72.9	-170.5	0	0	0	111.2	H1182 Q1184 T1243	H1182-I1215 HydrophobicContact CB-CB 4.48Å; H1182-I1215 HydrophobicContact CB-CD1 4.07Å; H1182-I1215 HydrophobicContact CB-CG1 4.34Å; H1182-I1215 PolarHBondContact O-N 3.48Å; Q1184-I1215 HydrophobicContact CG-CD1 3.98Å; Q1184-I1215 HydrophobicContact CG-CG1 3.73Å; I1215-T1243 HydrophobicContact CD1-CG2 3.32Å; I1215-T1243 HydrophobicContact CG1-CG2 4.48Å
1216	G	53.7	Low	47.4	Very low	77 Å²	77	73.4 Å²	73.4	79%	0.794	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-2.9	174.8	0	0	0	0	0	116.2	V1214	V1214-G1216 PolarHBondContact O-N 3.33Å
1217	R	49.9	Very low	46.2	Very low	156 Å²	156	78.9 Å²	78.9	59%	0.589	47%	0.472	S	S	*	.	B	Isolated β-bridge	trans	-146	126.5	176.6	-65	-173.6	-180	177.3	-1.5	113.2	T1172 V1214	T1172-R1217 PolarHBondContact OG1-NH1 3.49Å; V1214-R1217 PolarHBondContact O-N 3.12Å
1218	P	44.1	Very low	45.1	Very low	103 Å²	103	84.3 Å²	84.3	67%	0.669	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-61.8	145	162.2	-15.2	29.5	0	0	0	110.3	V1220	P1218-V1220 PolarHBondContact O-N 3.13Å
1219	S	40.4	Very low	43.6	Very low	53 Å²	53	88.7 Å²	88.7	37%	0.371	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-66.5	125.2	175.9	60.7	0	0	0	0	111	P1123	P1123-S1219 VanDerWaalsContact CB-OG 3.3Å; P1123-S1219 WeakPolarHBondContact CB-OG 3.48Å; P1123-S1219 VanDerWaalsContact CG-OG 3.27Å; P1123-S1219 WeakPolarHBondContact CG-OG 3.4Å
1220	V	33.3	Very low	42.5	Very low	106 Å²	106	94.2 Å²	94.2	64%	0.642	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	136.2	-178.5	-170.9	0	0	0	0	110.6	P1218	P1218-V1220 PolarHBondContact O-N 3.13Å
1221	N	34.8	Very low	41.3	Very low	161 Å²	161	101.6 Å²	101.6	86%	0.861	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.8	27.4	175.5	-61.9	-11.1	0	0	0	117.9	L1223	N1221-L1223 PolarHBondContact O-N 3.23Å
1222	G	30.5	Very low	40.3	Very low	43 Å²	43	109.1 Å²	109.1	44%	0.443	59%	0.59	S	S	.	*	S	Bend	trans	-74	84.5	162.5	0	0	0	0	0	113.2
1223	L	30.5	Very low	39.4	Very low	116 Å²	116	110.4 Å²	110.4	61%	0.607	60%	0.604	S	S	*	*			trans	49.3	90	163.8	-68.3	160.2	0	0	0	117	N1221 Y1225 Y1228	N1221-L1223 PolarHBondContact O-N 3.23Å; L1223-Y1225 PolarHBondContact O-N 3.32Å; L1223-Y1228 WeakPolarHBondContact CD1-OH 3.14Å
1224	A	26.1	Very low	39	Very low	105 Å²	105	112.2 Å²	112.2	87%	0.868	61%	0.611	S	S	*	*			trans	-81.7	44.8	175.3	0	0	0	0	0	114.3
1225	Y	28.2	Very low	38.7	Very low	185 Å²	185	114.9 Å²	114.9	73%	0.725	62%	0.622	S	S	*	*			trans	-126.5	129.3	178.1	-72.9	-78.3	0	0	0	112	L1223 E1227	L1223-Y1225 PolarHBondContact O-N 3.32Å; Y1225-E1227 VanDerWaalsContact C-N 3.31Å; Y1225-E1227 PolarHBondContact O-N 3.42Å
1226	A	24.5	Very low	38.9	Very low	109 Å²	109	112.3 Å²	112.3	90%	0.901	61%	0.612	S	S	*	*			trans	-92.1	43.5	-178.4	0	0	0	0	0	112.9
1227	E	28.1	Very low	39.8	Very low	171 Å²	171	109 Å²	109	80%	0.799	58%	0.576	S	S	*	*			trans	-139	100.6	176.5	-69.7	-170.4	-168.9	0	0	111	Y1225	Y1225-E1227 VanDerWaalsContact C-N 3.31Å; Y1225-E1227 PolarHBondContact O-N 3.42Å
1228	Y	31.6	Very low	41	Very low	142 Å²	142	101.8 Å²	101.8	56%	0.557	55%	0.549	S	S	*	.			trans	-133.3	139.6	168.1	-75.5	-66.6	0	0	0	112.7	L1223	L1223-Y1228 WeakPolarHBondContact CD1-OH 3.14Å
1229	V	25.9	Very low	42.7	Very low	124 Å²	124	97.5 Å²	97.5	75%	0.752	52%	0.52	S	S	*	.			trans	-76.3	129.2	-168.4	177.1	0	0	0	0	111.9
1230	I	32.8	Very low	44.9	Very low	117 Å²	117	95.9 Å²	95.9	60%	0.6	51%	0.506	S	S	*	.			trans	-86.4	119.9	179.1	-67.4	177.1	0	0	0	108.9	Y1139	Y1139-I1230 HydrophobicContact CD1-CB 4.27Å; Y1139-I1230 HydrophobicContact CD1-CG2 3.31Å; Y1139-I1230 HydrophobicContact CE1-CG2 3.98Å; Y1139-I1230 HydrophobicContact CG-CG2 3.84Å
1231	Y	31.7	Very low	47.4	Very low	178 Å²	178	91.1 Å²	91.1	70%	0.698	48%	0.477	S	S	*	.			trans	-123	119.4	179	-152.3	-78.7	0	0	0	112.9	Y1139 G1233	Y1139-Y1231 WeakPolarHBondContact CE1-O 3.43Å; Y1231-G1233 PolarHBondContact O-N 2.64Å
1232	R	34.3	Very low	49.9	Very low	228 Å²	228	83.5 Å²	83.5	86%	0.86	44%	0.436	S	S	*	.	S	Bend	trans	-61.9	123.8	-168.9	-73.1	-179.3	173.6	169.1	-3	113.4	Y1139	Y1139-R1232 WeakPolarHBondContact OH-CA 3.46Å
1233	G	48.9	Very low	52.7	Low	30 Å²	30	81.8 Å²	81.8	31%	0.309	42%	0.417	S	S	.	.			trans	-179.4	-78.4	176.4	0	0	0	0	0	118.9	R1101 Y1139 Y1231	R1101-G1233 PolarHBondContact NH2-O 2.88Å; R1101-G1233 VanDerWaalsContact NH2-O 3.16Å; Y1139-G1233 PolarHBondContact OH-N 3.01Å; Y1231-G1233 PolarHBondContact O-N 2.64Å
1234	E	57.2	Low	55.4	Low	52 Å²	52	76.3 Å²	76.3	24%	0.243	39%	0.388	C	S	.	.			trans	-136.8	155.6	-148.5	-52.6	-168.6	130.6	0	0	114.2	L1192 G1193 F1196	L1192-E1234 WeakPolarHBondContact CA-OE1 3.28Å; G1193-E1234 PolarHBondContact N-OE1 3.4Å; F1196-E1234 WeakPolarHBondContact CD2-OE1 3.34Å; F1196-E1234 WeakPolarHBondContact CE2-OE1 3.41Å
1235	Q	61.4	Low	58.4	Low	78 Å²	78	73.4 Å²	73.4	36%	0.364	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150	-178.4	-75.7	-168.8	5.3	0	0	113	R1097 R1101 V1190	R1097-Q1235 PolarHBondContact O-OE1 3.04Å; R1101-Q1235 HydrophobicContact CB-CB 4.41Å; R1101-Q1235 HydrophobicContact CB-CG 4.38Å; R1101-Q1235 HydrophobicContact CG-CB 4.2Å; R1101-Q1235 HydrophobicContact CG-CG 4.19Å; V1190-Q1235 WeakPolarHBondContact CG1-O 3.38Å
1236	A	68.8	Low	61.1	Low	25 Å²	25	64.7 Å²	64.7	21%	0.207	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.4	177.7	0	0	0	0	0	111.9	R1189 V1190	R1189-A1236 CarbonylContact O-C 3.56Å; R1189-A1236 WeakPolarHBondContact O-CA 3.48Å; V1190-A1236 HydrophobicContact CG1-CB 4.44Å; V1190-A1236 HydrophobicContact CG2-CB 3.74Å
1237	Y	73.3	Confident	63.9	Low	8 Å²	8	62.7 Å²	62.7	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	114.2	174.8	-179	-95.8	0	0	0	109.9	V1089 N1091 L1094 R1095 Y1098 C1188 R1189 E1239	V1089-Y1237 PolarHBondContact O-OH 3.31Å; N1091-Y1237 PolarHBondContact N-OH 3.27Å; L1094-Y1237 HydrophobicContact CB-CD2 4.26Å; L1094-Y1237 HydrophobicContact CB-CE2 4.15Å; L1094-Y1237 HydrophobicContact CD2-CD2 4.17Å; L1094-Y1237 HydrophobicContact CD2-CE2 4.36Å; L1094-Y1237 HydrophobicContact CG-CD2 3.93Å; L1094-Y1237 HydrophobicContact CG-CE2 4.26Å; R1095-Y1237 HydrophobicContact CB-CD2 4.36Å; R1095-Y1237 HydrophobicContact CB-CE2 3.71Å; Y1098-Y1237 HydrophobicContact CG-CG 4.46Å; C1188-Y1237 CarbonylContact C-O 3.45Å; C1188-Y1237 WeakPolarHBondContact CA-O 3.15Å; R1189-Y1237 PolarHBondContact N-O 2.96Å; R1189-Y1237 PolarHBondContact O-N 3.5Å; Y1237-E1239 HydrophobicContact CD1-CB 3.93Å; Y1237-E1239 HydrophobicContact CD1-CG 4.34Å; Y1237-E1239 HydrophobicContact CE1-CB 3.97Å; Y1237-E1239 HydrophobicContact CE1-CG 4.06Å; Y1237-E1239 PolarHBondContact O-N 2.82Å
1238	P	74.7	Confident	66.3	Low	3 Å²	3	61.5 Å²	61.5	2%	0.019	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.2	170.3	29.4	-30.2	0	0	0	108.6	V1089 L1094 F1133 L1186	V1089-P1238 WeakPolarHBondContact CB-O 3.25Å; V1089-P1238 WeakPolarHBondContact CG1-O 3.39Å; L1094-P1238 HydrophobicContact CD2-CG 3.94Å; F1133-P1238 HydrophobicContact CE2-CG 4.37Å; L1186-P1238 HydrophobicContact CD1-CB 4.38Å; L1186-P1238 HydrophobicContact CD2-CB 4.34Å
1239	E	80.5	Confident	68.4	Low	13 Å²	13	57.4 Å²	57.4	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-36.6	-171.9	-166.9	156.1	-140.2	0	0	112.6	V1089 R1095 F1187 R1189 Y1237	V1089-E1239 PolarHBondContact N-O 2.64Å; R1095-E1239 IonicContact NH1-OE1 3.19Å; R1095-E1239 PolarHBondContact NH1-OE1 3.33Å; F1187-E1239 PolarHBondContact O-N 2.93Å; R1189-E1239 IonicContact CZ-OE2 2.75Å; R1189-E1239 IonicContact NE-OE1 2.76Å; R1189-E1239 IonicContact NE-OE2 3.61Å; R1189-E1239 PolarHBondContact NE-OE2 3.3Å; R1189-E1239 IonicContact NH2-OE1 3.83Å; R1189-E1239 IonicContact NH2-OE2 3.26Å; R1189-E1239 PolarHBondContact NH2-OE2 3.15Å; Y1237-E1239 HydrophobicContact CD1-CB 3.93Å; Y1237-E1239 HydrophobicContact CD1-CG 4.34Å; Y1237-E1239 HydrophobicContact CE1-CB 3.97Å; Y1237-E1239 HydrophobicContact CE1-CG 4.06Å; Y1237-E1239 PolarHBondContact O-N 2.82Å
1240	Y	86	Confident	70.5	Confident	19 Å²	19	60.7 Å²	60.7	8%	0.075	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	145	169.3	-44.1	-76.3	0	0	0	111.9	L1047 E1053 V1057 I1086 Q1087 K1088 L1186 F1187	L1047-Y1240 HydrophobicContact CD1-CD1 4.24Å; L1047-Y1240 HydrophobicContact CD1-CE1 4.21Å; E1053-Y1240 HydrophobicContact CG-CE1 4.26Å; E1053-Y1240 WeakPolarHBondContact OE1-CE1 3.3Å; E1053-Y1240 PolarHBondContact OE1-OH 2.97Å; V1057-Y1240 HydrophobicContact CB-CD2 4.49Å; V1057-Y1240 HydrophobicContact CG1-CD2 3.93Å; V1057-Y1240 HydrophobicContact CG1-CE2 4.47Å; V1057-Y1240 HydrophobicContact CG1-CG 4.36Å; V1057-Y1240 HydrophobicContact CG2-CD2 3.65Å; V1057-Y1240 HydrophobicContact CG2-CE1 4.3Å; V1057-Y1240 HydrophobicContact CG2-CE2 3.37Å; V1057-Y1240 HydrophobicContact CG2-CG 4.29Å; I1086-Y1240 HydrophobicContact CG2-CD1 4.26Å; I1086-Y1240 HydrophobicContact CG2-CG 4.26Å; Q1087-Y1240 CarbonylContact O-C 3.58Å; Q1087-Y1240 VanDerWaalsContact O-CA 3.32Å; Q1087-Y1240 WeakPolarHBondContact O-CA 3.37Å; K1088-Y1240 HydrophobicContact CB-CD1 4Å; K1088-Y1240 HydrophobicContact CB-CE1 4.18Å; K1088-Y1240 HydrophobicContact CD-CE1 4.15Å; K1088-Y1240 HydrophobicContact CG-CD1 4.07Å; K1088-Y1240 HydrophobicContact CG-CE1 3.85Å; L1186-Y1240 WeakPolarHBondContact CA-O 3.43Å; F1187-Y1240 HydrophobicContact CB-CD2 4.11Å; F1187-Y1240 AromaticContact CD1-CD2 3.44Å; F1187-Y1240 HydrophobicContact CD1-CD2 3.44Å; F1187-Y1240 VanDerWaalsContact CD1-CD2 3.44Å; F1187-Y1240 AromaticContact CD1-CE2 3.72Å; F1187-Y1240 HydrophobicContact CD1-CE2 3.72Å; F1187-Y1240 HydrophobicContact CE1-CD2 4.15Å; F1187-Y1240 HydrophobicContact CE1-CE2 4.02Å; F1187-Y1240 HydrophobicContact CG-CD2 4.18Å; F1187-Y1240 PolarHBondContact N-O 2.68Å; F1187-Y1240 PolarHBondContact O-N 2.82Å
1241	L	85.5	Confident	71.2	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.037	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.1	163.6	171.9	63.7	0	0	0	108.1	L1044 Q1087 V1089 I1125 I1129 Q1184 L1186	L1044-L1241 HydrophobicContact CD1-CD2 4.01Å; Q1087-L1241 HydrophobicContact CB-CB 4.39Å; Q1087-L1241 PolarHBondContact N-O 3.18Å; Q1087-L1241 PolarHBondContact O-N 2.94Å; V1089-L1241 HydrophobicContact CG2-CB 4.31Å; I1125-L1241 HydrophobicContact CG2-CD1 3.53Å; I1129-L1241 HydrophobicContact CG1-CD2 4.48Å; Q1184-L1241 HydrophobicContact CB-CD1 4.1Å; Q1184-L1241 HydrophobicContact CG-CD1 4.23Å; L1186-L1241 HydrophobicContact CD2-CB 4.02Å; L1186-L1241 HydrophobicContact CD2-CD1 3.88Å
1242	I	87.3	Confident	71.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.5	-175.9	-53.1	172	0	0	0	109.3	V1057 M1061 I1083 I1086 F1119 Q1184 M1185 F1187	V1057-I1242 HydrophobicContact CG1-CD1 3.7Å; V1057-I1242 HydrophobicContact CG1-CG1 4.44Å; M1061-I1242 HydrophobicContact CE-CG2 4.05Å; M1061-I1242 HydrophobicContact SD-CB 4.3Å; M1061-I1242 HydrophobicContact SD-CD1 3.58Å; M1061-I1242 VanDerWaalsContact SD-CD1 3.58Å; M1061-I1242 HydrophobicContact SD-CG2 3.66Å; I1083-I1242 HydrophobicContact CD1-CG2 4.38Å; I1083-I1242 HydrophobicContact CG2-CG2 4.03Å; I1086-I1242 HydrophobicContact CG1-CG1 4.35Å; I1086-I1242 HydrophobicContact CG1-CG2 4.18Å; I1086-I1242 HydrophobicContact CG2-CG1 4.33Å; F1119-I1242 HydrophobicContact CD1-CD1 4.4Å; F1119-I1242 HydrophobicContact CE1-CD1 3.8Å; Q1184-I1242 CarbonylContact C-O 3.59Å; Q1184-I1242 WeakPolarHBondContact CA-O 3.36Å; M1185-I1242 HydrophobicContact CG-CB 4.11Å; M1185-I1242 PolarHBondContact N-O 3.24Å; M1185-I1242 PolarHBondContact O-N 2.95Å; F1187-I1242 HydrophobicContact CB-CD1 4.33Å
1243	T	88.6	Confident	71.8	Confident	8 Å²	8	50.2 Å²	50.2	5%	0.049	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.8	170.3	-60.3	0	0	0	0	109.6	I1084 K1085 H1182 R1183 I1215	I1084-T1243 HydrophobicContact CB-CG2 4.05Å; I1084-T1243 HydrophobicContact CG1-CG2 4.48Å; I1084-T1243 HydrophobicContact CG2-CG2 4.5Å; I1084-T1243 PolarHBondContact N-O 3.47Å; K1085-T1243 PolarHBondContact N-O 2.65Å; K1085-T1243 VanDerWaalsContact N-O 3.1Å; K1085-T1243 PolarHBondContact O-N 2.77Å; H1182-T1243 HydrophobicContact CB-CG2 4.33Å; R1183-T1243 CarbonylContact O-C 3.59Å; R1183-T1243 VanDerWaalsContact O-CA 3.3Å; R1183-T1243 WeakPolarHBondContact O-CA 3.22Å; I1215-T1243 HydrophobicContact CD1-CG2 3.32Å; I1215-T1243 HydrophobicContact CG1-CG2 4.48Å
1244	Y	88.5	Confident	71.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	166.9	-176.2	75.1	-76	0	0	0	111.6	M1061 Y1081 N1082 R1183 M1185 H1212 I1246	M1061-Y1244 HydrophobicContact CE-CD1 4.12Å; M1061-Y1244 HydrophobicContact CE-CD2 4.48Å; M1061-Y1244 HydrophobicContact CE-CG 3.97Å; Y1081-Y1244 AromaticContact CD1-CD2 3.55Å; Y1081-Y1244 HydrophobicContact CD1-CD2 3.55Å; Y1081-Y1244 AromaticContact CD1-CE2 3.5Å; Y1081-Y1244 HydrophobicContact CD1-CE2 3.5Å; Y1081-Y1244 VanDerWaalsContact CD1-CE2 3.5Å; Y1081-Y1244 AromaticContact CD2-CD2 3.9Å; Y1081-Y1244 HydrophobicContact CD2-CD2 3.9Å; Y1081-Y1244 HydrophobicContact CD2-CE2 4.06Å; Y1081-Y1244 HydrophobicContact CE1-CD2 4.16Å; Y1081-Y1244 AromaticContact CE1-CE2 3.62Å; Y1081-Y1244 HydrophobicContact CE1-CE2 3.62Å; Y1081-Y1244 HydrophobicContact CE2-CD2 4.47Å; Y1081-Y1244 HydrophobicContact CE2-CE2 4.18Å; Y1081-Y1244 AromaticContact CG-CD2 3.41Å; Y1081-Y1244 HydrophobicContact CG-CD2 3.41Å; Y1081-Y1244 VanDerWaalsContact CG-CD2 3.41Å; Y1081-Y1244 AromaticContact CG-CE2 3.74Å; Y1081-Y1244 HydrophobicContact CG-CE2 3.74Å; Y1081-Y1244 HydrophobicContact CG-CG 4.31Å; Y1081-Y1244 AromaticContact CZ-CE2 3.97Å; N1082-Y1244 CarbonylContact O-C 3.44Å; N1082-Y1244 WeakPolarHBondContact O-CA 3.18Å; N1082-Y1244 WeakPolarHBondContact O-CB 3.28Å; R1183-Y1244 HydrophobicContact CB-CD1 4.29Å; R1183-Y1244 HydrophobicContact CB-CE1 3.56Å; R1183-Y1244 HydrophobicContact CB-CE2 4.33Å; R1183-Y1244 WeakPolarHBondContact CB-OH 3.27Å; R1183-Y1244 VanDerWaalsContact CD-OH 3.29Å; R1183-Y1244 WeakPolarHBondContact CD-OH 3.28Å; R1183-Y1244 PolarHBondContact N-O 2.98Å; R1183-Y1244 WeakPolarHBondContact O-CD1 3.33Å; R1183-Y1244 PolarHBondContact O-N 3.17Å; M1185-Y1244 HydrophobicContact CB-CE1 4.48Å; M1185-Y1244 HydrophobicContact CE-CD1 3.69Å; M1185-Y1244 HydrophobicContact CE-CE1 3.25Å; M1185-Y1244 HydrophobicContact CE-CE2 4.2Å; M1185-Y1244 HydrophobicContact CE-CG 4.37Å; M1185-Y1244 HydrophobicContact CG-CD1 4.38Å; M1185-Y1244 HydrophobicContact CG-CE1 4.26Å; H1212-Y1244 VanDerWaalsContact CB-OH 3.28Å; H1212-Y1244 WeakPolarHBondContact CB-OH 3.31Å; H1212-Y1244 AromaticContact ND1-CZ 3.64Å; H1212-Y1244 PolarHBondContact ND1-OH 3.36Å; Y1244-I1246 HydrophobicContact CE2-CG1 4.19Å
1245	Q	87.7	Confident	69.9	Low	44 Å²	44	61.2 Å²	61.2	21%	0.206	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	151	172	-161.4	-180	36.1	0	0	109.3	Y1081 N1082 Y1179 L1180	Y1081-Q1245 WeakPolarHBondContact CA-O 3.36Å; N1082-Q1245 HydrophobicContact CB-CB 4.22Å; N1082-Q1245 PolarHBondContact N-O 2.92Å; N1082-Q1245 PolarHBondContact O-N 3.31Å; Y1179-Q1245 VanDerWaalsContact O-CG 3.25Å; Y1179-Q1245 WeakPolarHBondContact O-CG 3.45Å; Y1179-Q1245 PolarHBondContact O-NE2 3.49Å; L1180-Q1245 PolarHBondContact O-NE2 2.93Å
1246	I	86.3	Confident	68.7	Low	2 Å²	2	62.7 Å²	62.7	1%	0.01	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	126.7	175.6	-55.5	174.7	0	0	0	108.4	F1078 Y1081 Y1179 P1209 Y1244	F1078-I1246 HydrophobicContact CB-CG2 3.51Å; F1078-I1246 HydrophobicContact CD1-CG2 3.77Å; F1078-I1246 HydrophobicContact CD2-CG2 4.12Å; F1078-I1246 HydrophobicContact CG-CG2 3.51Å; Y1081-I1246 HydrophobicContact CD1-CG1 4.42Å; Y1081-I1246 HydrophobicContact CE1-CG1 4.26Å; Y1179-I1246 HydrophobicContact CD1-CB 4.16Å; Y1179-I1246 HydrophobicContact CD1-CG2 3.77Å; Y1179-I1246 HydrophobicContact CE1-CG2 3.85Å; P1209-I1246 HydrophobicContact CB-CD1 3.95Å; P1209-I1246 HydrophobicContact CG-CD1 4.15Å; Y1244-I1246 HydrophobicContact CE2-CG1 4.19Å
1247	L	82.7	Confident	67.1	Low	68 Å²	68	66 Å²	66	36%	0.356	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-82.5	130.6	174.3	-77.3	162.7	0	0	0	110.5	F1078 R1080 N1082	F1078-L1247 WeakPolarHBondContact CB-O 3.31Å; R1080-L1247 HydrophobicContact CB-CD1 4.09Å; R1080-L1247 HydrophobicContact CG-CD1 4.08Å; R1080-L1247 PolarHBondContact O-N 2.77Å; N1082-L1247 HydrophobicContact CB-CD1 4.12Å; N1082-L1247 HydrophobicContact CB-CD2 4.07Å; N1082-L1247 HydrophobicContact CB-CG 3.88Å
1248	K	78.9	Confident	65.1	Low	145 Å²	145	70.6 Å²	70.6	63%	0.63	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-75.9	129.2	170.1	-166.8	-179.6	-178.4	-176.8	0	108.6	Y1179 E1250	Y1179-K1248 HydrophobicContact CD1-CB 3.66Å; Y1179-K1248 HydrophobicContact CD1-CG 4.28Å; Y1179-K1248 HydrophobicContact CD2-CB 4.37Å; Y1179-K1248 HydrophobicContact CD2-CD 4.44Å; Y1179-K1248 HydrophobicContact CD2-CG 4.34Å; Y1179-K1248 VanDerWaalsContact CE1-CA 3.47Å; Y1179-K1248 HydrophobicContact CE1-CB 3.83Å; Y1179-K1248 HydrophobicContact CE1-CG 4.07Å; Y1179-K1248 HydrophobicContact CE2-CD 4.44Å; Y1179-K1248 HydrophobicContact CE2-CG 4.14Å; Y1179-K1248 HydrophobicContact CG-CB 3.93Å; Y1179-K1248 HydrophobicContact CG-CG 4.39Å; K1248-E1250 PolarHBondContact O-N 2.87Å
1249	P	74.4	Confident	63.1	Low	56 Å²	56	75.5 Å²	75.5	36%	0.364	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-61.2	135.2	172.8	22.5	-29.3	0	0	0	109.2	V1077 S1251	V1077-P1249 HydrophobicContact CB-CG 4.13Å; V1077-P1249 HydrophobicContact CG1-CG 4.32Å; V1077-P1249 WeakPolarHBondContact O-CD 3.31Å; V1077-P1249 WeakPolarHBondContact O-CG 3.36Å; P1249-S1251 PolarHBondContact O-N 3.45Å
1250	E	70.2	Confident	61.1	Low	193 Å²	193	83.4 Å²	83.4	90%	0.902	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-59.4	123.4	178.1	-65.3	-178.3	162.4	0	0	109.1	K1248 A1252	K1248-E1250 PolarHBondContact O-N 2.87Å; E1250-A1252 PolarHBondContact O-N 3.19Å
1251	S	48.8	Very low	58.6	Low	110 Å²	110	91.2 Å²	91.2	77%	0.769	56%	0.56	S	S	*	*			trans	-70.8	102.2	177.6	52.8	0	0	0	0	109.1	P1249 A1253	P1249-S1251 PolarHBondContact O-N 3.45Å; S1251-A1253 PolarHBondContact O-N 3.38Å
1252	A	41.4	Very low	56	Low	95 Å²	95	100.2 Å²	100.2	79%	0.785	60%	0.599	S	S	*	*			trans	-49	132.9	162.3	0	0	0	0	0	108.9	E1250 Q1254	E1250-A1252 PolarHBondContact O-N 3.19Å; A1252-Q1254 PolarHBondContact O-N 2.93Å
1253	A	36.2	Very low	53.5	Low	99 Å²	99	109.1 Å²	109.1	82%	0.818	66%	0.662	S	S	*	*			trans	-53.9	132.7	-170.6	0	0	0	0	0	111.8	S1251 S1255	S1251-A1253 PolarHBondContact O-N 3.38Å; A1253-S1255 PolarHBondContact O-N 2.75Å
1254	Q	34.2	Very low	51.7	Low	198 Å²	198	114.2 Å²	114.2	93%	0.925	69%	0.692	S	S	*	*			trans	-62.1	115.7	-177.4	-68.6	170.8	-30.5	0	0	110.9	A1252	A1252-Q1254 PolarHBondContact O-N 2.93Å
1255	S	32	Very low	49.8	Very low	114 Å²	114	120.2 Å²	120.2	80%	0.797	73%	0.729	S	S	*	*			trans	-79.5	116.6	161.3	51.4	0	0	0	0	109.3	A1253 A1257	A1253-S1255 PolarHBondContact O-N 2.75Å; S1255-A1257 PolarHBondContact O-N 2.64Å; S1255-A1257 VanDerWaalsContact O-N 3.11Å
1256	A	36.2	Very low	47.7	Very low	109 Å²	109	124.4 Å²	124.4	90%	0.901	76%	0.758	S	S	*	*			trans	-73.7	99.4	-178.3	0	0	0	0	0	111.6
1257	A	34.7	Very low	45.4	Very low	95 Å²	95	131.6 Å²	131.6	79%	0.785	80%	0.802	S	S	*	*			trans	-161.7	55.1	174.1	0	0	0	0	0	114.1	S1255	S1255-A1257 PolarHBondContact O-N 2.64Å; S1255-A1257 VanDerWaalsContact O-N 3.11Å
1258	A	32.2	Very low	43.1	Very low	105 Å²	105	135.6 Å²	135.6	87%	0.868	83%	0.829	S	S	*	*			trans	-156.8	34.4	175.4	0	0	0	0	0	114.9
1259	A	33.7	Very low	40.7	Very low	105 Å²	105	135 Å²	135	87%	0.868	84%	0.843	S	S	*	*			trans	-120.6	56	179.9	0	0	0	0	0	111.9
1260	E	37	Very low	38.3	Very low	180 Å²	180	140.6 Å²	140.6	84%	0.841	88%	0.877	S	S	*	*			trans	-155.6	143.7	168.3	-117.4	171.6	-155.2	0	0	109.8
1261	Q	33.6	Very low	35.8	Very low	183 Å²	183	136.6 Å²	136.6	86%	0.855	88%	0.875	S	S	*	*			trans	70.5	121.6	-171	-46.3	178.1	14.4	0	0	113.5
1262	K	31.9	Very low	34.7	Very low	195 Å²	195	138.8 Å²	138.8	85%	0.848	88%	0.884	S	S	*	*			cis	-137.3	142.4	21.3	-70.3	177.1	174.5	177.6	0	113.2
1263	S	33.5	Very low	34.1	Very low	188 Å²	188	142.8 Å²	142.8	100%	1.315	89%	0.893	S	S	*	*			trans	-74.3	0	141.1	60.8	0	0	0	0	109.9

Retrieved 1,263 of 1,263 residues in 7852.3 ms (Link to these results)

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