A0A096NEE3_PAPAN Loading...

Catenin delta 2

AlphaFold DB (F7F975), UniProt , Accession A0A096NEE3, Species PAPAN (Papio anubis, Olive baboon), Gene CTNND2, Length 1,251 aa.

						>A0A096NEE3_PAPAN|A0A096NEE3|CTNND2
MFARKPPGAAPLGAMPVPDQPSSASEKTSSLSPGLNTSNGDGSETETTSAILASVKEQELQFERLTRELEAERQIVASQLERCKLGSETGSMSSISSAEEQFHWQSQDGQKDIEDELTTGLELVDSCIRSLQESGILDPQDYSTGERPSLLSQSALQLNSKPEGSFQYPASYHSNQTLALGESTPSQLPARGTQARAAGQSFSQGTTSRAGHLAGPEPAPPPPPPPREPFAPSLGSAFHLPDAPPTAAAAAALYYSSSTLPAPPRGGSPLAAPQGGSPTKLQRGGSAPEGATYAAPRGSSPKQSPSRLAKSYSTSSPINIVVSSAGLSPIRVTSPPTVQSTISSSPIHQLSSTIGTYATLSPTKRLVHASEQYSKHSQELYATATLQRPGSLAAGSRASYSSQHGHLGPELRALQSPEHHIDPIYEDRVYQKPPMRSLSQSQGDPLPPAHTGTYRTSTAPSSPGVDSVPLQRTGSQHGPQNAAAATFQRASYAAGPASNYADPYRQLQYCPSVESPYSKSGPALPPEGTLARSPSIDSIQKDPREFGWRDPELPEVIQMLQHQFPSVQSNAAAYLQHLCFGDNKIKAEIRRQGGIQLLVDLLDHRMTEVHRSACGALRNLVYGKANDDNKIALKNCGGIPALVRLLRKTTDLEIRELVTGVLWNLSSCDALKMPIIQDALAVLTNAVIIPHSGWENSPLQDDRKIQLHSSQVLRNATGCLRNVSSAGEEARRRMRECDGLTDALLYVIQSALGSSEIDSKTVENCVCILRNLSYRLAAETSQGQHMGTDELDGLLCGEANGKDAESSGCWGKKKKKKKSQDQWDGVGPLPDCAEPPKGIQMLWHPSIVKPYLTLLSECSNPDTLEGAAGALQNLAAGSWKGWAEDVAGMAYALRSLPEGAPCLPQWSVYIRAAVRKEKGLPILVELLRIDNDRVVCAVATALRNMALDVRNKELIGKYAMRDLVHRLPGGNNSNNTASKAMSDDTVTAVCCTLHEVITKNMENAKALRDAGGIEKLVGISKSKGDKHSPKVVKAASQVLNSMWQYRDLRSLYKKDGWSQYHFVASSSTIERDRQRPYSSSRTPSISPVRVSPNNRSASAPASPREMISLKERKTDYECTGGNATYHGAKGEHTSRKDAMTAQNTGISTLYRNSYGAPAEDIKHNQVSAQPVPQEPSRKDYETYQPFQNSTRNYDESFFEDQVHHRPPASEYTMHLGLKSTGNYVDFYSAARPYSELNYETSHYPASPDSWV
					

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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	30.8	Very low	34.3	Very low	226 Å²	226	132.4 Å²	132.4	100%	1.113	76%	0.764	S	S	*	*				0	148.8	0	-85.6	165.4	164.2	0	0	108.3
2	F	29	Very low	34.4	Very low	193 Å²	193	131.4 Å²	131.4	85%	0.846	75%	0.753	S	S	*	*			trans	13.2	141.1	156.1	-53.7	-71.8	0	0	0	120.1
3	A	30.2	Very low	34.4	Very low	80 Å²	80	124.8 Å²	124.8	66%	0.661	73%	0.731	S	S	*	*			cis	-162.7	174.6	-7	0	0	0	0	0	107.4
4	R	27.7	Very low	34.2	Very low	232 Å²	232	123.5 Å²	123.5	88%	0.875	74%	0.742	S	S	*	*				42.8	135.2	59.5	-79.2	-177.9	174.5	-173.6	-1.2	111.5
5	K	28.8	Very low	33.6	Very low	182 Å²	182	125.5 Å²	125.5	79%	0.791	74%	0.743	S	S	*	*			cis	-159.3	-175.2	14.6	-122.5	-163.5	171.9	-170.7	0	108.7
6	P	47.7	Very low	34.2	Very low	109 Å²	109	125.6 Å²	125.6	71%	0.708	75%	0.748	S	S	*	*			trans	-91.9	-139.4	-178.2	42.1	-39	0	0	0	110.9
7	P	48.8	Very low	34	Very low	119 Å²	119	124.6 Å²	124.6	77%	0.773	74%	0.743	S	S	*	*			cis	-144.4	173.1	-13.7	37.6	-16.9	0	0	0	119
8	G	28.1	Very low	34.5	Very low	78 Å²	78	124 Å²	124	80%	0.804	74%	0.742	S	S	*	*			trans	78.4	176.5	142.1	0	0	0	0	0	120.3
9	A	27.5	Very low	34.1	Very low	97 Å²	97	125.9 Å²	125.9	80%	0.802	75%	0.748	S	S	*	*			cis	-176	132.6	-24.2	0	0	0	0	0	114.1
10	A	32.4	Very low	33.7	Very low	67 Å²	67	128.5 Å²	128.5	55%	0.554	75%	0.752	S	S	*	*			trans	53.3	-169.9	163.5	0	0	0	0	0	117.8
11	P	46	Very low	34.4	Very low	73 Å²	73	127.1 Å²	127.1	47%	0.474	75%	0.747	S	S	.	*			cis	-121.3	-158.8	-25.4	46.6	-30.9	0	0	0	110.8
12	L	35.4	Very low	34.2	Very low	121 Å²	121	121.4 Å²	121.4	63%	0.634	73%	0.729	S	S	*	*			cis	-162.2	129.1	-12.6	-135.9	177.3	0	0	0	112.7	L270 A271	L12-L270 CarbonylContact C-O 3.55Å; L12-A271 CarbonylContact C-O 3.59Å; L12-A271 VanDerWaalsContact CA-O 3.28Å; L12-A271 WeakPolarHBondContact CA-O 3.23Å
13	G	34.5	Very low	34.2	Very low	45 Å²	45	117.8 Å²	117.8	46%	0.464	73%	0.728	S	S	.	*			trans	65.7	165.5	153	0	0	0	0	0	122.7	A271	G13-A271 PolarHBondContact N-O 3.19Å
14	A	32.1	Very low	34.1	Very low	107 Å²	107	119.2 Å²	119.2	88%	0.884	74%	0.74	S	S	*	*			cis	-165.8	174.6	-8.9	0	0	0	0	0	115
15	M	25	Very low	34.1	Very low	154 Å²	154	113.4 Å²	113.4	76%	0.759	74%	0.735	S	S	*	*			trans	-45.6	164.8	179	-87.6	-76.4	107.9	0	0	120.4	V17	M15-V17 HydrophobicContact SD-CG2 3.63Å
16	P	42.6	Very low	34	Very low	127 Å²	127	111.2 Å²	111.2	83%	0.825	73%	0.727	S	S	*	*				-148.1	-161.7	62.3	41.8	-18.8	0	0	0	119.4
17	V	32.1	Very low	33	Very low	109 Å²	109	113.9 Å²	113.9	66%	0.661	73%	0.728	S	S	*	*			trans	-136.5	154.4	-154.1	178.4	0	0	0	0	113.2	M15	M15-V17 HydrophobicContact SD-CG2 3.63Å
18	P	41.8	Very low	31.8	Very low	113 Å²	113	115.3 Å²	115.3	73%	0.734	74%	0.735	S	S	*	*				-154.2	133.5	122.6	36.2	-16.2	0	0	0	119.5
19	D	26.7	Very low	31.8	Very low	160 Å²	160	117.2 Å²	117.2	86%	0.856	74%	0.736	S	S	*	*			trans	60	179.2	134.5	-57.5	-35	0	0	0	127.2
20	Q	27.2	Very low	31.7	Very low	178 Å²	178	118.2 Å²	118.2	83%	0.832	74%	0.737	S	S	*	*			trans	-131.4	-171.4	-149.2	-106.3	-169.2	28.2	0	0	112.6
21	P	47.9	Very low	31.4	Very low	99 Å²	99	122.9 Å²	122.9	64%	0.643	75%	0.751	S	S	*	*			cis	-141.3	-177.3	-32.9	38	-18.9	0	0	0	116.5
22	S	27.3	Very low	30.7	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	77%	0.765	S	S	*	*			trans	104.9	141.1	134.7	79.6	0	0	0	0	125.1
23	S	27.8	Very low	30.8	Very low	118 Å²	118	125 Å²	125	83%	0.825	78%	0.775	S	S	*	*			trans	111	150.8	143.7	80	0	0	0	0	122.3
24	A	27.9	Very low	30.5	Very low	109 Å²	109	125.9 Å²	125.9	90%	0.901	78%	0.784	S	S	*	*			trans	85.5	153.1	167.3	0	0	0	0	0	121.6
25	S	28.1	Very low	30.5	Very low	110 Å²	110	128.7 Å²	128.7	77%	0.769	78%	0.783	S	S	*	*			trans	-119.3	176	-171.9	-149	0	0	0	0	109.7
26	E	26.8	Very low	30.6	Very low	136 Å²	136	127.7 Å²	127.7	64%	0.636	78%	0.781	S	S	*	*			cis	-161.1	158.5	18	-161.1	175.9	179.6	0	0	112.4
27	K	26	Very low	29.9	Very low	166 Å²	166	127.4 Å²	127.4	72%	0.722	78%	0.777	S	S	*	*			trans	34.7	116.3	157.7	-75	159.6	-173.9	153.5	0	120.8
28	T	24.4	Very low	29.8	Very low	148 Å²	148	127.3 Å²	127.3	91%	0.908	78%	0.781	S	S	*	*				178.1	146.5	104.8	27.1	0	0	0	0	110.7
29	S	27.7	Very low	29.2	Very low	118 Å²	118	130.2 Å²	130.2	83%	0.825	79%	0.791	S	S	*	*			trans	-154.2	119.9	172.1	49.8	0	0	0	0	113.1
30	S	25.2	Very low	29.4	Very low	118 Å²	118	125.8 Å²	125.8	83%	0.825	78%	0.783	S	S	*	*			trans	-139.4	105.9	166	56.8	0	0	0	0	107.3
31	L	27.5	Very low	29.7	Very low	165 Å²	165	125.9 Å²	125.9	86%	0.864	79%	0.789	S	S	*	*			trans	-135.3	115.9	-176.2	-76.1	173.5	0	0	0	111
32	S	30.9	Very low	28.9	Very low	110 Å²	110	124.1 Å²	124.1	77%	0.769	79%	0.789	S	S	*	*			trans	-75.3	156.4	142.6	-45.2	0	0	0	0	108.1
33	P	36.8	Very low	29.8	Very low	130 Å²	130	125 Å²	125	84%	0.844	80%	0.795	S	S	*	*				-140.6	179.7	81.8	38.6	-23.6	0	0	0	113.2
34	G	28.1	Very low	30.3	Very low	63 Å²	63	128 Å²	128	65%	0.649	80%	0.796	S	S	*	*			trans	-120	169.7	172.2	0	0	0	0	0	112.7
35	L	33.6	Very low	31.2	Very low	165 Å²	165	129.2 Å²	129.2	86%	0.864	79%	0.793	S	S	*	*			trans	69.5	137.1	175.6	-45.1	175.9	0	0	0	113.2
36	N	25.8	Very low	32.3	Very low	133 Å²	133	131.5 Å²	131.5	71%	0.711	79%	0.791	S	S	*	*			cis	-166	168.5	34.7	-141.1	-11.2	0	0	0	113.9
37	T	28.1	Very low	34.3	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	79%	0.788	S	S	*	*			trans	68.9	146	154.9	58.2	0	0	0	0	123.5
38	S	29.9	Very low	36	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	78%	0.784	S	S	*	*			trans	72.3	114.4	145.7	-176.7	0	0	0	0	120.1
39	N	30.2	Very low	37.9	Very low	175 Å²	175	123.7 Å²	123.7	94%	0.936	77%	0.771	S	S	*	*			trans	-126.6	121.8	147.2	-93.4	-25.8	0	0	0	110.1
40	G	29.9	Very low	39.6	Very low	67 Å²	67	120.4 Å²	120.4	69%	0.691	75%	0.751	S	S	*	*			trans	-100.2	174	164.6	0	0	0	0	0	110.8
41	D	34.3	Very low	41.8	Very low	179 Å²	179	118.8 Å²	118.8	96%	0.957	73%	0.732	S	S	*	*			trans	-64.3	133.9	-177.7	-170.6	14.3	0	0	0	112.6
42	G	30.2	Very low	43.8	Very low	62 Å²	62	116.4 Å²	116.4	64%	0.639	72%	0.719	S	S	*	*			trans	-174.9	110.4	-175.3	0	0	0	0	0	112	E44	G42-E44 PolarHBondContact O-N 2.89Å
43	S	45.8	Very low	45.9	Very low	125 Å²	125	114 Å²	114	87%	0.874	71%	0.707	S	S	*	*			trans	-86.2	95.2	-176.3	62.6	0	0	0	0	112.4
44	E	38.5	Very low	47.9	Very low	181 Å²	181	110.6 Å²	110.6	85%	0.846	69%	0.685	S	S	*	*			trans	-108.1	144.5	166.4	-62.5	-159	161.2	0	0	111.3	G42 E46	G42-E44 PolarHBondContact O-N 2.89Å; E44-E46 PolarHBondContact O-N 2.73Å
45	T	48.2	Very low	50.3	Low	135 Å²	135	110.5 Å²	110.5	83%	0.828	67%	0.672	S	S	*	*			trans	-78.6	106.4	178	49.5	0	0	0	0	109.9	T47	T45-T47 PolarHBondContact O-N 3.38Å
46	E	50.9	Low	52.5	Low	157 Å²	157	109.9 Å²	109.9	73%	0.734	66%	0.662	S	S	*	*			trans	-51.1	121.5	175.5	-65.5	-175	141.2	0	0	111	E44 I51	E44-E46 PolarHBondContact O-N 2.73Å; E46-I51 HydrophobicContact CB-CD1 4.45Å; E46-I51 HydrophobicContact CB-CG1 4.39Å
47	T	67.8	Low	55.2	Low	94 Å²	94	109.1 Å²	109.1	58%	0.577	66%	0.655	S	S	*	*			trans	-81.3	147.5	173	57.6	0	0	0	0	109.6	T45 S49 A50	T45-T47 PolarHBondContact O-N 3.38Å; T47-S49 PolarHBondContact O-N 2.71Å; T47-A50 WeakPolarHBondContact O-CB 3.24Å; T47-A50 PolarHBondContact O-N 3.34Å
48	T	62.4	Low	57.4	Low	104 Å²	104	109.1 Å²	109.1	64%	0.638	65%	0.646	S	S	*	*	H	α-helix	trans	-52.9	-30.5	-176.2	-38.9	0	0	0	0	113.2	I51 L52	T48-I51 PolarHBondContact O-N 3.36Å; T48-L52 HydrophobicContact CG2-CD1 4.39Å; T48-L52 WeakPolarHBondContact O-CG 3.35Å; T48-L52 PolarHBondContact O-N 2.95Å
49	S	63.4	Low	60	Low	89 Å²	89	110 Å²	110	62%	0.622	64%	0.638	S	S	*	*	H	α-helix	trans	-64.2	-34.7	175.7	-51.3	0	0	0	0	113.9	T47 A53	T47-S49 PolarHBondContact O-N 2.71Å; S49-A53 PolarHBondContact O-N 3.46Å
50	A	63.6	Low	62.6	Low	49 Å²	49	107.1 Å²	107.1	41%	0.405	62%	0.622	S	S	.	*	H	α-helix	trans	-70.6	-42	177.1	0	0	0	0	0	111.2	T47 L52 A53 S54	T47-A50 WeakPolarHBondContact O-CB 3.24Å; T47-A50 PolarHBondContact O-N 3.34Å; A50-L52 PolarHBondContact O-N 3.1Å; A50-A53 PolarHBondContact O-N 3.24Å; A50-S54 PolarHBondContact O-N 2.78Å
51	I	71.6	Confident	64.7	Low	83 Å²	83	109.9 Å²	109.9	43%	0.426	62%	0.617	S	S	.	*	H	α-helix	trans	-61.4	-45.4	175.1	-56.4	177.2	0	0	0	110.1	E46 T48 A53 S54 V55	E46-I51 HydrophobicContact CB-CD1 4.45Å; E46-I51 HydrophobicContact CB-CG1 4.39Å; T48-I51 PolarHBondContact O-N 3.36Å; I51-A53 VanDerWaalsContact C-N 3.32Å; I51-A53 PolarHBondContact O-N 2.8Å; I51-S54 PolarHBondContact O-N 3.45Å; I51-V55 HydrophobicContact CG2-CG2 4.48Å; I51-V55 WeakPolarHBondContact O-CG2 3.35Å; I51-V55 PolarHBondContact O-N 3.42Å
52	L	70.4	Confident	67.1	Low	115 Å²	115	108.3 Å²	108.3	60%	0.602	60%	0.603	S	S	*	*	H	α-helix	trans	-64.2	-33	176.7	-72.4	169.4	0	0	0	113.3	T48 A50 K56	T48-L52 HydrophobicContact CG2-CD1 4.39Å; T48-L52 WeakPolarHBondContact O-CG 3.35Å; T48-L52 PolarHBondContact O-N 2.95Å; A50-L52 PolarHBondContact O-N 3.1Å; L52-K56 WeakPolarHBondContact O-CB 3.39Å; L52-K56 PolarHBondContact O-N 3.49Å
53	A	73.7	Confident	69.5	Low	61 Å²	61	110.2 Å²	110.2	50%	0.504	60%	0.595	S	S	.	*	H	α-helix	trans	-67.6	-44.8	172.6	0	0	0	0	0	111.6	S49 A50 I51 K56 E57	S49-A53 PolarHBondContact O-N 3.46Å; A50-A53 PolarHBondContact O-N 3.24Å; I51-A53 VanDerWaalsContact C-N 3.32Å; I51-A53 PolarHBondContact O-N 2.8Å; A53-K56 PolarHBondContact O-N 2.6Å; A53-E57 PolarHBondContact O-N 3.01Å
54	S	78.4	Confident	71.3	Confident	57 Å²	57	112.7 Å²	112.7	40%	0.399	59%	0.585	S	S	.	*	H	α-helix	trans	-64.2	-42.6	178.2	-174.3	0	0	0	0	112.6	A50 I51 K56 E57 Q58	A50-S54 PolarHBondContact O-N 2.78Å; I51-S54 PolarHBondContact O-N 3.45Å; S54-K56 VanDerWaalsContact C-N 3.33Å; S54-K56 PolarHBondContact O-N 2.67Å; S54-E57 PolarHBondContact O-N 3.16Å; S54-Q58 WeakPolarHBondContact O-CG 3.12Å; S54-Q58 PolarHBondContact O-N 3.35Å
55	V	79.1	Confident	73.2	Confident	62 Å²	62	109.6 Å²	109.6	38%	0.376	57%	0.573	S	S	.	*	H	α-helix	trans	-59.2	-44.4	173.9	169.8	0	0	0	0	110.9	I51 E57 Q58 E59	I51-V55 HydrophobicContact CG2-CG2 4.48Å; I51-V55 WeakPolarHBondContact O-CG2 3.35Å; I51-V55 PolarHBondContact O-N 3.42Å; V55-E57 VanDerWaalsContact C-N 3.3Å; V55-E57 PolarHBondContact O-N 2.97Å; V55-Q58 WeakPolarHBondContact O-CB 3.02Å; V55-Q58 PolarHBondContact O-N 3.34Å; V55-Q58 VanDerWaalsContact O-N 3.15Å; V55-E59 WeakPolarHBondContact O-CG 3.42Å; V55-E59 PolarHBondContact O-N 3.47Å
56	K	79.6	Confident	75	Confident	151 Å²	151	106.4 Å²	106.4	66%	0.657	55%	0.554	S	S	*	*	H	α-helix	trans	-67	-29.6	178.9	-168.4	172.3	-176	177.1	0	113.4	L52 A53 S54 L60	L52-K56 WeakPolarHBondContact O-CB 3.39Å; L52-K56 PolarHBondContact O-N 3.49Å; A53-K56 PolarHBondContact O-N 2.6Å; S54-K56 VanDerWaalsContact C-N 3.33Å; S54-K56 PolarHBondContact O-N 2.67Å; K56-L60 PolarHBondContact O-N 3.18Å
57	E	82.3	Confident	76.6	Confident	117 Å²	117	105.4 Å²	105.4	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-71.1	-39.9	171.1	-173.2	171.5	-170.7	0	0	111.7	A53 S54 V55 L60 Q61	A53-E57 PolarHBondContact O-N 3.01Å; S54-E57 PolarHBondContact O-N 3.16Å; V55-E57 VanDerWaalsContact C-N 3.3Å; V55-E57 PolarHBondContact O-N 2.97Å; E57-L60 PolarHBondContact O-N 2.62Å; E57-Q61 WeakPolarHBondContact O-CG 3.33Å; E57-Q61 PolarHBondContact O-N 2.84Å
58	Q	75.8	Confident	77.3	Confident	123 Å²	123	106.6 Å²	106.6	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-64.4	-40.2	173.9	-71.1	177.1	-7.4	0	0	112.4	S54 V55 L60 Q61 F62	S54-Q58 WeakPolarHBondContact O-CG 3.12Å; S54-Q58 PolarHBondContact O-N 3.35Å; V55-Q58 WeakPolarHBondContact O-CB 3.02Å; V55-Q58 PolarHBondContact O-N 3.34Å; V55-Q58 VanDerWaalsContact O-N 3.15Å; Q58-L60 VanDerWaalsContact C-N 3.34Å; Q58-L60 PolarHBondContact O-N 3.4Å; Q58-Q61 PolarHBondContact O-N 3.25Å; Q58-F62 WeakPolarHBondContact O-CB 3.31Å; Q58-F62 PolarHBondContact O-N 3.12Å
59	E	83.6	Confident	78.2	Confident	123 Å²	123	107.3 Å²	107.3	58%	0.575	54%	0.542	S	S	*	.	H	α-helix	trans	-57.6	-45.1	172	-73.2	175.6	156.2	0	0	111.5	V55 F62 E63	V55-E59 WeakPolarHBondContact O-CG 3.42Å; V55-E59 PolarHBondContact O-N 3.47Å; E59-F62 PolarHBondContact O-N 3.2Å; E59-E63 PolarHBondContact O-N 2.92Å
60	L	84.8	Confident	79.2	Confident	115 Å²	115	106.6 Å²	106.6	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-66.4	-37.5	178.4	-171.4	70.2	0	0	0	112.6	K56 E57 Q58 R64	K56-L60 PolarHBondContact O-N 3.18Å; E57-L60 PolarHBondContact O-N 2.62Å; Q58-L60 VanDerWaalsContact C-N 3.34Å; Q58-L60 PolarHBondContact O-N 3.4Å; L60-R64 PolarHBondContact O-N 3.12Å
61	Q	74.1	Confident	80.2	Confident	125 Å²	125	106.4 Å²	106.4	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-67.4	-41	173.9	-70.8	-171.7	18.6	0	0	111.7	E57 Q58 R64 L65	E57-Q61 WeakPolarHBondContact O-CG 3.33Å; E57-Q61 PolarHBondContact O-N 2.84Å; Q58-Q61 PolarHBondContact O-N 3.25Å; Q61-R64 PolarHBondContact O-N 3.2Å; Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 PolarHBondContact O-N 2.89Å
62	F	84.9	Confident	80.7	Confident	147 Å²	147	108.6 Å²	108.6	65%	0.645	54%	0.536	S	S	*	.	H	α-helix	trans	-63.9	-40.6	175.5	-172.8	-94.1	0	0	0	112	Q58 E59 L65 T66	Q58-F62 WeakPolarHBondContact O-CB 3.31Å; Q58-F62 PolarHBondContact O-N 3.12Å; E59-F62 PolarHBondContact O-N 3.2Å; F62-L65 PolarHBondContact O-N 3.29Å; F62-T66 WeakPolarHBondContact O-CB 3.19Å; F62-T66 PolarHBondContact O-N 3.04Å; F62-T66 PolarHBondContact O-OG1 2.91Å
63	E	81.6	Confident	81.5	Confident	102 Å²	102	111 Å²	111	48%	0.477	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-38	175.2	-156.5	-149.3	165	0	0	111.9	E59 R67	E59-E63 PolarHBondContact O-N 2.92Å; E63-R67 WeakPolarHBondContact O-CB 3.36Å; E63-R67 PolarHBondContact O-N 3.49Å; E63-R67 VanDerWaalsContact O-N 3.14Å; E63-R67 IonicContact OE1-CZ 2.69Å; E63-R67 IonicContact OE1-NH2 3.16Å; E63-R67 PolarHBondContact OE1-NH2 3.04Å; E63-R67 IonicContact OE2-NH2 2.7Å; E63-R67 PolarHBondContact OE2-NH2 3.43Å; E63-R67 VanDerWaalsContact OE2-NH2 3.16Å
64	R	83.3	Confident	81.4	Confident	176 Å²	176	113.6 Å²	113.6	66%	0.664	54%	0.538	S	S	*	.	H	α-helix	trans	-62.2	-51.3	171.8	176.6	176.4	-80.6	-178	-5	111.4	L60 Q61 T66 R67 E68	L60-R64 PolarHBondContact O-N 3.12Å; Q61-R64 PolarHBondContact O-N 3.2Å; R64-T66 VanDerWaalsContact C-N 3.31Å; R64-T66 PolarHBondContact O-N 2.96Å; R64-R67 PolarHBondContact O-N 3.19Å; R64-R67 VanDerWaalsContact O-N 3.13Å; R64-E68 PolarHBondContact O-N 3.34Å
65	L	78.1	Confident	81.7	Confident	116 Å²	116	115.5 Å²	115.5	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-61.5	-39.8	-177.9	-163.7	75.9	0	0	0	111.8	Q61 F62 R67 E68 L69	Q61-L65 WeakPolarHBondContact O-CB 3.36Å; Q61-L65 PolarHBondContact O-N 2.89Å; F62-L65 PolarHBondContact O-N 3.29Å; L65-R67 VanDerWaalsContact C-N 3.35Å; L65-R67 PolarHBondContact O-N 2.91Å; L65-E68 PolarHBondContact O-N 3.34Å; L65-L69 WeakPolarHBondContact O-CB 3.34Å; L65-L69 PolarHBondContact O-N 2.84Å
66	T	85.1	Confident	81.6	Confident	69 Å²	69	116.2 Å²	116.2	42%	0.423	55%	0.547	S	S	.	.	H	α-helix	trans	-62.4	-41.6	175.4	-56.4	0	0	0	0	111.7	F62 R64 E68 L69 E70	F62-T66 WeakPolarHBondContact O-CB 3.19Å; F62-T66 PolarHBondContact O-N 3.04Å; F62-T66 PolarHBondContact O-OG1 2.91Å; R64-T66 VanDerWaalsContact C-N 3.31Å; R64-T66 PolarHBondContact O-N 2.96Å; T66-E68 VanDerWaalsContact C-N 3.33Å; T66-E68 PolarHBondContact O-N 2.76Å; T66-L69 PolarHBondContact O-N 2.98Å; T66-E70 PolarHBondContact O-N 2.7Å
67	R	84.2	Confident	81.4	Confident	136 Å²	136	111.7 Å²	111.7	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-69.9	-30.4	179.1	-158.2	-176.9	-59.1	104	-9	112.6	E63 R64 L65 A71	E63-R67 WeakPolarHBondContact O-CB 3.36Å; E63-R67 PolarHBondContact O-N 3.49Å; E63-R67 VanDerWaalsContact O-N 3.14Å; E63-R67 IonicContact OE1-CZ 2.69Å; E63-R67 IonicContact OE1-NH2 3.16Å; E63-R67 PolarHBondContact OE1-NH2 3.04Å; E63-R67 IonicContact OE2-NH2 2.7Å; E63-R67 PolarHBondContact OE2-NH2 3.43Å; E63-R67 VanDerWaalsContact OE2-NH2 3.16Å; R64-R67 PolarHBondContact O-N 3.19Å; R64-R67 VanDerWaalsContact O-N 3.13Å; L65-R67 VanDerWaalsContact C-N 3.35Å; L65-R67 PolarHBondContact O-N 2.91Å; R67-A71 PolarHBondContact O-N 3.01Å
68	E	83.6	Confident	80.9	Confident	119 Å²	119	108.6 Å²	108.6	56%	0.556	53%	0.53	S	S	*	.	H	α-helix	trans	-75	-42.2	175.6	-166.3	156.2	-147.2	0	0	111.4	R64 L65 T66 E70 A71 E72	R64-E68 PolarHBondContact O-N 3.34Å; L65-E68 PolarHBondContact O-N 3.34Å; T66-E68 VanDerWaalsContact C-N 3.33Å; T66-E68 PolarHBondContact O-N 2.76Å; E68-E70 PolarHBondContact O-N 3.02Å; E68-A71 WeakPolarHBondContact O-CB 3.19Å; E68-A71 PolarHBondContact O-N 3.38Å; E68-A71 VanDerWaalsContact O-N 3.15Å; E68-E72 PolarHBondContact O-N 3.21Å
69	L	80.8	Confident	80.4	Confident	119 Å²	119	108 Å²	108	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-61.7	-40.1	173.1	-169.9	73.5	0	0	0	112.5	L65 T66 A71 E72 R73	L65-L69 WeakPolarHBondContact O-CB 3.34Å; L65-L69 PolarHBondContact O-N 2.84Å; T66-L69 PolarHBondContact O-N 2.98Å; L69-A71 VanDerWaalsContact C-N 3.31Å; L69-E72 PolarHBondContact O-N 3.19Å; L69-R73 WeakPolarHBondContact O-CB 3.34Å; L69-R73 PolarHBondContact O-N 3.16Å
70	E	85.8	Confident	79.7	Confident	74 Å²	74	107.8 Å²	107.8	35%	0.346	53%	0.529	S	S	.	.	H	α-helix	trans	-68.4	-31.2	175.7	-168.9	59.4	-134.1	0	0	111.9	T66 E68 R73 Q74	T66-E70 PolarHBondContact O-N 2.7Å; E68-E70 PolarHBondContact O-N 3.02Å; E70-R73 PolarHBondContact O-N 2.89Å; E70-R73 IonicContact OE1-CZ 2.74Å; E70-R73 IonicContact OE1-NH1 2.69Å; E70-R73 PolarHBondContact OE1-NH1 3.49Å; E70-R73 IonicContact OE2-NH1 3.81Å; E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.44Å; E70-Q74 PolarHBondContact O-N 3.12Å
71	A	82.8	Confident	79	Confident	45 Å²	45	108.3 Å²	108.3	37%	0.372	53%	0.528	S	S	.	.	H	α-helix	trans	-69.1	-42.9	172.7	0	0	0	0	0	112	R67 E68 L69 R73 Q74 I75	R67-A71 PolarHBondContact O-N 3.01Å; E68-A71 WeakPolarHBondContact O-CB 3.19Å; E68-A71 PolarHBondContact O-N 3.38Å; E68-A71 VanDerWaalsContact O-N 3.15Å; L69-A71 VanDerWaalsContact C-N 3.31Å; A71-R73 VanDerWaalsContact C-N 3.34Å; A71-R73 PolarHBondContact O-N 3.35Å; A71-Q74 PolarHBondContact O-N 3.47Å; A71-I75 VanDerWaalsContact O-CG1 3.31Å; A71-I75 WeakPolarHBondContact O-CG1 3.25Å; A71-I75 PolarHBondContact O-N 2.9Å
72	E	83	Confident	78.3	Confident	129 Å²	129	111.1 Å²	111.1	60%	0.603	53%	0.533	S	S	*	.	H	α-helix	trans	-60.5	-43.4	171.2	-73.6	-153.5	138.2	0	0	111.8	E68 L69 Q74 I75 V76	E68-E72 PolarHBondContact O-N 3.21Å; L69-E72 PolarHBondContact O-N 3.19Å; E72-Q74 VanDerWaalsContact C-N 3.29Å; E72-Q74 PolarHBondContact O-N 3.45Å; E72-I75 PolarHBondContact O-N 3.39Å; E72-I75 VanDerWaalsContact O-N 3.14Å; E72-V76 WeakPolarHBondContact O-CG2 3.44Å; E72-V76 PolarHBondContact O-N 3.48Å
73	R	86.7	Confident	77	Confident	165 Å²	165	108.7 Å²	108.7	62%	0.623	53%	0.534	S	S	*	.	H	α-helix	trans	-56.9	-42	175.8	-180	178.4	174.6	-110	-3.3	112	L69 E70 A71 A77	L69-R73 WeakPolarHBondContact O-CB 3.34Å; L69-R73 PolarHBondContact O-N 3.16Å; E70-R73 PolarHBondContact O-N 2.89Å; E70-R73 IonicContact OE1-CZ 2.74Å; E70-R73 IonicContact OE1-NH1 2.69Å; E70-R73 PolarHBondContact OE1-NH1 3.49Å; E70-R73 IonicContact OE2-NH1 3.81Å; A71-R73 VanDerWaalsContact C-N 3.34Å; A71-R73 PolarHBondContact O-N 3.35Å; R73-A77 WeakPolarHBondContact O-CB 3.48Å; R73-A77 PolarHBondContact O-N 3.22Å
74	Q	71.5	Confident	75.8	Confident	116 Å²	116	112.1 Å²	112.1	54%	0.542	55%	0.547	S	S	.	.	H	α-helix	trans	-68.1	-40.8	175.5	-72.5	171.8	16.5	0	0	112.3	E70 A71 E72 V76 A77 S78	E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.44Å; E70-Q74 PolarHBondContact O-N 3.12Å; A71-Q74 PolarHBondContact O-N 3.47Å; E72-Q74 VanDerWaalsContact C-N 3.29Å; E72-Q74 PolarHBondContact O-N 3.45Å; Q74-V76 PolarHBondContact O-N 2.96Å; Q74-A77 PolarHBondContact O-N 3.27Å; Q74-S78 PolarHBondContact O-N 3.31Å; Q74-S78 PolarHBondContact O-OG 3.35Å
75	I	85.1	Confident	74.2	Confident	96 Å²	96	109.5 Å²	109.5	49%	0.492	55%	0.546	S	S	.	.	H	α-helix	trans	-60.6	-45.2	174.8	-69.7	163.8	0	0	0	110.8	A71 E72 S78 Q79	A71-I75 VanDerWaalsContact O-CG1 3.31Å; A71-I75 WeakPolarHBondContact O-CG1 3.25Å; A71-I75 PolarHBondContact O-N 2.9Å; E72-I75 PolarHBondContact O-N 3.39Å; E72-I75 VanDerWaalsContact O-N 3.14Å; I75-S78 PolarHBondContact O-N 3.1Å; I75-Q79 VanDerWaalsContact O-CG 3.31Å; I75-Q79 WeakPolarHBondContact O-CG 3.49Å; I75-Q79 PolarHBondContact O-N 3.37Å
76	V	77.4	Confident	72.5	Confident	77 Å²	77	106.8 Å²	106.8	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-40.3	176.7	171.5	0	0	0	0	111.5	E72 Q74 Q79 L80	E72-V76 WeakPolarHBondContact O-CG2 3.44Å; E72-V76 PolarHBondContact O-N 3.48Å; Q74-V76 PolarHBondContact O-N 2.96Å; V76-Q79 PolarHBondContact O-N 2.88Å; V76-L80 HydrophobicContact CG1-CD1 4.25Å; V76-L80 PolarHBondContact O-N 3.11Å
77	A	74.8	Confident	70.5	Confident	56 Å²	56	108.3 Å²	108.3	46%	0.463	56%	0.559	S	S	.	*	H	α-helix	trans	-61.4	-47.3	175	0	0	0	0	0	112.1	R73 Q74 Q79 L80 E81	R73-A77 WeakPolarHBondContact O-CB 3.48Å; R73-A77 PolarHBondContact O-N 3.22Å; Q74-A77 PolarHBondContact O-N 3.27Å; A77-Q79 VanDerWaalsContact C-N 3.3Å; A77-Q79 PolarHBondContact O-N 3.06Å; A77-L80 WeakPolarHBondContact O-CB 3.45Å; A77-L80 PolarHBondContact O-N 3.3Å; A77-E81 WeakPolarHBondContact O-CB 3.3Å; A77-E81 PolarHBondContact O-N 3.45Å
78	S	71.6	Confident	68.2	Low	53 Å²	53	109.8 Å²	109.8	37%	0.371	57%	0.572	S	S	.	*	H	α-helix	trans	-68.1	-25.1	175.9	-64.8	0	0	0	0	113.7	Q74 I75 R82	Q74-S78 PolarHBondContact O-N 3.31Å; Q74-S78 PolarHBondContact O-OG 3.35Å; I75-S78 PolarHBondContact O-N 3.1Å; S78-R82 VanDerWaalsContact O-CG 3.3Å; S78-R82 WeakPolarHBondContact O-CG 3.47Å; S78-R82 PolarHBondContact O-N 2.96Å; S78-R82 VanDerWaalsContact O-N 3.17Å
79	Q	65.2	Low	66	Low	110 Å²	110	110.6 Å²	110.6	51%	0.514	59%	0.585	S	S	.	*	H	α-helix	trans	-70.2	-46.5	169.6	-74.5	176.3	22	0	0	111.1	I75 V76 A77 E81 R82 C83	I75-Q79 VanDerWaalsContact O-CG 3.31Å; I75-Q79 WeakPolarHBondContact O-CG 3.49Å; I75-Q79 PolarHBondContact O-N 3.37Å; V76-Q79 PolarHBondContact O-N 2.88Å; A77-Q79 VanDerWaalsContact C-N 3.3Å; A77-Q79 PolarHBondContact O-N 3.06Å; Q79-E81 VanDerWaalsContact C-N 3.33Å; Q79-E81 PolarHBondContact O-N 2.88Å; Q79-R82 PolarHBondContact O-N 3.4Å; Q79-C83 PolarHBondContact O-N 3.06Å; Q79-C83 PolarHBondContact O-SG 3.32Å; Q79-C83 VanDerWaalsContact O-SG 3.34Å
80	L	68.6	Low	63.6	Low	119 Å²	119	108.8 Å²	108.8	62%	0.623	60%	0.595	S	S	*	*	H	α-helix	trans	-58.6	-41.7	174.2	-92.7	158	0	0	0	112.6	V76 A77 C83 K84	V76-L80 HydrophobicContact CG1-CD1 4.25Å; V76-L80 PolarHBondContact O-N 3.11Å; A77-L80 WeakPolarHBondContact O-CB 3.45Å; A77-L80 PolarHBondContact O-N 3.3Å; L80-C83 WeakPolarHBondContact O-CB 3.34Å; L80-C83 PolarHBondContact O-N 3.49Å; L80-K84 PolarHBondContact O-N 3.32Å
81	E	70.6	Confident	60.9	Low	125 Å²	125	111 Å²	111	58%	0.584	62%	0.619	S	S	*	*	H	α-helix	trans	-64.2	-41.9	176.9	-170.7	171.4	-136.3	0	0	112.1	A77 Q79 K84 L85	A77-E81 WeakPolarHBondContact O-CB 3.3Å; A77-E81 PolarHBondContact O-N 3.45Å; Q79-E81 VanDerWaalsContact C-N 3.33Å; Q79-E81 PolarHBondContact O-N 2.88Å; E81-K84 WeakPolarHBondContact O-CB 3.42Å; E81-K84 PolarHBondContact O-N 3.09Å; E81-L85 HydrophobicContact CG-CD1 4.47Å; E81-L85 PolarHBondContact O-N 3.46Å
82	R	59.5	Low	58.5	Low	184 Å²	184	117.6 Å²	117.6	69%	0.694	64%	0.644	S	S	*	*	H	α-helix	trans	-65.2	-37.7	171.5	-72.8	175.4	-168	162.6	6.9	112.8	S78 Q79 K84 L85 G86	S78-R82 VanDerWaalsContact O-CG 3.3Å; S78-R82 WeakPolarHBondContact O-CG 3.47Å; S78-R82 PolarHBondContact O-N 2.96Å; S78-R82 VanDerWaalsContact O-N 3.17Å; Q79-R82 PolarHBondContact O-N 3.4Å; R82-K84 VanDerWaalsContact C-N 3.28Å; R82-K84 PolarHBondContact O-N 3.12Å; R82-L85 PolarHBondContact O-N 3.41Å; R82-G86 PolarHBondContact O-N 3.19Å
83	C	57.1	Low	55.9	Low	97 Å²	97	116.5 Å²	116.5	66%	0.655	65%	0.651	S	S	*	*	H	α-helix	trans	-64.2	-34.9	173.7	-71.2	0	0	0	0	111.9	Q79 L80 G86	Q79-C83 PolarHBondContact O-N 3.06Å; Q79-C83 PolarHBondContact O-SG 3.32Å; Q79-C83 VanDerWaalsContact O-SG 3.34Å; L80-C83 WeakPolarHBondContact O-CB 3.34Å; L80-C83 PolarHBondContact O-N 3.49Å; C83-G86 PolarHBondContact O-N 3.31Å
84	K	57	Low	53.2	Low	173 Å²	173	113.9 Å²	113.9	75%	0.752	66%	0.658	S	S	*	*	H	α-helix	trans	-68.2	-46.3	175.5	-158.3	177.2	-176.3	-174.1	0	111.6	L80 E81 R82 G86 S87	L80-K84 PolarHBondContact O-N 3.32Å; E81-K84 WeakPolarHBondContact O-CB 3.42Å; E81-K84 PolarHBondContact O-N 3.09Å; R82-K84 VanDerWaalsContact C-N 3.28Å; R82-K84 PolarHBondContact O-N 3.12Å; K84-G86 VanDerWaalsContact C-N 3.28Å; K84-G86 PolarHBondContact O-N 3.35Å; K84-S87 PolarHBondContact O-N 2.86Å
85	L	49	Very low	51	Low	122 Å²	122	116.4 Å²	116.4	64%	0.639	67%	0.673	S	S	*	*	H	α-helix	trans	-67.4	-25.2	175.1	-73.1	163.6	0	0	0	113.4	E81 R82 S87	E81-L85 HydrophobicContact CG-CD1 4.47Å; E81-L85 PolarHBondContact O-N 3.46Å; R82-L85 PolarHBondContact O-N 3.41Å; L85-S87 PolarHBondContact O-N 3.19Å
86	G	42.3	Very low	48.2	Very low	59 Å²	59	117.4 Å²	117.4	61%	0.608	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-5.4	176.1	0	0	0	0	0	115.1	R82 C83 K84	R82-G86 PolarHBondContact O-N 3.19Å; C83-G86 PolarHBondContact O-N 3.31Å; K84-G86 VanDerWaalsContact C-N 3.28Å; K84-G86 PolarHBondContact O-N 3.35Å
87	S	44	Very low	45.9	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-3.3	-176.9	-164.9	0	0	0	0	114.9	K84 L85	K84-S87 PolarHBondContact O-N 2.86Å; L85-S87 PolarHBondContact O-N 3.19Å
88	E	35.6	Very low	43.7	Very low	166 Å²	166	120.9 Å²	120.9	78%	0.776	72%	0.719	S	S	*	*	S	Bend	trans	-113.8	38.2	-170.8	-65.4	-165.1	146.9	0	0	114.9
89	T	36.5	Very low	41.7	Very low	137 Å²	137	127 Å²	127	84%	0.84	74%	0.742	S	S	*	*	S	Bend	trans	-137.9	72.6	168.9	45.9	0	0	0	0	111.9
90	G	31.9	Very low	39.8	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	76%	0.763	S	S	*	*	S	Bend	trans	-149.1	-22.8	-169.7	0	0	0	0	0	120.2
91	S	28.8	Very low	37.9	Very low	119 Å²	119	133 Å²	133	83%	0.832	77%	0.767	S	S	*	*			trans	-160.2	144.9	172.7	-162.5	0	0	0	0	113.2
92	M	32.5	Very low	35.8	Very low	184 Å²	184	135 Å²	135	91%	0.906	77%	0.774	S	S	*	*			trans	-139.7	101.7	-179.5	-99.5	-85.2	-165.4	0	0	109.2
93	S	28.5	Very low	34.1	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	78%	0.779	S	S	*	*			trans	167.2	152.3	150.6	40.2	0	0	0	0	112.3
94	S	28.7	Very low	32.5	Very low	109 Å²	109	142 Å²	142	76%	0.762	79%	0.794	S	S	*	*			cis	-170.4	106.2	-24.2	-92	0	0	0	0	110.5
95	I	26.8	Very low	31.1	Very low	170 Å²	170	142.6 Å²	142.6	87%	0.872	80%	0.799	S	S	*	*			trans	-172	128.6	149.9	34.3	175	0	0	0	106.8
96	S	25	Very low	30.2	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	81%	0.81	S	S	*	*			cis	76.2	120.4	35.2	-162.4	0	0	0	0	112.9
97	S	30.1	Very low	29.3	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	82%	0.823	S	S	*	*			cis	-161.2	146.9	-5.1	-176.6	0	0	0	0	111.1
98	A	28.4	Very low	28.6	Very low	100 Å²	100	152 Å²	152	83%	0.826	83%	0.832	S	S	*	*			trans	-162.3	147	151.6	0	0	0	0	0	109.4
99	E	29.4	Very low	28.2	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	83%	0.83	S	S	*	*			trans	-99.1	145.2	-174.3	-63.7	153.3	120.1	0	0	111.8
100	E	26.5	Very low	28.2	Very low	206 Å²	206	150.4 Å²	150.4	96%	0.963	83%	0.834	S	S	*	*				-164.6	176	117	-111.3	-179.4	-170.6	0	0	111.8
101	Q	27.4	Very low	28.1	Very low	151 Å²	151	155.4 Å²	155.4	71%	0.706	83%	0.833	S	S	*	*			trans	-131	141.6	-155.6	-177.6	-177.9	2.7	0	0	111.1
102	F	26.2	Very low	28.3	Very low	167 Å²	167	155 Å²	155	73%	0.732	82%	0.821	S	S	*	*				163.4	174.3	128.4	-93.6	-69.3	0	0	0	114.8
103	H	23.7	Very low	28.8	Very low	171 Å²	171	152.6 Å²	152.6	79%	0.792	81%	0.81	S	S	*	*			trans	-76.4	150.4	-169.4	-69.3	-47.4	0	0	0	114.8
104	W	24.6	Very low	29.3	Very low	257 Å²	257	154.9 Å²	154.9	97%	0.973	81%	0.81	S	S	*	*			trans	-89.7	131.1	152.9	-75.9	105.8	0	0	0	111
105	Q	26.5	Very low	29.7	Very low	185 Å²	185	155.3 Å²	155.3	86%	0.864	80%	0.803	S	S	*	*			trans	-130.6	112.6	174.5	-162.9	170.4	37	0	0	107.6
106	S	30	Very low	30.4	Very low	125 Å²	125	154.6 Å²	154.6	87%	0.874	80%	0.796	S	S	*	*			trans	-76	132.7	-172.2	-50.6	0	0	0	0	112.4
107	Q	25	Very low	31.1	Very low	186 Å²	186	154.1 Å²	154.1	87%	0.869	78%	0.784	S	S	*	*			trans	-148.1	141.4	162.5	-160.6	163.8	24.6	0	0	110.1
108	D	28.1	Very low	31.7	Very low	167 Å²	167	152.5 Å²	152.5	89%	0.893	77%	0.77	S	S	*	*			trans	-71	150.3	-173.3	-49.6	-88.4	0	0	0	113.2
109	G	27.3	Very low	32.7	Very low	71 Å²	71	151.8 Å²	151.8	73%	0.732	76%	0.755	S	S	*	*			trans	172.5	16.9	172	0	0	0	0	0	123.8	K111	G109-K111 PolarHBondContact O-N 3.2Å
110	Q	36	Very low	33.6	Very low	200 Å²	200	145 Å²	145	94%	0.935	73%	0.734	S	S	*	*			trans	52.6	65.8	153.7	-165.7	-178.1	-7	0	0	117.4
111	K	30.5	Very low	34.7	Very low	185 Å²	185	140.4 Å²	140.4	80%	0.804	72%	0.715	S	S	*	*			trans	-173.2	148.3	162.9	-100.2	-179.6	-174.1	-177.8	0	107.3	G109	G109-K111 PolarHBondContact O-N 3.2Å
112	D	33.5	Very low	35.4	Very low	111 Å²	111	139.2 Å²	139.2	59%	0.594	71%	0.71	S	S	*	*			cis	-129.2	153.6	-0	-71	-70.1	0	0	0	109.5
113	I	41.9	Very low	36.6	Very low	133 Å²	133	137.3 Å²	137.3	68%	0.682	71%	0.706	S	S	*	*	S	Bend	trans	-105.8	-13.9	-177.1	-70.1	173.8	0	0	0	112.5	L117	I113-L117 HydrophobicContact CG2-CD1 4.23Å
114	E	38.7	Very low	38.3	Very low	156 Å²	156	132.9 Å²	132.9	73%	0.729	69%	0.691	S	S	*	*	H	α-helix	trans	-81.3	-29.7	-171.4	-59.8	-172.9	150.2	0	0	113.1	L117 T118	E114-L117 PolarHBondContact O-N 3.47Å; E114-T118 PolarHBondContact O-N 3.47Å; E114-T118 PolarHBondContact O-OG1 3.34Å
115	D	37.7	Very low	39.7	Very low	117 Å²	117	124.9 Å²	124.9	63%	0.626	67%	0.667	S	S	*	*	H	α-helix	trans	-76.3	-32.3	178.5	-70.6	-27.4	0	0	0	113.5	L117 T118 T119	D115-L117 VanDerWaalsContact C-N 3.32Å; D115-T118 PolarHBondContact O-N 3.37Å; D115-T119 PolarHBondContact O-N 2.93Å; D115-T119 PolarHBondContact O-OG1 3.34Å
116	E	41.2	Very low	40.9	Very low	155 Å²	155	119.3 Å²	119.3	72%	0.724	65%	0.649	S	S	*	*	H	α-helix	trans	-69.1	-32.8	173	-167.1	174.7	-154.3	0	0	111.2	T119 G120	E116-T119 PolarHBondContact O-OG1 3.39Å; E116-G120 PolarHBondContact O-N 3.44Å; E116-G120 VanDerWaalsContact O-N 3.1Å
117	L	41	Very low	41.8	Very low	108 Å²	108	117 Å²	117	57%	0.565	63%	0.632	S	S	*	*	H	α-helix	trans	-69.3	-38	169.2	-91.8	159	0	0	0	112.6	I113 E114 D115 G120 L121	I113-L117 HydrophobicContact CG2-CD1 4.23Å; E114-L117 PolarHBondContact O-N 3.47Å; D115-L117 VanDerWaalsContact C-N 3.32Å; L117-G120 PolarHBondContact O-N 3.2Å; L117-L121 VanDerWaalsContact O-CG 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.38Å; L117-L121 PolarHBondContact O-N 3.37Å
118	T	42.7	Very low	43.8	Very low	71 Å²	71	111.4 Å²	111.4	44%	0.436	61%	0.607	S	S	.	*	H	α-helix	trans	-67.2	-47.1	179.7	-56.6	0	0	0	0	111.5	E114 D115 G120 L121 E122	E114-T118 PolarHBondContact O-N 3.47Å; E114-T118 PolarHBondContact O-OG1 3.34Å; D115-T118 PolarHBondContact O-N 3.37Å; T118-G120 VanDerWaalsContact C-N 3.34Å; T118-G120 PolarHBondContact O-N 2.91Å; T118-L121 WeakPolarHBondContact O-CB 3.43Å; T118-L121 PolarHBondContact O-N 2.85Å; T118-L121 VanDerWaalsContact O-N 3.15Å; T118-E122 PolarHBondContact O-N 3.1Å
119	T	49	Very low	45.2	Very low	85 Å²	85	110.2 Å²	110.2	52%	0.521	59%	0.59	S	S	.	*	H	α-helix	trans	-65.4	-34.5	174.7	46.1	0	0	0	0	112.8	D115 E116 E122 L123	D115-T119 PolarHBondContact O-N 2.93Å; D115-T119 PolarHBondContact O-OG1 3.34Å; E116-T119 PolarHBondContact O-OG1 3.39Å; T119-E122 PolarHBondContact O-N 3.21Å; T119-L123 PolarHBondContact O-N 3.07Å
120	G	48.5	Very low	46.6	Very low	38 Å²	38	109.9 Å²	109.9	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-62.2	-38.5	170	0	0	0	0	0	113.6	E116 L117 T118 V124	E116-G120 PolarHBondContact O-N 3.44Å; E116-G120 VanDerWaalsContact O-N 3.1Å; L117-G120 PolarHBondContact O-N 3.2Å; T118-G120 VanDerWaalsContact C-N 3.34Å; T118-G120 PolarHBondContact O-N 2.91Å; G120-V124 WeakPolarHBondContact O-CG2 3.4Å; G120-V124 PolarHBondContact O-N 3.33Å
121	L	48.2	Very low	47.5	Very low	109 Å²	109	103.9 Å²	103.9	57%	0.571	55%	0.551	S	S	*	*	H	α-helix	trans	-70	-41.3	176.4	-75.1	165.7	0	0	0	112.3	L117 T118 L123 V124 D125	L117-L121 VanDerWaalsContact O-CG 3.31Å; L117-L121 WeakPolarHBondContact O-CG 3.38Å; L117-L121 PolarHBondContact O-N 3.37Å; T118-L121 WeakPolarHBondContact O-CB 3.43Å; T118-L121 PolarHBondContact O-N 2.85Å; T118-L121 VanDerWaalsContact O-N 3.15Å; L121-L123 VanDerWaalsContact C-N 3.27Å; L121-L123 PolarHBondContact O-N 2.94Å; L121-V124 PolarHBondContact O-N 3.38Å; L121-V124 VanDerWaalsContact O-N 3.11Å; L121-D125 PolarHBondContact O-N 3.35Å
122	E	43.2	Very low	48.5	Very low	127 Å²	127	99.1 Å²	99.1	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-61.5	-36	175.4	-70.2	-170.2	149.9	0	0	112.4	T118 T119 V124 D125 S126	T118-E122 PolarHBondContact O-N 3.1Å; T119-E122 PolarHBondContact O-N 3.21Å; E122-V124 VanDerWaalsContact C-N 3.35Å; E122-D125 PolarHBondContact O-N 3.25Å; E122-S126 WeakPolarHBondContact O-CB 3.37Å; E122-S126 PolarHBondContact O-N 3.04Å
123	L	50.2	Low	49.4	Very low	126 Å²	126	102.1 Å²	102.1	66%	0.66	54%	0.542	S	S	*	.	H	α-helix	trans	-65.8	-37.3	174.5	-145.5	81.1	0	0	0	112	T119 L121 S126 C127	T119-L123 PolarHBondContact O-N 3.07Å; L121-L123 VanDerWaalsContact C-N 3.27Å; L121-L123 PolarHBondContact O-N 2.94Å; L123-S126 PolarHBondContact O-N 2.82Å; L123-C127 PolarHBondContact O-N 3.12Å; L123-C127 VanDerWaalsContact O-N 3.07Å; L123-C127 PolarHBondContact O-SG 3.07Å
124	V	59.9	Low	49.8	Very low	79 Å²	79	99.1 Å²	99.1	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-68.9	-44.8	175.1	170.1	0	0	0	0	111.2	G120 L121 E122 S126 C127 I128	G120-V124 WeakPolarHBondContact O-CG2 3.4Å; G120-V124 PolarHBondContact O-N 3.33Å; L121-V124 PolarHBondContact O-N 3.38Å; L121-V124 VanDerWaalsContact O-N 3.11Å; E122-V124 VanDerWaalsContact C-N 3.35Å; V124-S126 VanDerWaalsContact C-N 3.25Å; V124-S126 PolarHBondContact O-N 3.31Å; V124-C127 WeakPolarHBondContact O-CB 3.18Å; V124-C127 PolarHBondContact O-N 3.16Å; V124-I128 HydrophobicContact CG1-CD1 3.8Å; V124-I128 HydrophobicContact CG1-CG1 4.45Å; V124-I128 WeakPolarHBondContact O-CG1 3.39Å; V124-I128 PolarHBondContact O-N 3.26Å
125	D	53.6	Low	50.1	Low	88 Å²	88	94.8 Å²	94.8	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-68.3	-23.6	176.2	-89.6	4	0	0	0	113	L121 E122 R129	L121-D125 PolarHBondContact O-N 3.35Å; E122-D125 PolarHBondContact O-N 3.25Å; D125-R129 WeakPolarHBondContact O-CB 3.48Å; D125-R129 PolarHBondContact O-N 3.49Å; D125-R129 VanDerWaalsContact O-N 3.14Å; D125-R129 PolarHBondContact O-NE 3.21Å
126	S	52.4	Low	50.7	Low	69 Å²	69	95.2 Å²	95.2	48%	0.483	53%	0.531	S	S	.	.	H	α-helix	trans	-70.5	-47.9	169.1	-171.1	0	0	0	0	111.1	E122 L123 V124 I128 R129 S130	E122-S126 WeakPolarHBondContact O-CB 3.37Å; E122-S126 PolarHBondContact O-N 3.04Å; L123-S126 PolarHBondContact O-N 2.82Å; V124-S126 VanDerWaalsContact C-N 3.25Å; V124-S126 PolarHBondContact O-N 3.31Å; S126-I128 VanDerWaalsContact C-N 3.34Å; S126-I128 PolarHBondContact O-N 3.33Å; S126-R129 PolarHBondContact O-N 2.97Å; S126-S130 WeakPolarHBondContact O-CB 3.31Å; S126-S130 PolarHBondContact O-N 3.31Å
127	C	50	Low	50.5	Low	76 Å²	76	91.9 Å²	91.9	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-59.6	-40.7	173	-74.7	0	0	0	0	112.7	L123 V124 S130 L131	L123-C127 PolarHBondContact O-N 3.12Å; L123-C127 VanDerWaalsContact O-N 3.07Å; L123-C127 PolarHBondContact O-SG 3.07Å; V124-C127 WeakPolarHBondContact O-CB 3.18Å; V124-C127 PolarHBondContact O-N 3.16Å; C127-S130 PolarHBondContact O-N 3.02Å; C127-L131 WeakPolarHBondContact O-CB 3.43Å; C127-L131 VanDerWaalsContact O-CG 3.28Å; C127-L131 WeakPolarHBondContact O-CG 3.27Å; C127-L131 PolarHBondContact O-N 3.39Å
128	I	66.1	Low	50.1	Low	68 Å²	68	94.5 Å²	94.5	35%	0.349	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-44.6	177.9	-70.3	167.9	0	0	0	110.9	V124 S126 L131 Q132	V124-I128 HydrophobicContact CG1-CD1 3.8Å; V124-I128 HydrophobicContact CG1-CG1 4.45Å; V124-I128 WeakPolarHBondContact O-CG1 3.39Å; V124-I128 PolarHBondContact O-N 3.26Å; S126-I128 VanDerWaalsContact C-N 3.34Å; S126-I128 PolarHBondContact O-N 3.33Å; I128-L131 PolarHBondContact O-N 2.61Å; I128-Q132 WeakPolarHBondContact O-CG 3.37Å; I128-Q132 PolarHBondContact O-N 3.34Å
129	R	57.3	Low	49.6	Very low	143 Å²	143	94.9 Å²	94.9	54%	0.54	54%	0.536	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.7	-83.9	173.8	-79.1	-169.7	-5	112.3	D125 S126 L131 Q132 E133	D125-R129 WeakPolarHBondContact O-CB 3.48Å; D125-R129 PolarHBondContact O-N 3.49Å; D125-R129 VanDerWaalsContact O-N 3.14Å; D125-R129 PolarHBondContact O-NE 3.21Å; S126-R129 PolarHBondContact O-N 2.97Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.01Å; R129-Q132 WeakPolarHBondContact O-CB 3.39Å; R129-Q132 PolarHBondContact O-N 2.89Å; R129-Q132 VanDerWaalsContact O-N 3.08Å; R129-E133 PolarHBondContact O-N 3.38Å
130	S	56.8	Low	48.8	Very low	64 Å²	64	99.4 Å²	99.4	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-63.8	-34.3	177.2	-168.7	0	0	0	0	112.6	S126 C127 S134	S126-S130 WeakPolarHBondContact O-CB 3.31Å; S126-S130 PolarHBondContact O-N 3.31Å; C127-S130 PolarHBondContact O-N 3.02Å; S130-S134 VanDerWaalsContact O-CB 3.31Å; S130-S134 WeakPolarHBondContact O-CB 3.18Å; S130-S134 PolarHBondContact O-N 3.09Å; S130-S134 PolarHBondContact O-OG 2.93Å
131	L	55.9	Low	47.8	Very low	74 Å²	74	104.5 Å²	104.5	39%	0.387	57%	0.569	S	S	.	*	H	α-helix	trans	-71.8	-27.1	172.9	-73.8	167.5	0	0	0	113.7	C127 I128 R129 I136 L137	C127-L131 WeakPolarHBondContact O-CB 3.43Å; C127-L131 VanDerWaalsContact O-CG 3.28Å; C127-L131 WeakPolarHBondContact O-CG 3.27Å; C127-L131 PolarHBondContact O-N 3.39Å; I128-L131 PolarHBondContact O-N 2.61Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.01Å; L131-I136 PolarHBondContact O-N 2.98Å; L131-L137 HydrophobicContact CB-CD1 3.93Å; L131-L137 HydrophobicContact CB-CG 4.48Å; L131-L137 HydrophobicContact CD1-CD1 4.5Å
132	Q	51.8	Low	46.7	Very low	85 Å²	85	110.6 Å²	110.6	40%	0.397	59%	0.587	S	S	.	*	H	α-helix	trans	-75.7	-45.8	172.4	-72.3	167.9	-25.1	0	0	111.2	I128 R129 S134 G135 L137	I128-Q132 WeakPolarHBondContact O-CG 3.37Å; I128-Q132 PolarHBondContact O-N 3.34Å; R129-Q132 WeakPolarHBondContact O-CB 3.39Å; R129-Q132 PolarHBondContact O-N 2.89Å; R129-Q132 VanDerWaalsContact O-N 3.08Å; Q132-S134 PolarHBondContact O-N 3.33Å; Q132-G135 PolarHBondContact O-N 3.33Å; Q132-L137 HydrophobicContact CG-CB 4.38Å
133	E	51.6	Low	45.9	Very low	174 Å²	174	109.1 Å²	109.1	81%	0.813	59%	0.59	S	S	*	*	H	α-helix	trans	-60.6	-30.9	171.5	-72.4	-175.9	126.4	0	0	112.4	R129 G135	R129-E133 PolarHBondContact O-N 3.38Å; E133-G135 PolarHBondContact O-N 3.31Å
134	S	50	Low	44.9	Very low	69 Å²	69	109.7 Å²	109.7	48%	0.483	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	-5.4	174.4	-61.7	0	0	0	0	114.3	S130 Q132 I136	S130-S134 VanDerWaalsContact O-CB 3.31Å; S130-S134 WeakPolarHBondContact O-CB 3.18Å; S130-S134 PolarHBondContact O-N 3.09Å; S130-S134 PolarHBondContact O-OG 2.93Å; Q132-S134 PolarHBondContact O-N 3.33Å; S134-I136 PolarHBondContact O-N 3.33Å
135	G	44.3	Very low	43.3	Very low	66 Å²	66	109.2 Å²	109.2	68%	0.68	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	67	16.7	-179.1	0	0	0	0	0	114.9	Q132 E133	Q132-G135 PolarHBondContact O-N 3.33Å; E133-G135 PolarHBondContact O-N 3.31Å
136	I	51.1	Low	41.9	Very low	125 Å²	125	115 Å²	115	64%	0.641	63%	0.634	S	S	*	*	S	Bend	trans	-91.8	-16.3	-177.5	-68.7	169.7	0	0	0	111.6	L131 S134	L131-I136 PolarHBondContact O-N 2.98Å; S134-I136 PolarHBondContact O-N 3.33Å
137	L	37.2	Very low	40.7	Very low	85 Å²	85	121.8 Å²	121.8	45%	0.445	65%	0.649	S	S	.	*			trans	-126.8	106.3	174.4	-65.8	175.5	0	0	0	110.2	L131 Q132 P139	L131-L137 HydrophobicContact CB-CD1 3.93Å; L131-L137 HydrophobicContact CB-CG 4.48Å; L131-L137 HydrophobicContact CD1-CD1 4.5Å; Q132-L137 HydrophobicContact CG-CB 4.38Å; L137-P139 WeakPolarHBondContact O-CD 3.36Å
138	D	32.2	Very low	40.2	Very low	163 Å²	163	123.8 Å²	123.8	87%	0.872	66%	0.661	S	S	*	*			trans	-97.9	113.8	172.7	-173.7	13.2	0	0	0	110.3
139	P	32.3	Very low	38.3	Very low	80 Å²	80	124.5 Å²	124.5	52%	0.519	67%	0.673	S	S	.	*			trans	-118.9	86.8	-168	39.1	-25.6	0	0	0	114.4	L137	L137-P139 WeakPolarHBondContact O-CD 3.36Å
140	Q	31.7	Very low	36.9	Very low	180 Å²	180	125.4 Å²	125.4	84%	0.841	69%	0.687	S	S	*	*			trans	168.5	139.4	130.8	-95.2	168.2	47.9	0	0	112
141	D	27.3	Very low	35.6	Very low	145 Å²	145	129.1 Å²	129.1	78%	0.775	70%	0.701	S	S	*	*				-165.5	114.8	108.3	-133.4	-19	0	0	0	112.6
142	Y	25.2	Very low	34.1	Very low	237 Å²	237	129.9 Å²	129.9	93%	0.929	71%	0.713	S	S	*	*			trans	-170.7	80.1	164.8	-122.1	-69.3	0	0	0	112
143	S	27.6	Very low	33.1	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	73%	0.73	S	S	*	*			trans	-173.6	161.5	137.1	-147	0	0	0	0	115.4
144	T	28.2	Very low	31.9	Very low	138 Å²	138	129.8 Å²	129.8	85%	0.847	72%	0.723	S	S	*	*			trans	72.7	149	161.7	58.6	0	0	0	0	120.4
145	G	27.2	Very low	30.9	Very low	69 Å²	69	130.7 Å²	130.7	71%	0.711	73%	0.734	S	S	*	*			trans	-100.3	-159.5	174.6	0	0	0	0	0	112.3
146	E	24.8	Very low	30	Very low	208 Å²	208	135 Å²	135	97%	0.972	74%	0.741	S	S	*	*			cis	-139	-150	28.2	-60.7	-167.4	93.2	0	0	114.9
147	R	26.9	Very low	28.7	Very low	213 Å²	213	136.2 Å²	136.2	80%	0.804	74%	0.744	S	S	*	*			trans	-106.3	159.5	-164.7	-144.2	-171.8	-164.3	170.3	3.2	111.8
148	P	37.8	Very low	28.2	Very low	118 Å²	118	139.1 Å²	139.1	77%	0.766	76%	0.759	S	S	*	*				-138.8	141.5	99.3	17.2	4.7	0	0	0	113.1
149	S	27.1	Very low	28	Very low	83 Å²	83	138.3 Å²	138.3	58%	0.58	76%	0.755	S	S	*	*				65.3	113.1	72.9	-54	0	0	0	0	112.1
150	L	28.4	Very low	27.7	Very low	162 Å²	162	139.2 Å²	139.2	85%	0.848	76%	0.763	S	S	*	*				-162.6	177.3	66.1	-80.6	170.8	0	0	0	110.4
151	L	28.3	Very low	27.5	Very low	141 Å²	141	140.2 Å²	140.2	74%	0.738	77%	0.765	S	S	*	*			cis	-159.6	162.5	18.4	-137.2	175.8	0	0	0	110.8
152	S	25.7	Very low	28.6	Very low	90 Å²	90	138.9 Å²	138.9	63%	0.629	76%	0.763	S	S	*	*			trans	68.4	143.6	160.7	-81.9	0	0	0	0	121.5
153	Q	29.6	Very low	28.7	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	76%	0.761	S	S	*	*			cis	-164.8	156.5	-25.2	-133.4	-174.5	63.9	0	0	113.1
154	S	28	Very low	28.7	Very low	95 Å²	95	135.3 Å²	135.3	66%	0.664	76%	0.763	S	S	*	*			trans	74.2	110.6	144.6	-64.5	0	0	0	0	123
155	A	27.1	Very low	28.7	Very low	87 Å²	87	134.1 Å²	134.1	72%	0.719	76%	0.761	S	S	*	*				125.7	118.2	111.5	0	0	0	0	0	119.2
156	L	25.5	Very low	28.7	Very low	156 Å²	156	139.9 Å²	139.9	82%	0.817	77%	0.766	S	S	*	*			trans	64	156.1	146.8	-59.3	169.8	0	0	0	119.7
157	Q	25.6	Very low	28.6	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	76%	0.761	S	S	*	*			cis	-169.4	154.9	-36.7	-155.1	178.8	35.2	0	0	108.3
158	L	26.7	Very low	28.4	Very low	146 Å²	146	138.9 Å²	138.9	76%	0.764	76%	0.763	S	S	*	*			trans	67.4	148.6	174	-44	170.1	0	0	0	113.6
159	N	26.6	Very low	28.6	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	76%	0.76	S	S	*	*			cis	-153.5	-171.2	-7.6	-136.6	-11.9	0	0	0	107.1
160	S	27.2	Very low	28.5	Very low	99 Å²	99	139 Å²	139	69%	0.692	77%	0.77	S	S	*	*			cis	-161.5	168.9	2.6	33.5	0	0	0	0	111.1
161	K	27.6	Very low	28.3	Very low	202 Å²	202	135.7 Å²	135.7	88%	0.878	76%	0.76	S	S	*	*			trans	-143.7	-168	165	-101.9	-173.3	-178.7	-176.6	0	106.3
162	P	50	Low	28.2	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	76%	0.761	S	S	*	*			cis	-113.8	-155.3	-5.4	37.5	-16.9	0	0	0	109.8
163	E	26.7	Very low	28.1	Very low	189 Å²	189	141.8 Å²	141.8	88%	0.883	77%	0.768	S	S	*	*			cis	-123.9	-162.9	-1.3	-62.1	-165.7	71.2	0	0	109.3
164	G	28	Very low	27.9	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	77%	0.77	S	S	*	*			cis	-176.5	156	-6.4	0	0	0	0	0	108.2
165	S	27.6	Very low	27.8	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	78%	0.775	S	S	*	*			cis	-147.7	178.8	5.1	57.8	0	0	0	0	111.4
166	F	27.3	Very low	27.8	Very low	190 Å²	190	146 Å²	146	83%	0.833	78%	0.78	S	S	*	*			trans	-55.9	168.1	178.7	-61.6	-93.5	0	0	0	114.4
167	Q	22.9	Very low	27.9	Very low	182 Å²	182	143.9 Å²	143.9	85%	0.85	77%	0.773	S	S	*	*			cis	-160.2	166.6	30.7	-150.5	149.2	-10.6	0	0	115.2
168	Y	22.5	Very low	28.1	Very low	219 Å²	219	144.6 Å²	144.6	86%	0.859	78%	0.781	S	S	*	*			trans	-89.9	-171.6	174.9	-103.7	-100.2	0	0	0	111.5
169	P	42.9	Very low	28.2	Very low	107 Å²	107	141.2 Å²	141.2	70%	0.695	77%	0.774	S	S	*	*			cis	-139	-176.1	-7.1	37.4	-16.9	0	0	0	117.2
170	A	24.9	Very low	28.4	Very low	96 Å²	96	142.7 Å²	142.7	79%	0.793	78%	0.781	S	S	*	*			trans	63.9	177	140.4	0	0	0	0	0	121
171	S	23.5	Very low	28.3	Very low	92 Å²	92	141.2 Å²	141.2	64%	0.643	78%	0.781	S	S	*	*			cis	-170.3	164.3	-49.9	-165.7	0	0	0	0	110.7
172	Y	25.4	Very low	28.3	Very low	193 Å²	193	140.8 Å²	140.8	76%	0.757	78%	0.782	S	S	*	*			trans	66.3	123	156.6	-72.7	-58.1	0	0	0	124
173	H	25.3	Very low	27.3	Very low	166 Å²	166	140.7 Å²	140.7	77%	0.769	78%	0.784	S	S	*	*				61.4	156.5	129.4	-69.6	-31.3	0	0	0	124.8
174	S	24.3	Very low	27.6	Very low	117 Å²	117	138 Å²	138	82%	0.818	78%	0.782	S	S	*	*			trans	91.1	150.4	150.2	-164	0	0	0	0	118.3
175	N	26.3	Very low	28.1	Very low	144 Å²	144	141 Å²	141	77%	0.77	79%	0.788	S	S	*	*			cis	-176.9	176.3	-44.2	-140.5	-25.8	0	0	0	107.7
176	Q	27.9	Very low	28.1	Very low	174 Å²	174	140.7 Å²	140.7	81%	0.813	79%	0.786	S	S	*	*			trans	70	161.4	165.3	-62.8	-171.5	8.6	0	0	118.8
177	T	26.9	Very low	28.1	Very low	110 Å²	110	140 Å²	140	68%	0.675	79%	0.786	S	S	*	*			cis	-171.6	166.8	-29.1	-79.7	0	0	0	0	108.1
178	L	29.1	Very low	28.4	Very low	167 Å²	167	139.1 Å²	139.1	87%	0.874	79%	0.786	S	S	*	*			trans	104.7	149.8	162.9	-57.5	171.1	0	0	0	116.8
179	A	29.5	Very low	29.7	Very low	74 Å²	74	134.3 Å²	134.3	61%	0.612	78%	0.781	S	S	*	*				-177.8	142.2	-56.3	0	0	0	0	0	111.5
180	L	30.1	Very low	29.1	Very low	177 Å²	177	133.6 Å²	133.6	93%	0.927	78%	0.784	S	S	*	*			trans	64.6	152.1	164.3	-63	155.3	0	0	0	117
181	G	26.2	Very low	29.2	Very low	68 Å²	68	141 Å²	141	70%	0.701	79%	0.792	S	S	*	*			cis	-165.4	-169.7	1.7	0	0	0	0	0	113.6
182	E	27.6	Very low	29.4	Very low	193 Å²	193	139.7 Å²	139.7	90%	0.902	79%	0.792	S	S	*	*			trans	-78.6	-174.8	-169	-48.2	154.4	108.1	0	0	113.3
183	S	28.7	Very low	29.4	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	80%	0.795	S	S	*	*			cis	-162.1	175.5	14.7	55.4	0	0	0	0	112.8
184	T	32.6	Very low	29.5	Very low	134 Å²	134	138.4 Å²	138.4	82%	0.822	80%	0.803	S	S	*	*			trans	-91.2	154.6	174.7	51.2	0	0	0	0	114.3
185	P	38	Very low	29.7	Very low	130 Å²	130	137.4 Å²	137.4	84%	0.844	80%	0.801	S	S	*	*				-146.3	-168	126.6	38.7	-22.3	0	0	0	115.4
186	S	28.9	Very low	29.8	Very low	108 Å²	108	142 Å²	142	76%	0.755	81%	0.808	S	S	*	*			trans	-120.1	160.4	-158.2	-50.9	0	0	0	0	117
187	Q	27.6	Very low	30	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.822	81%	0.806	S	S	*	*			trans	62.4	115.4	150	-72.1	178.7	-0.8	0	0	123.4
188	L	29.1	Very low	30.2	Very low	162 Å²	162	137.6 Å²	137.6	85%	0.848	81%	0.813	S	S	*	*			trans	57.2	172.7	130.8	-70.9	171.1	0	0	0	120.4
189	P	49.2	Very low	30.3	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	80%	0.804	S	S	*	*			cis	-131.4	-173.9	3	43.5	-26.3	0	0	0	117.6
190	A	29.7	Very low	30.3	Very low	92 Å²	92	138.3 Å²	138.3	76%	0.76	82%	0.817	S	S	*	*			trans	-25.8	158.6	172.3	0	0	0	0	0	120.1
191	R	27.8	Very low	30.2	Very low	253 Å²	253	133.7 Å²	133.7	96%	0.955	80%	0.799	S	S	*	*				175.6	140.5	65.6	-178.4	-175.2	-165.3	174.6	4.3	112.1
192	G	26.3	Very low	30.2	Very low	63 Å²	63	139.2 Å²	139.2	65%	0.649	80%	0.804	S	S	*	*			trans	158.2	102.3	162.2	0	0	0	0	0	121.3
193	T	27.3	Very low	30.2	Very low	132 Å²	132	134 Å²	134	81%	0.81	79%	0.789	S	S	*	*			trans	50.5	120.7	141.8	48.7	0	0	0	0	125.4
194	Q	27.1	Very low	30.1	Very low	200 Å²	200	137.8 Å²	137.8	94%	0.935	79%	0.794	S	S	*	*			trans	78.8	152.1	132.6	-69.8	-169.3	-5.7	0	0	122.2
195	A	28.9	Very low	29.9	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	79%	0.785	S	S	*	*			trans	-146.2	161.6	-160.2	0	0	0	0	0	113
196	R	27.5	Very low	29.3	Very low	241 Å²	241	134.3 Å²	134.3	91%	0.909	78%	0.783	S	S	*	*			trans	-155.9	130	146	-96.7	-174.8	161.6	127.5	-4.1	106.4
197	A	31.6	Very low	29.2	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	79%	0.787	S	S	*	*				70.1	133.4	62.7	0	0	0	0	0	112.2
198	A	31.7	Very low	29.3	Very low	99 Å²	99	133.2 Å²	133.2	82%	0.818	79%	0.789	S	S	*	*			cis	-161	167.8	-3.4	0	0	0	0	0	109.3
199	G	30.6	Very low	29.2	Very low	66 Å²	66	137.7 Å²	137.7	68%	0.68	79%	0.794	S	S	*	*			cis	148.9	178.8	-6.9	0	0	0	0	0	112.9
200	Q	30	Very low	28.2	Very low	190 Å²	190	136.9 Å²	136.9	89%	0.888	80%	0.798	S	S	*	*			trans	75.1	142.4	165	-62.4	-171.7	13.8	0	0	117.4
201	S	28.4	Very low	28	Very low	80 Å²	80	136.3 Å²	136.3	56%	0.559	80%	0.8	S	S	*	*			cis	-161.2	154.7	0.6	-115.4	0	0	0	0	115.4
202	F	26.2	Very low	28	Very low	184 Å²	184	132.5 Å²	132.5	81%	0.807	79%	0.793	S	S	*	*			trans	41.3	126.5	161.1	-68.7	-85.9	0	0	0	121.1
203	S	27.2	Very low	28	Very low	83 Å²	83	137.1 Å²	137.1	58%	0.58	80%	0.802	S	S	*	*			cis	87.7	119.1	8.1	95	0	0	0	0	120.3
204	Q	27.4	Very low	28.2	Very low	194 Å²	194	135.2 Å²	135.2	91%	0.907	80%	0.8	S	S	*	*			trans	62.4	155.9	149.8	-64.1	175	-16.2	0	0	119.1
205	G	26.4	Very low	28.3	Very low	61 Å²	61	129.3 Å²	129.3	63%	0.629	79%	0.792	S	S	*	*			cis	158.8	171.5	-10.2	0	0	0	0	0	114.4
206	T	26.2	Very low	29.5	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	80%	0.797	S	S	*	*			trans	71.8	155.6	156	76.1	0	0	0	0	123
207	T	27.7	Very low	29.9	Very low	139 Å²	139	128.2 Å²	128.2	85%	0.853	79%	0.793	S	S	*	*			trans	80.7	141.7	160.5	59.2	0	0	0	0	121.8
208	S	28.8	Very low	30.8	Very low	122 Å²	122	129.6 Å²	129.6	85%	0.853	79%	0.794	S	S	*	*			trans	-99.4	177.5	-171.1	-26.5	0	0	0	0	113.3
209	R	28.1	Very low	31.1	Very low	256 Å²	256	129.2 Å²	129.2	97%	0.966	79%	0.791	S	S	*	*			trans	125.5	150.2	142.7	-154	171.9	-161	173.6	4.3	113.8
210	A	27	Very low	32.3	Very low	102 Å²	102	131.9 Å²	131.9	84%	0.843	80%	0.797	S	S	*	*			trans	-98.5	159.8	-167.9	0	0	0	0	0	114.1
211	G	25.8	Very low	33.6	Very low	79 Å²	79	128.7 Å²	128.7	81%	0.814	79%	0.792	S	S	*	*			trans	-173.4	136.6	173	0	0	0	0	0	113.3
212	H	27.4	Very low	35.4	Very low	173 Å²	173	130.1 Å²	130.1	80%	0.801	80%	0.799	S	S	*	*			trans	-96.1	151.4	-172.8	-84.1	-108.8	0	0	0	114.3
213	L	27.6	Very low	36.7	Very low	160 Å²	160	127.3 Å²	127.3	84%	0.838	80%	0.8	S	S	*	*			trans	63.1	155	141.5	-65.4	167.4	0	0	0	119.4
214	A	29.6	Very low	38	Very low	93 Å²	93	129 Å²	129	77%	0.769	81%	0.809	S	S	*	*			cis	-168.9	163.8	-12.3	0	0	0	0	0	114.1
215	G	29.6	Very low	39.9	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	80%	0.803	S	S	*	*			trans	89.3	165.7	151.5	0	0	0	0	0	119.2
216	P	54.3	Low	41.4	Very low	136 Å²	136	128.2 Å²	128.2	88%	0.883	81%	0.81	S	S	*	*			cis	-132.3	-167.7	-6.4	41.1	-22	0	0	0	116.7
217	E	36.6	Very low	41.8	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	82%	0.817	S	S	*	*			trans	-62	-175.7	-175.5	-99.3	-167.2	106	0	0	120.1
218	P	50.4	Low	42	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	81%	0.81	S	S	*	*			cis	-135.3	-161.4	1.7	27.1	0.1	0	0	0	117.5
219	A	38.7	Very low	42.9	Very low	92 Å²	92	134.1 Å²	134.1	76%	0.76	80%	0.804	S	S	*	*			trans	-107.2	-159.5	-172.8	0	0	0	0	0	115.4
220	P	54.7	Low	42.9	Very low	122 Å²	122	130.6 Å²	130.6	79%	0.792	80%	0.796	S	S	*	*			cis	-135	-132.6	-1.8	32.7	-3.4	0	0	0	117
221	P	58.6	Low	43	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	79%	0.79	S	S	*	*				-122.9	-138.4	-98.7	47	-28.6	0	0	0	119.8
222	P	66.4	Low	44.1	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	79%	0.79	S	S	*	*			trans	-120.8	177.9	-133.5	42.1	-21.8	0	0	0	119
223	P	52.6	Low	44	Very low	126 Å²	126	128.8 Å²	128.8	82%	0.818	79%	0.786	S	S	*	*				-152.6	-134.4	121.6	34.9	-8.8	0	0	0	118.8
224	P	54.8	Low	44	Very low	118 Å²	118	129.3 Å²	129.3	77%	0.766	79%	0.789	S	S	*	*				-130.9	-172.4	-110.8	45.2	-25.2	0	0	0	119
225	P	66.6	Low	43.9	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	79%	0.793	S	S	*	*			trans	-124.9	176.6	-165	44.8	-34.4	0	0	0	119.8
226	P	57.4	Low	43.7	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	80%	0.795	S	S	*	*			trans	-126.2	-179.5	159.4	41.6	-29.3	0	0	0	113.5
227	R	35	Very low	42.3	Very low	252 Å²	252	128.1 Å²	128.1	95%	0.951	78%	0.784	S	S	*	*			cis	-166.1	176.3	-31.9	-101.2	-171.1	173.6	-158.4	-2.7	109.9
228	E	32.8	Very low	41.8	Very low	152 Å²	152	128.8 Å²	128.8	71%	0.71	79%	0.785	S	S	*	*			trans	-122.9	169.2	177.3	-151.3	-157.2	-94.5	0	0	111.6	F230	E228-F230 PolarHBondContact OE2-N 3.43Å
229	P	47.3	Very low	40.6	Very low	109 Å²	109	131.3 Å²	131.3	71%	0.708	79%	0.786	S	S	*	*				-154.2	145.2	92.8	38.4	-18.8	0	0	0	119.4
230	F	27.9	Very low	40.2	Very low	183 Å²	183	134.1 Å²	134.1	80%	0.803	79%	0.787	S	S	*	*			trans	53.9	127.2	141.6	-71.6	-116.3	0	0	0	120.2	E228	E228-F230 PolarHBondContact OE2-N 3.43Å
231	A	29.5	Very low	39.5	Very low	87 Å²	87	133.2 Å²	133.2	72%	0.719	78%	0.781	S	S	*	*			cis	104.1	178.6	31.2	0	0	0	0	0	113.4
232	P	48.1	Very low	38	Very low	126 Å²	126	135 Å²	135	82%	0.818	78%	0.784	S	S	*	*				-129.3	-176.2	-115.8	36	-14.7	0	0	0	115.5
233	S	25.4	Very low	36.3	Very low	103 Å²	103	134 Å²	134	72%	0.72	79%	0.786	S	S	*	*			trans	-164	123.2	153.9	-167.9	0	0	0	0	115.6
234	L	27	Very low	36	Very low	170 Å²	170	133.6 Å²	133.6	89%	0.89	78%	0.782	S	S	*	*			trans	24.5	141.4	134	-48.6	172.4	0	0	0	121.4
235	G	28.1	Very low	35.7	Very low	83 Å²	83	133 Å²	133	86%	0.856	78%	0.779	S	S	*	*			trans	-177.9	41.5	171.2	0	0	0	0	0	116
236	S	25.1	Very low	33.8	Very low	117 Å²	117	134.1 Å²	134.1	82%	0.818	78%	0.783	S	S	*	*			trans	-82.9	162.1	-180	51.7	0	0	0	0	113.9
237	A	25.4	Very low	32.4	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	79%	0.788	S	S	*	*			trans	85.5	106.5	152.3	0	0	0	0	0	120.9
238	F	26	Very low	32.1	Very low	193 Å²	193	126.1 Å²	126.1	85%	0.846	78%	0.781	S	S	*	*				67	158.2	121.9	-76.8	-80.7	0	0	0	123.1
239	H	26.1	Very low	31.9	Very low	173 Å²	173	123.6 Å²	123.6	80%	0.801	79%	0.786	S	S	*	*			trans	85.7	104.9	158.7	-83.7	-71.6	0	0	0	121.4
240	L	29.6	Very low	31	Very low	152 Å²	152	123.1 Å²	123.1	80%	0.796	79%	0.792	S	S	*	*			trans	-34.7	158.5	132.9	-97	80.8	0	0	0	113.5
241	P	40.8	Very low	31	Very low	102 Å²	102	119.1 Å²	119.1	66%	0.662	79%	0.792	S	S	*	*			cis	-151.8	-172.2	47.6	45	-25.2	0	0	0	118.8
242	D	26.1	Very low	31	Very low	160 Å²	160	119.2 Å²	119.2	86%	0.856	79%	0.793	S	S	*	*			trans	74.7	162.2	151	-66.9	-35.5	0	0	0	120.9
243	A	30.8	Very low	30.1	Very low	90 Å²	90	120.4 Å²	120.4	74%	0.744	79%	0.792	S	S	*	*			trans	-127.4	-126.8	-159.4	0	0	0	0	0	114
244	P	46.9	Very low	30.3	Very low	116 Å²	116	125.1 Å²	125.1	75%	0.753	80%	0.795	S	S	*	*			trans	-102.1	-163.8	-132.8	44.9	-31.7	0	0	0	111.3
245	P	47.8	Very low	30.3	Very low	107 Å²	107	127.6 Å²	127.6	70%	0.695	79%	0.794	S	S	*	*			cis	-142.3	-153.5	5.1	37.9	-13.9	0	0	0	114.7
246	T	27	Very low	30.2	Very low	143 Å²	143	128.3 Å²	128.3	88%	0.877	79%	0.787	S	S	*	*			trans	105.8	155.7	158.7	72.7	0	0	0	0	118.4
247	A	28.2	Very low	30.2	Very low	105 Å²	105	127.8 Å²	127.8	87%	0.868	78%	0.783	S	S	*	*			trans	-130.7	151.4	-150.1	0	0	0	0	0	114.7
248	A	28.4	Very low	30.3	Very low	98 Å²	98	129.1 Å²	129.1	81%	0.81	79%	0.787	S	S	*	*			trans	-161.3	125	156.9	0	0	0	0	0	107
249	A	28.4	Very low	30.5	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	78%	0.783	S	S	*	*				92.2	94.8	55.1	0	0	0	0	0	114.3
250	A	28.7	Very low	30.5	Very low	100 Å²	100	124.6 Å²	124.6	83%	0.826	78%	0.782	S	S	*	*			trans	67.1	132.6	141.9	0	0	0	0	0	124
251	A	28.5	Very low	31	Very low	98 Å²	98	123.1 Å²	123.1	81%	0.81	78%	0.781	S	S	*	*			trans	90.7	126.5	132.5	0	0	0	0	0	123.8
252	A	29	Very low	30.5	Very low	90 Å²	90	121.9 Å²	121.9	74%	0.744	78%	0.78	S	S	*	*			trans	68.8	94.6	131.4	0	0	0	0	0	123.1
253	L	29	Very low	31.5	Very low	150 Å²	150	120 Å²	120	79%	0.785	78%	0.776	S	S	*	*				47.2	125.3	114.5	-67	177.5	0	0	0	123.1
254	Y	29.5	Very low	32.4	Very low	202 Å²	202	120.7 Å²	120.7	79%	0.792	77%	0.773	S	S	*	*			trans	90.9	129.4	138.8	-84.1	-56.9	0	0	0	123.4
255	Y	27.2	Very low	31.5	Very low	222 Å²	222	126.8 Å²	126.8	87%	0.871	78%	0.781	S	S	*	*			trans	81.9	153	162.6	-94.8	-82.4	0	0	0	119.7
256	S	26	Very low	30.5	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	79%	0.787	S	S	*	*			trans	-122.9	156.5	-149.7	-20.7	0	0	0	0	114
257	S	26	Very low	30.4	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	79%	0.786	S	S	*	*				157.5	164.7	126.1	-69.8	0	0	0	0	113.6
258	S	27.6	Very low	30.5	Very low	108 Å²	108	122.4 Å²	122.4	76%	0.755	78%	0.778	S	S	*	*			trans	78.3	149.6	158.2	-54.6	0	0	0	0	117.4
259	T	28.3	Very low	31.3	Very low	124 Å²	124	123 Å²	123	76%	0.761	77%	0.774	S	S	*	*			cis	-160.1	150.8	-1.9	4.1	0	0	0	0	114.6
260	L	28	Very low	31.5	Very low	146 Å²	146	124 Å²	124	76%	0.764	77%	0.765	S	S	*	*			trans	8.2	150.9	139	-71.1	174.7	0	0	0	122.3
261	P	39.8	Very low	31.6	Very low	121 Å²	121	121.3 Å²	121.3	79%	0.786	74%	0.743	S	S	*	*				-129.5	159.9	67.6	37.3	-23.4	0	0	0	115
262	A	29	Very low	31.6	Very low	77 Å²	77	119.9 Å²	119.9	64%	0.636	73%	0.731	S	S	*	*			cis	84.8	146.3	24.5	0	0	0	0	0	115.7
263	P	47.8	Very low	32.3	Very low	120 Å²	120	119.7 Å²	119.7	78%	0.779	72%	0.722	S	S	*	*			cis	-132.2	-149.3	-9.1	45.3	-27.8	0	0	0	111.7
264	P	49.3	Very low	32.4	Very low	105 Å²	105	122 Å²	122	68%	0.682	73%	0.729	S	S	*	*			cis	-117.5	-160.2	-34.1	37.3	-18.2	0	0	0	110.9
265	R	28.7	Very low	32.3	Very low	243 Å²	243	116.1 Å²	116.1	92%	0.917	73%	0.73	S	S	*	*			cis	-118.2	-139.3	-5.2	-59	-179.3	160.8	128.9	-2.6	108.4
266	G	26.6	Very low	32.2	Very low	79 Å²	79	109.5 Å²	109.5	81%	0.814	73%	0.729	S	S	*	*			cis	110.4	129.1	-0.8	0	0	0	0	0	114.3
267	G	25.6	Very low	32.4	Very low	83 Å²	83	110.4 Å²	110.4	86%	0.856	74%	0.735	S	S	*	*			cis	-157.4	-176.8	1	0	0	0	0	0	114.6
268	S	29.5	Very low	33.4	Very low	102 Å²	102	110.4 Å²	110.4	71%	0.713	73%	0.733	S	S	*	*			trans	-145.6	160	-169.3	-174.4	0	0	0	0	112.9
269	P	45.1	Very low	33.5	Very low	110 Å²	110	111.3 Å²	111.3	71%	0.714	73%	0.734	S	S	*	*				-136.8	165.1	101.1	19.4	3.6	0	0	0	112.8
270	L	31.9	Very low	33.5	Very low	118 Å²	118	114 Å²	114	62%	0.618	74%	0.735	S	S	*	*			cis	78.7	140.6	35.5	-57.8	173.4	0	0	0	115.1	L12	L12-L270 CarbonylContact C-O 3.55Å
271	A	30.6	Very low	33.5	Very low	44 Å²	44	113.7 Å²	113.7	36%	0.364	73%	0.734	S	S	.	*			cis	-169.9	-149.8	-21.7	0	0	0	0	0	110.1	L12 G13	L12-A271 CarbonylContact C-O 3.59Å; L12-A271 VanDerWaalsContact CA-O 3.28Å; L12-A271 WeakPolarHBondContact CA-O 3.23Å; G13-A271 PolarHBondContact N-O 3.19Å
272	A	29.7	Very low	32.8	Very low	69 Å²	69	116.4 Å²	116.4	57%	0.57	74%	0.736	S	S	*	*			trans	-142.6	161.6	-174.9	0	0	0	0	0	114.2
273	P	43.6	Very low	32.8	Very low	86 Å²	86	124.2 Å²	124.2	56%	0.558	75%	0.749	S	S	*	*				-160.4	-174.1	116.7	40.4	-19.4	0	0	0	118.8
274	Q	30.7	Very low	31.7	Very low	197 Å²	197	122.2 Å²	122.2	92%	0.921	75%	0.75	S	S	*	*			trans	79.6	147	171	-54.4	-167.8	37.5	0	0	118.6
275	G	27.8	Very low	30.5	Very low	80 Å²	80	120.6 Å²	120.6	83%	0.825	75%	0.752	S	S	*	*			cis	169.2	156.5	-9	0	0	0	0	0	112.8
276	G	25	Very low	30.5	Very low	82 Å²	82	115.4 Å²	115.4	85%	0.845	75%	0.753	S	S	*	*			trans	151.8	163.6	171	0	0	0	0	0	119.6
277	S	30.8	Very low	30.9	Very low	118 Å²	118	115.9 Å²	115.9	83%	0.825	75%	0.75	S	S	*	*			trans	-155.6	166.3	175.1	-93	0	0	0	0	107.4
278	P	45.4	Very low	31.8	Very low	106 Å²	106	117.9 Å²	117.9	69%	0.688	75%	0.748	S	S	*	*			cis	-158.7	-166.3	44.6	44.2	-20.8	0	0	0	118.6
279	T	30.1	Very low	31.9	Very low	128 Å²	128	122.3 Å²	122.3	79%	0.785	76%	0.757	S	S	*	*			trans	65.6	159.8	154.3	50	0	0	0	0	121
280	K	29.1	Very low	31	Very low	179 Å²	179	120.3 Å²	120.3	78%	0.778	76%	0.756	S	S	*	*			cis	-174.9	167.6	-33.8	-163	175.9	-177.4	-177.5	0	108.4
281	L	27.5	Very low	30.9	Very low	140 Å²	140	119.4 Å²	119.4	73%	0.733	77%	0.765	S	S	*	*			trans	77.5	146.3	168.7	-54.8	176.2	0	0	0	115.7
282	Q	25.3	Very low	30.6	Very low	178 Å²	178	122.4 Å²	122.4	83%	0.832	78%	0.78	S	S	*	*			cis	-147.1	-173.8	-14.7	-154.6	152.7	-22.1	0	0	111.1
283	R	28.4	Very low	30.5	Very low	242 Å²	242	129.9 Å²	129.9	91%	0.913	80%	0.795	S	S	*	*			trans	-135.4	144	-168.5	165.7	-167.2	-81.1	-155.9	-3.7	112.8
284	G	25.1	Very low	29.6	Very low	78 Å²	78	130.3 Å²	130.3	80%	0.804	81%	0.806	S	S	*	*			trans	111	153.6	159.2	0	0	0	0	0	114.5
285	G	25.1	Very low	29.4	Very low	70 Å²	70	125.4 Å²	125.4	72%	0.722	80%	0.799	S	S	*	*			cis	165.6	165	-7	0	0	0	0	0	113.4
286	S	28.4	Very low	29.7	Very low	135 Å²	135	127.7 Å²	127.7	94%	0.944	80%	0.799	S	S	*	*			trans	72.6	151.7	167.3	-54.8	0	0	0	0	119.9
287	A	34	Very low	29.7	Very low	89 Å²	89	135.5 Å²	135.5	74%	0.736	80%	0.803	S	S	*	*			trans	-106.6	169.4	161.8	0	0	0	0	0	109.8
288	P	44.6	Very low	29.4	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	80%	0.8	S	S	*	*				-148.6	-167.5	114.4	39.6	-22.3	0	0	0	116
289	E	30.7	Very low	28.5	Very low	195 Å²	195	134.3 Å²	134.3	91%	0.911	81%	0.809	S	S	*	*			trans	-63.5	171.2	-174.5	-58.1	155.2	141.5	0	0	115.5
290	G	27.9	Very low	28.4	Very low	67 Å²	67	133.4 Å²	133.4	69%	0.691	81%	0.807	S	S	*	*			cis	163.6	177.8	-2.9	0	0	0	0	0	113.1
291	A	28.4	Very low	28.8	Very low	99 Å²	99	130.1 Å²	130.1	82%	0.818	80%	0.804	S	S	*	*			trans	64.7	152.9	175	0	0	0	0	0	117.1
292	T	24.9	Very low	28.7	Very low	108 Å²	108	131.8 Å²	131.8	66%	0.663	81%	0.806	S	S	*	*			cis	-159.7	154.4	-10.4	12.2	0	0	0	0	108.7
293	Y	28.3	Very low	28.7	Very low	225 Å²	225	130.6 Å²	130.6	88%	0.882	80%	0.8	S	S	*	*				166.7	172.9	117.7	-92	-66.7	0	0	0	113.5
294	A	24.9	Very low	28.5	Very low	96 Å²	96	123.5 Å²	123.5	79%	0.793	79%	0.788	S	S	*	*			trans	-84.6	169.5	-160	0	0	0	0	0	116.9
295	A	26	Very low	29	Very low	93 Å²	93	126.1 Å²	126.1	77%	0.769	79%	0.79	S	S	*	*			trans	-84.5	171.3	169.8	0	0	0	0	0	112.6
296	P	34.2	Very low	29.1	Very low	128 Å²	128	127.2 Å²	127.2	83%	0.831	79%	0.787	S	S	*	*				-147.7	-178.4	98.7	40.5	-24.7	0	0	0	117.1
297	R	25.1	Very low	29.2	Very low	247 Å²	247	131.6 Å²	131.6	93%	0.932	78%	0.783	S	S	*	*			trans	-52.1	152	173.8	-55	161.1	178.3	175.7	-3	112.7
298	G	24.9	Very low	28.8	Very low	74 Å²	74	135.2 Å²	135.2	76%	0.763	79%	0.789	S	S	*	*				118.9	168.6	73	0	0	0	0	0	109.3
299	S	25.9	Very low	27.9	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	79%	0.789	S	S	*	*			cis	-162.4	173.7	-1.6	50.2	0	0	0	0	111.1
300	S	27.6	Very low	27.7	Very low	108 Å²	108	134.3 Å²	134.3	76%	0.755	79%	0.788	S	S	*	*			trans	-66.4	-179.2	-175.8	-40.5	0	0	0	0	116.2
301	P	38.1	Very low	27.6	Very low	110 Å²	110	136.4 Å²	136.4	71%	0.714	79%	0.792	S	S	*	*				-142.9	138.2	105.4	30.3	-12.9	0	0	0	117.7
302	K	25.3	Very low	27.4	Very low	175 Å²	175	142.8 Å²	142.8	76%	0.761	80%	0.796	S	S	*	*			trans	69	150.6	134	-62.7	175	167.9	-169.9	0	120.2
303	Q	24.8	Very low	27.4	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	80%	0.803	S	S	*	*			cis	-155.1	157.4	-14.4	-121.1	168.2	-64	0	0	114
304	S	25.1	Very low	27.4	Very low	93 Å²	93	139.3 Å²	139.3	65%	0.65	80%	0.803	S	S	*	*			trans	-42.1	159.1	164.6	57.3	0	0	0	0	117.8
305	P	35.3	Very low	27.4	Very low	133 Å²	133	140.2 Å²	140.2	86%	0.864	80%	0.804	S	S	*	*				-136.9	-163.9	76	38.2	-21.8	0	0	0	115.9
306	S	27.5	Very low	27.7	Very low	94 Å²	94	141 Å²	141	66%	0.657	80%	0.804	S	S	*	*			trans	-163.5	157.8	-155.1	66.2	0	0	0	0	116.4
307	R	28.8	Very low	27.6	Very low	227 Å²	227	140.8 Å²	140.8	86%	0.857	80%	0.802	S	S	*	*			trans	71.3	153	171.3	-50	172.4	-176.2	-114.3	1.8	113.1
308	L	27	Very low	27.8	Very low	164 Å²	164	135.9 Å²	135.9	86%	0.859	79%	0.793	S	S	*	*			cis	-141.9	168.4	25	-98.5	96.6	0	0	0	112.5
309	A	24.3	Very low	28.4	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	79%	0.791	S	S	*	*			trans	-148.1	134.4	153.3	0	0	0	0	0	111.6
310	K	27	Very low	28.6	Very low	204 Å²	204	139.4 Å²	139.4	89%	0.887	78%	0.784	S	S	*	*			trans	-143.9	143.5	160.9	-96.4	-170.8	175.9	-177.8	0	107.9
311	S	26.4	Very low	28.5	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	79%	0.785	S	S	*	*			trans	-79.2	151.5	-166.5	-39.9	0	0	0	0	114.2
312	Y	24.2	Very low	28	Very low	232 Å²	232	141.4 Å²	141.4	91%	0.91	79%	0.789	S	S	*	*			trans	-133.1	163.9	145.5	-87.4	-66.7	0	0	0	110.7
313	S	25.3	Very low	27.9	Very low	116 Å²	116	138.3 Å²	138.3	81%	0.811	79%	0.789	S	S	*	*			trans	-69.4	151.3	-163.4	-46.3	0	0	0	0	114.7
314	T	27	Very low	28.1	Very low	144 Å²	144	136.7 Å²	136.7	88%	0.883	80%	0.795	S	S	*	*			trans	-117.4	136.6	161.4	45.7	0	0	0	0	110.8
315	S	26.3	Very low	28.2	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-99.8	153.7	178.2	45.7	0	0	0	0	111.5
316	S	31.1	Very low	27.9	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-90.1	138.2	171.3	-48.3	0	0	0	0	111.3
317	P	33.4	Very low	28.1	Very low	124 Å²	124	137.6 Å²	137.6	81%	0.805	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-97.1	151.7	165.3	35.9	-31.2	0	0	0	112.3
318	I	29	Very low	28.1	Very low	144 Å²	144	132 Å²	132	74%	0.738	80%	0.804	S	S	*	*			trans	-146.7	132.3	173.9	-64.2	179.9	0	0	0	109.6
319	N	37	Very low	29.3	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	80%	0.796	S	S	*	*			trans	150.7	124.2	147.5	-82.3	-36.4	0	0	0	110
320	I	29.8	Very low	29.4	Very low	140 Å²	140	132.9 Å²	132.9	72%	0.718	80%	0.8	S	S	*	*				76.9	122.2	69.7	-68.8	-179.5	0	0	0	113.5
321	V	25.3	Very low	29.3	Very low	130 Å²	130	133.9 Å²	133.9	79%	0.788	80%	0.798	S	S	*	*			trans	-136.3	137.8	148.1	176	0	0	0	0	108.2
322	V	27.2	Very low	29.2	Very low	130 Å²	130	134.5 Å²	134.5	79%	0.788	80%	0.796	S	S	*	*			trans	-130.7	138.7	167.3	163	0	0	0	0	107.2
323	S	25.2	Very low	29.3	Very low	109 Å²	109	130 Å²	130	76%	0.762	79%	0.794	S	S	*	*			trans	-132.1	134.6	179.9	-60.8	0	0	0	0	111.2
324	S	27.8	Very low	29.3	Very low	120 Å²	120	130 Å²	130	84%	0.839	79%	0.793	S	S	*	*			trans	-151.1	134.5	173.6	59	0	0	0	0	111.5
325	A	27.2	Very low	30.7	Very low	109 Å²	109	128.6 Å²	128.6	90%	0.901	79%	0.787	S	S	*	*			trans	-159.1	155.9	175.2	0	0	0	0	0	111.4
326	G	29.4	Very low	31.5	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	78%	0.781	S	S	*	*			trans	-129.9	-175.8	164.6	0	0	0	0	0	109.9
327	L	31.8	Very low	31.3	Very low	162 Å²	162	127.8 Å²	127.8	85%	0.848	78%	0.775	S	S	*	*			cis	-154.5	145.6	14.3	-75.9	166.1	0	0	0	111.2
328	S	28.1	Very low	31.1	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	78%	0.775	S	S	*	*			trans	62.8	169.2	144.6	-65.8	0	0	0	0	120.7
329	P	52.3	Low	31	Very low	109 Å²	109	128.2 Å²	128.2	71%	0.708	77%	0.771	S	S	*	*			cis	-133.8	170.6	-42.5	36.6	-21.3	0	0	0	113.5
330	I	26.2	Very low	30.6	Very low	171 Å²	171	126.7 Å²	126.7	88%	0.877	77%	0.771	S	S	*	*			trans	169.9	158.6	134.1	-89.2	163	0	0	0	113.9
331	R	25.2	Very low	30.4	Very low	225 Å²	225	126 Å²	126	85%	0.849	77%	0.773	S	S	*	*			trans	-69	147.1	-161.5	-73	-179.5	171.3	-163.9	-2.3	120.6
332	V	24.7	Very low	30.5	Very low	123 Å²	123	127.1 Å²	127.1	75%	0.745	77%	0.774	S	S	*	*				69.4	124.5	127.9	174	0	0	0	0	121.3
333	T	25.3	Very low	30.4	Very low	139 Å²	139	125.9 Å²	125.9	85%	0.853	77%	0.771	S	S	*	*				-162.5	140.1	126	7.4	0	0	0	0	112.2
334	S	26.2	Very low	30.4	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	77%	0.772	S	S	*	*			trans	179.8	165.1	178.1	-73	0	0	0	0	108.6
335	P	56.7	Low	30.2	Very low	116 Å²	116	125.6 Å²	125.6	75%	0.753	77%	0.769	S	S	*	*			cis	-111.3	-121	-15	25.2	-0.5	0	0	0	109.5
336	P	42.4	Very low	31.2	Very low	105 Å²	105	125.7 Å²	125.7	68%	0.682	76%	0.76	S	S	*	*			cis	-136.2	149.4	34.1	42.5	-24.2	0	0	0	118.3
337	T	28.3	Very low	31.2	Very low	102 Å²	102	128.9 Å²	128.9	63%	0.626	76%	0.76	S	S	*	*			trans	37.4	139.5	139.2	62.7	0	0	0	0	122
338	V	27.3	Very low	31	Very low	133 Å²	133	128.7 Å²	128.7	81%	0.806	75%	0.754	S	S	*	*				-172.1	162.1	78.9	143.9	0	0	0	0	111.7
339	Q	27.1	Very low	30.8	Very low	144 Å²	144	130.2 Å²	130.2	67%	0.673	75%	0.749	S	S	*	*			cis	-176.8	143.1	-42.6	-162	164.4	-96	0	0	111.4
340	S	29.1	Very low	29.5	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	75%	0.753	S	S	*	*			trans	66	153.9	156.9	58	0	0	0	0	119.5
341	T	26.4	Very low	29.4	Very low	125 Å²	125	129 Å²	129	77%	0.767	75%	0.745	S	S	*	*			cis	-149.6	-177.1	18.3	-21.9	0	0	0	0	108.5
342	I	27.1	Very low	29.6	Very low	155 Å²	155	123.2 Å²	123.2	80%	0.795	74%	0.74	S	S	*	*			cis	-157.2	178.4	6.9	-161.5	158.3	0	0	0	111.8
343	S	25.1	Very low	29.6	Very low	104 Å²	104	123 Å²	123	73%	0.727	74%	0.739	S	S	*	*			trans	-79	-176.7	178.9	-42.8	0	0	0	0	114.1
344	S	24.8	Very low	29.7	Very low	114 Å²	114	124 Å²	124	80%	0.797	74%	0.737	S	S	*	*			cis	-163.1	174.4	24.4	54.9	0	0	0	0	115.5
345	S	24.2	Very low	29.7	Very low	109 Å²	109	122.2 Å²	122.2	76%	0.762	74%	0.737	S	S	*	*			trans	-104.4	-158.3	-179.6	-32.9	0	0	0	0	112.2
346	P	48.8	Very low	28.3	Very low	111 Å²	111	121.7 Å²	121.7	72%	0.721	73%	0.732	S	S	*	*			cis	-142.9	-164.6	-14.6	27.2	0.1	0	0	0	116.8
347	I	27.8	Very low	27.5	Very low	135 Å²	135	124.4 Å²	124.4	69%	0.692	73%	0.729	S	S	*	*			trans	99.7	139.1	148.7	-37.2	-172.4	0	0	0	121
348	H	27.7	Very low	27.4	Very low	158 Å²	158	123.6 Å²	123.6	73%	0.731	73%	0.733	S	S	*	*			trans	93.2	143.9	164.9	-66.3	-78.4	0	0	0	119.1
349	Q	24.3	Very low	27.8	Very low	142 Å²	142	123.4 Å²	123.4	66%	0.664	73%	0.733	S	S	*	*			cis	-172.6	141.1	-39.4	-126.8	-175.5	-19.4	0	0	111
350	L	24.1	Very low	27.6	Very low	152 Å²	152	124.6 Å²	124.6	80%	0.796	74%	0.743	S	S	*	*			trans	63	161.6	158.4	-58.9	167.9	0	0	0	118.3
351	S	25.8	Very low	27.9	Very low	101 Å²	101	125.2 Å²	125.2	71%	0.706	75%	0.747	S	S	*	*			cis	-170.2	175.3	-35.2	-167	0	0	0	0	110.2
352	S	27.5	Very low	28.2	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	75%	0.745	S	S	*	*			trans	70	145.7	169.8	73.5	0	0	0	0	117.7
353	T	25.8	Very low	28.1	Very low	119 Å²	119	123 Å²	123	73%	0.73	74%	0.743	S	S	*	*			cis	-152.3	121.3	-8.2	4.6	0	0	0	0	107.2
354	I	27.1	Very low	28.2	Very low	159 Å²	159	126.6 Å²	126.6	82%	0.815	75%	0.745	S	S	*	*				51.9	120.9	92.1	-57.7	176.4	0	0	0	114.8
355	G	25.4	Very low	28.3	Very low	77 Å²	77	131.8 Å²	131.8	79%	0.794	75%	0.747	S	S	*	*			trans	-171.4	102.3	168.6	0	0	0	0	0	110.9
356	T	27.4	Very low	28.3	Very low	104 Å²	104	133.3 Å²	133.3	64%	0.638	75%	0.746	S	S	*	*			trans	-122.5	147.6	-166.9	-40.5	0	0	0	0	112.1
357	Y	26.5	Very low	27.2	Very low	162 Å²	162	133.3 Å²	133.3	64%	0.635	74%	0.744	S	S	*	*			trans	114	145.2	148	-65.4	-67	0	0	0	120.3	R489	Y357-R489 VanDerWaalsContact CD2-NH1 3.3Å; Y357-R489 VanDerWaalsContact CE2-NH1 3.3Å
358	A	26.3	Very low	27.1	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	75%	0.746	S	S	*	*			trans	99.2	132.3	139.1	0	0	0	0	0	119.6
359	T	34.5	Very low	27	Very low	130 Å²	130	131.3 Å²	131.3	80%	0.798	75%	0.747	S	S	*	*			trans	-76.2	148	161	47.2	0	0	0	0	110.9
360	L	24.8	Very low	27	Very low	169 Å²	169	129.7 Å²	129.7	89%	0.885	75%	0.751	S	S	*	*			trans	169.5	156	135.9	-94.2	165.9	0	0	0	111.6
361	S	34.5	Very low	27.2	Very low	113 Å²	113	129.7 Å²	129.7	79%	0.79	75%	0.747	S	S	*	*			trans	-87.9	139.4	174.9	-44.4	0	0	0	0	112.2
362	P	33.1	Very low	27.1	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	75%	0.745	S	S	*	*				-138.6	154.8	125.3	34.5	-20.6	0	0	0	111.5
363	T	24.1	Very low	27.1	Very low	120 Å²	120	136 Å²	136	74%	0.736	75%	0.747	S	S	*	*			cis	76.1	81	41.9	-54.8	0	0	0	0	115.3
364	K	27.1	Very low	27	Very low	180 Å²	180	135.2 Å²	135.2	78%	0.783	75%	0.747	S	S	*	*			trans	64.9	135.8	136.5	-72.3	-179.8	177	171.9	0	122.2
365	R	27.3	Very low	27	Very low	223 Å²	223	136.3 Å²	136.3	84%	0.842	75%	0.745	S	S	*	*			trans	73.8	153.3	154.1	-69.5	169.1	174.9	174.8	-4.5	115.4
366	L	24.8	Very low	27	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	75%	0.747	S	S	*	*			cis	-134.4	155.4	9	-155.6	63.3	0	0	0	107.6
367	V	24.2	Very low	26.9	Very low	111 Å²	111	141.4 Å²	141.4	67%	0.673	75%	0.753	S	S	*	*				-179.9	141	81.7	167.2	0	0	0	0	108.9
368	H	25.9	Very low	26.8	Very low	160 Å²	160	142.4 Å²	142.4	74%	0.741	76%	0.763	S	S	*	*			trans	15	132.5	170.6	-49.2	-51.2	0	0	0	121.7
369	A	25.9	Very low	26.8	Very low	92 Å²	92	147.2 Å²	147.2	76%	0.76	77%	0.771	S	S	*	*			cis	69.2	132.6	42.5	0	0	0	0	0	112.9
370	S	24.7	Very low	26.3	Very low	107 Å²	107	149 Å²	149	75%	0.748	78%	0.775	S	S	*	*				-133.9	133.4	50.2	175.1	0	0	0	0	110.4
371	E	27.7	Very low	26.5	Very low	152 Å²	152	150.3 Å²	150.3	71%	0.71	77%	0.769	S	S	*	*				53.5	139	82.4	-75.5	-168.3	-160.9	0	0	114.3
372	Q	24.7	Very low	26.1	Very low	139 Å²	139	149.7 Å²	149.7	65%	0.65	77%	0.771	S	S	*	*			cis	-131.9	-176.5	17	-117.3	145.4	49.5	0	0	110.4
373	Y	26.5	Very low	25.7	Very low	200 Å²	200	150 Å²	150	78%	0.784	77%	0.771	S	S	*	*			cis	-146.8	146.8	10.7	-142.6	-69.6	0	0	0	110.4
374	S	24.8	Very low	25.7	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	78%	0.777	S	S	*	*			trans	-167	142.1	166.4	174.5	0	0	0	0	110.9
375	K	26.9	Very low	25.7	Very low	181 Å²	181	147.2 Å²	147.2	79%	0.787	78%	0.78	S	S	*	*			trans	168.8	133.7	147.6	-97	154.3	-172.8	168.7	0	112.7
376	H	24.9	Very low	25.8	Very low	180 Å²	180	143.4 Å²	143.4	83%	0.833	78%	0.775	S	S	*	*				170.1	139.4	112.5	-85.7	95.8	0	0	0	107.6
377	S	25.9	Very low	25.7	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	78%	0.783	S	S	*	*			cis	-166.8	147.2	-25.2	37.9	0	0	0	0	107.8
378	Q	24.4	Very low	26.2	Very low	184 Å²	184	150.9 Å²	150.9	86%	0.86	79%	0.79	S	S	*	*			trans	-85.4	151.5	174.1	-110.8	172.3	-34.4	0	0	112
379	E	26.2	Very low	26.1	Very low	186 Å²	186	149.7 Å²	149.7	87%	0.869	80%	0.796	S	S	*	*			trans	66.3	115.2	165.3	-62.5	-175	165.9	0	0	119.7
380	L	25	Very low	26	Very low	166 Å²	166	148.3 Å²	148.3	87%	0.869	79%	0.792	S	S	*	*			trans	-128.6	111.3	144.4	-106.3	175.1	0	0	0	109.8
381	Y	27.1	Very low	26	Very low	197 Å²	197	148.5 Å²	148.5	77%	0.773	79%	0.793	S	S	*	*			trans	20.9	131.3	155.2	-88.5	-93.1	0	0	0	122.1	T383	Y381-T383 HydrophobicContact CD1-CG2 4.03Å; Y381-T383 HydrophobicContact CE1-CG2 4.48Å
382	A	26.1	Very low	25.8	Very low	101 Å²	101	148.8 Å²	148.8	84%	0.835	80%	0.798	S	S	*	*			trans	-101.5	115.3	150.7	0	0	0	0	0	110.8
383	T	26.4	Very low	25.8	Very low	119 Å²	119	146.7 Å²	146.7	73%	0.73	81%	0.805	S	S	*	*			trans	-153.2	98.3	168.8	40.5	0	0	0	0	111	Y381	Y381-T383 HydrophobicContact CD1-CG2 4.03Å; Y381-T383 HydrophobicContact CE1-CG2 4.48Å
384	A	24.1	Very low	25.6	Very low	104 Å²	104	142.2 Å²	142.2	86%	0.86	81%	0.809	S	S	*	*			trans	-177	85.9	154.7	0	0	0	0	0	113
385	T	25.9	Very low	25.6	Very low	138 Å²	138	141 Å²	141	85%	0.847	81%	0.813	S	S	*	*			trans	-126.7	145.8	147.8	47	0	0	0	0	106.2
386	L	28.9	Very low	25.5	Very low	143 Å²	143	137.8 Å²	137.8	75%	0.749	81%	0.814	S	S	*	*			cis	-154	139.9	8.6	-133.3	170.9	0	0	0	108.3
387	Q	22.6	Very low	25.4	Very low	192 Å²	192	140.9 Å²	140.9	90%	0.897	82%	0.818	S	S	*	*			trans	-149.6	117.5	151.2	-126.7	179.8	17.4	0	0	110.9
388	R	36.2	Very low	25.3	Very low	217 Å²	217	139.6 Å²	139.6	82%	0.819	81%	0.814	S	S	*	*			trans	-78.9	154.8	162.5	-77.1	-179.2	171.2	172.8	-3.1	108.5
389	P	22.8	Very low	25.3	Very low	134 Å²	134	135.7 Å²	135.7	87%	0.87	81%	0.807	S	S	*	*				-107.2	132.5	109.7	-17.8	33	0	0	0	112.2
390	G	24.4	Very low	25.2	Very low	64 Å²	64	137.3 Å²	137.3	66%	0.66	81%	0.806	S	S	*	*			trans	-105	123	152.7	0	0	0	0	0	107.7
391	S	23.5	Very low	25.2	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	80%	0.796	S	S	*	*			trans	-122.5	111.4	155.3	-169.3	0	0	0	0	105
392	L	25.3	Very low	25.2	Very low	157 Å²	157	129 Å²	129	82%	0.822	79%	0.791	S	S	*	*				60.5	131	71.2	-73.8	173.7	0	0	0	113.9
393	A	23.7	Very low	25.4	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	78%	0.784	S	S	*	*			trans	71.9	112.2	158.1	0	0	0	0	0	119.5
394	A	23.3	Very low	25.4	Very low	106 Å²	106	133.7 Å²	133.7	88%	0.876	79%	0.787	S	S	*	*			trans	-3.1	139.9	133.1	0	0	0	0	0	118.8
395	G	23.6	Very low	25.6	Very low	78 Å²	78	131.6 Å²	131.6	80%	0.804	78%	0.775	S	S	*	*			trans	-179.8	80.1	170.9	0	0	0	0	0	114.1
396	S	24.3	Very low	25.6	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	77%	0.774	S	S	*	*			trans	-67.3	156.7	174.5	-49.5	0	0	0	0	113.1
397	R	24	Very low	25.4	Very low	245 Å²	245	134.4 Å²	134.4	93%	0.925	78%	0.779	S	S	*	*			trans	73	153.2	163.3	-66.8	178.7	169.5	-179.6	-4.2	116.8
398	A	23.6	Very low	25.6	Very low	81 Å²	81	128.4 Å²	128.4	67%	0.669	77%	0.769	S	S	*	*			cis	-173.1	-179.9	-19.5	0	0	0	0	0	110.5
399	S	24.8	Very low	25.6	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	77%	0.765	S	S	*	*			trans	111.3	123.2	141.1	-57.1	0	0	0	0	119
400	Y	24.3	Very low	25.9	Very low	220 Å²	220	125.2 Å²	125.2	86%	0.863	76%	0.762	S	S	*	*			trans	32	143.1	131.1	-66.3	-84.5	0	0	0	120.3
401	S	24.4	Very low	26	Very low	95 Å²	95	129.2 Å²	129.2	66%	0.664	77%	0.767	S	S	*	*			cis	-172.9	155.5	38.3	-156.8	0	0	0	0	114.5
402	S	27.9	Very low	26.2	Very low	95 Å²	95	134 Å²	134	66%	0.664	77%	0.768	S	S	*	*			trans	62.9	156.8	144.3	-99.3	0	0	0	0	120.6
403	Q	29.2	Very low	26.3	Very low	147 Å²	147	130.7 Å²	130.7	69%	0.687	76%	0.764	S	S	*	*			cis	-156.4	175.8	-0.6	-149.5	158.9	84.1	0	0	112.4
404	H	26.6	Very low	26.4	Very low	171 Å²	171	133.2 Å²	133.2	79%	0.792	76%	0.763	S	S	*	*			trans	75	133.6	172.7	-52.4	-75.1	0	0	0	117.8
405	G	27.5	Very low	26.4	Very low	59 Å²	59	137.6 Å²	137.6	61%	0.608	77%	0.765	S	S	*	*			cis	168.2	152.6	-12.8	0	0	0	0	0	114.9
406	H	25.9	Very low	26.6	Very low	178 Å²	178	139 Å²	139	82%	0.824	76%	0.763	S	S	*	*			trans	67.2	140.3	170.3	-63.6	-76.9	0	0	0	117.3
407	L	26.4	Very low	27.5	Very low	162 Å²	162	138.6 Å²	138.6	85%	0.848	76%	0.757	S	S	*	*			cis	-149.4	165.2	-3.4	-101	156.1	0	0	0	109.5
408	G	26.1	Very low	27.9	Very low	67 Å²	67	133 Å²	133	69%	0.691	74%	0.742	S	S	*	*			trans	-96.9	-155.7	175.4	0	0	0	0	0	114
409	P	35.9	Very low	28.2	Very low	114 Å²	114	136.5 Å²	136.5	74%	0.74	74%	0.744	S	S	*	*			cis	-139.6	168.5	4.1	43.4	-26.4	0	0	0	117.6
410	E	28.4	Very low	28.4	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.794	74%	0.743	S	S	*	*			trans	60.3	158.6	142.4	-76.6	-175	161.4	0	0	122.5
411	L	26.7	Very low	28.7	Very low	148 Å²	148	135 Å²	135	78%	0.775	74%	0.737	S	S	*	*			cis	-148.5	178.5	5.7	-130.6	169.2	0	0	0	112.2
412	R	27.7	Very low	29.1	Very low	211 Å²	211	137.7 Å²	137.7	80%	0.796	74%	0.744	S	S	*	*			trans	-151.2	139	-177.5	178.3	-148.7	-73.4	135.2	-7.3	111.7
413	A	27.1	Very low	29.9	Very low	88 Å²	88	138.7 Å²	138.7	73%	0.727	75%	0.748	S	S	*	*			trans	-177.2	140.1	149.7	0	0	0	0	0	109
414	L	27.1	Very low	30	Very low	148 Å²	148	138.4 Å²	138.4	78%	0.775	75%	0.749	S	S	*	*			cis	80.1	122	39.8	-69.6	175.4	0	0	0	115.5
415	Q	22.7	Very low	30.2	Very low	197 Å²	197	137.5 Å²	137.5	92%	0.921	74%	0.74	S	S	*	*				-167.6	158.6	120.4	-109.2	175.4	-8.1	0	0	114
416	S	28.7	Very low	30.4	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	72%	0.718	S	S	*	*			trans	-104.7	-128	173.9	-54.8	0	0	0	0	109
417	P	43.6	Very low	30.6	Very low	106 Å²	106	134.1 Å²	134.1	69%	0.688	71%	0.713	S	S	*	*			cis	-89.2	-154.1	0.2	41.7	-38	0	0	0	111.6
418	E	31.4	Very low	30.8	Very low	128 Å²	128	133.1 Å²	133.1	60%	0.598	70%	0.698	S	S	*	*			cis	-160.9	179.5	-0.1	-139.2	160.8	-73	0	0	106.9
419	H	30.1	Very low	30.8	Very low	155 Å²	155	135 Å²	135	72%	0.718	70%	0.696	S	S	*	*			cis	-136.3	136.6	1.8	-44.1	-96.8	0	0	0	109.4
420	H	28.8	Very low	30.4	Very low	147 Å²	147	139.2 Å²	139.2	68%	0.681	70%	0.699	S	S	*	*				65.1	137.5	103.9	-71.2	-84.8	0	0	0	120
421	I	29.6	Very low	30.2	Very low	143 Å²	143	137.6 Å²	137.6	73%	0.733	69%	0.691	S	S	*	*			cis	-178	147	-39.4	-107	162.6	0	0	0	111.1
422	D	33.5	Very low	30.1	Very low	151 Å²	151	139 Å²	139	81%	0.807	69%	0.691	S	S	*	*			trans	-92.5	-179.9	173.3	-50.4	-73	0	0	0	113.9
423	P	45.9	Very low	30.5	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	69%	0.69	S	S	*	*			trans	-156.7	174.6	139.7	38.2	-19.5	0	0	0	119.7
424	I	31.1	Very low	31.7	Very low	141 Å²	141	136.2 Å²	136.2	72%	0.723	69%	0.692	S	S	*	*			trans	78.1	137.8	154.9	-80.7	159.7	0	0	0	119.6	K1178	I424-K1178 CarbonylContact C-O 3.5Å; I424-K1178 VanDerWaalsContact C-O 3.22Å
425	Y	30.2	Very low	31.7	Very low	153 Å²	153	136.2 Å²	136.2	60%	0.6	69%	0.69	S	S	*	*			cis	-172.9	165.9	-18.7	-157.6	-101.4	0	0	0	114.2	S1176 R1177 K1178	Y425-S1176 WeakPolarHBondContact CD2-OG 3.35Å; Y425-R1177 CarbonylContact C-O 3.59Å; Y425-R1177 WeakPolarHBondContact CA-O 3.34Å; Y425-R1177 VanDerWaalsContact O-O 3.08Å; Y425-K1178 PolarHBondContact N-O 3.41Å; Y425-K1178 WeakPolarHBondContact O-CB 3.42Å
426	E	31.6	Very low	32.2	Very low	31 Å²	31	137 Å²	137	15%	0.145	69%	0.685	C	S	.	*			trans	-109.6	164.9	-172.4	174.3	168.3	-59.3	0	0	117.4	P1175 S1176 R1177	E426-P1175 WeakPolarHBondContact OE2-CG 3.38Å; E426-S1176 VanDerWaalsContact CB-CA 3.49Å; E426-S1176 WeakPolarHBondContact CB-OG 3.42Å; E426-S1176 PolarHBondContact N-OG 3.46Å; E426-S1176 VanDerWaalsContact N-OG 3.1Å; E426-S1176 VanDerWaalsContact OE1-CA 3.31Å; E426-S1176 WeakPolarHBondContact OE1-CA 3.42Å; E426-S1176 PolarHBondContact OE1-N 3.18Å; E426-R1177 HydrophobicContact CB-CB 3.97Å; E426-R1177 HydrophobicContact CG-CB 4.13Å; E426-R1177 HydrophobicContact CG-CG 4.37Å; E426-R1177 PolarHBondContact N-O 2.84Å; E426-R1177 WeakPolarHBondContact OE1-CB 3.24Å; E426-R1177 WeakPolarHBondContact OE1-CD 3.48Å; E426-R1177 WeakPolarHBondContact OE1-CG 3.31Å; E426-R1177 PolarHBondContact OE1-N 2.98Å
427	D	29.9	Very low	32.2	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	68%	0.677	S	S	*	*			trans	-149.7	175	144.1	-143.7	-18.3	0	0	0	115.9	R1177	D427-R1177 PolarHBondContact O-NH1 2.81Å
428	R	31.3	Very low	31.6	Very low	141 Å²	141	138.4 Å²	138.4	53%	0.532	68%	0.684	S	S	.	*			trans	-149.4	130.2	-156.3	-126.6	-167.4	-169.8	174.3	8.8	116.8	E1174	R428-E1174 IonicContact CZ-OE1 2.77Å; R428-E1174 IonicContact CZ-OE2 3.59Å; R428-E1174 IonicContact NH1-OE1 2.72Å; R428-E1174 IonicContact NH1-OE2 3.51Å; R428-E1174 PolarHBondContact NH1-OE2 3.04Å; R428-E1174 IonicContact NH2-OE1 3.74Å; R428-E1174 PolarHBondContact NH2-OE1 3.41Å; R428-E1174 IonicContact NH2-OE2 2.83Å; R428-E1174 PolarHBondContact NH2-OE2 3.2Å
429	V	25.5	Very low	31.5	Very low	107 Å²	107	136.4 Å²	136.4	65%	0.648	68%	0.684	S	S	*	*			trans	68.7	149.8	152	-134.6	0	0	0	0	123.8
430	Y	27.3	Very low	31.4	Very low	202 Å²	202	138.2 Å²	138.2	79%	0.792	69%	0.692	S	S	*	*			trans	82	149.3	148.4	-85	-42.8	0	0	0	120.8
431	Q	24.4	Very low	31.3	Very low	136 Å²	136	135.8 Å²	135.8	64%	0.636	69%	0.692	S	S	*	*			cis	-164.4	163.2	-6.1	-164.2	179.9	84.6	0	0	113.7
432	K	23.9	Very low	31.1	Very low	177 Å²	177	138.4 Å²	138.4	77%	0.77	70%	0.701	S	S	*	*			trans	111.5	114	146.3	-70.1	-164.5	172.6	175.7	0	121.4
433	P	36.3	Very low	30.8	Very low	121 Å²	121	134.9 Å²	134.9	79%	0.786	70%	0.7	S	S	*	*			trans	-132.7	153.6	159.4	40.1	-26.7	0	0	0	116
434	P	52.1	Low	29.7	Very low	119 Å²	119	136.9 Å²	136.9	77%	0.773	71%	0.705	S	S	*	*			trans	-118.3	-170.3	158.9	35.2	-18	0	0	0	111.1
435	M	27.8	Very low	30.4	Very low	148 Å²	148	134.7 Å²	134.7	73%	0.729	70%	0.7	S	S	*	*			cis	-150	165.5	22	-100.6	-59.6	-116.1	0	0	113.9
436	R	32.5	Very low	30.2	Very low	215 Å²	215	135.1 Å²	135.1	81%	0.811	71%	0.712	S	S	*	*			trans	2.5	151.4	148.6	-77.6	-162.4	165.1	132.5	2.4	122.7
437	S	29.4	Very low	31.1	Very low	82 Å²	82	139 Å²	139	57%	0.573	74%	0.739	S	S	*	*			cis	-179.4	133.8	0.8	160.6	0	0	0	0	117
438	L	30.1	Very low	31.7	Very low	160 Å²	160	138.4 Å²	138.4	84%	0.838	74%	0.743	S	S	*	*			trans	57	154.9	141	-62.5	170.2	0	0	0	121.8
439	S	29.3	Very low	31.5	Very low	85 Å²	85	135.4 Å²	135.4	59%	0.594	75%	0.749	S	S	*	*			cis	-176	152	-11.2	49.1	0	0	0	0	115.8
440	Q	29.6	Very low	31.5	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	76%	0.755	S	S	*	*			trans	63.9	149.5	153.1	-70.5	174.7	-15.9	0	0	119.3
441	S	25.9	Very low	31.5	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	76%	0.759	S	S	*	*			cis	-160.8	159.8	23.1	56.6	0	0	0	0	114.8
442	Q	26.3	Very low	31.6	Very low	199 Å²	199	132.4 Å²	132.4	93%	0.93	76%	0.763	S	S	*	*			trans	61.5	152.7	164.4	-65.9	177.2	-19.8	0	0	118.2
443	G	25.9	Very low	31.8	Very low	76 Å²	76	129.1 Å²	129.1	78%	0.784	76%	0.758	S	S	*	*			cis	-174.8	168.8	-4.2	0	0	0	0	0	113.4
444	D	22.5	Very low	31.3	Very low	157 Å²	157	133 Å²	133	84%	0.84	76%	0.758	S	S	*	*			trans	-86.9	-170.3	175.5	-134.6	-10.1	0	0	0	110.3
445	P	45.8	Very low	30.1	Very low	95 Å²	95	138 Å²	138	62%	0.617	76%	0.762	S	S	*	*			cis	-145.2	174.2	-7.8	42.5	-22.2	0	0	0	119.2
446	L	27.6	Very low	29.9	Very low	163 Å²	163	136.4 Å²	136.4	85%	0.853	76%	0.761	S	S	*	*			trans	62.7	151.4	141.8	-70.6	164.2	0	0	0	125.5
447	P	49.5	Very low	29.7	Very low	111 Å²	111	131 Å²	131	72%	0.721	76%	0.756	S	S	*	*			trans	-100.2	-160.3	178.1	45.2	-39.4	0	0	0	112.7
448	P	43.1	Very low	29.5	Very low	123 Å²	123	134.1 Å²	134.1	80%	0.799	77%	0.771	S	S	*	*			cis	-145	-138.8	11.2	45.7	-21.7	0	0	0	116.3
449	A	26.4	Very low	29.4	Very low	79 Å²	79	130.8 Å²	130.8	65%	0.653	77%	0.767	S	S	*	*			trans	79.1	157.4	170.1	0	0	0	0	0	118.3
450	H	25.7	Very low	29.8	Very low	168 Å²	168	132.9 Å²	132.9	78%	0.778	78%	0.779	S	S	*	*			cis	-167	152	-29.2	-104.7	-55.3	0	0	0	110.3
451	T	26.7	Very low	29.7	Very low	143 Å²	143	128.7 Å²	128.7	88%	0.877	77%	0.771	S	S	*	*			trans	59.3	157.8	155.9	55.1	0	0	0	0	121.2
452	G	27.6	Very low	30.3	Very low	70 Å²	70	129.7 Å²	129.7	72%	0.722	78%	0.778	S	S	*	*			trans	150	31.6	155.8	0	0	0	0	0	123.9
453	T	27.1	Very low	30.8	Very low	109 Å²	109	126.2 Å²	126.2	67%	0.669	77%	0.772	S	S	*	*			trans	6.8	134.7	155.3	38.9	0	0	0	0	123
454	Y	26.8	Very low	30.9	Very low	202 Å²	202	125.7 Å²	125.7	79%	0.792	77%	0.767	S	S	*	*				133.4	123.6	129.2	-67.9	-53.1	0	0	0	119.5
455	R	25.7	Very low	31.4	Very low	224 Å²	224	125.2 Å²	125.2	85%	0.845	77%	0.77	S	S	*	*			trans	80.8	136.6	136.8	-78.4	-172.3	176.9	-162.3	1.4	124.7
456	T	25.6	Very low	30.7	Very low	115 Å²	115	125.8 Å²	125.8	71%	0.706	77%	0.768	S	S	*	*			trans	73.2	103.9	142.8	46	0	0	0	0	123
457	S	26.3	Very low	30.7	Very low	102 Å²	102	123.8 Å²	123.8	71%	0.713	77%	0.767	S	S	*	*				66	135.9	118.3	-53.5	0	0	0	0	123.3
458	T	26.8	Very low	29.9	Very low	146 Å²	146	123.9 Å²	123.9	90%	0.896	77%	0.765	S	S	*	*			trans	76.2	145.1	155.7	20.8	0	0	0	0	119.1
459	A	27.8	Very low	30.4	Very low	91 Å²	91	123.1 Å²	123.1	75%	0.752	76%	0.761	S	S	*	*			trans	-78.6	167.4	-173.7	0	0	0	0	0	112.9
460	P	37.6	Very low	30.4	Very low	129 Å²	129	127.5 Å²	127.5	84%	0.838	77%	0.772	S	S	*	*				-146.2	-159.9	82.5	41.8	-23.8	0	0	0	115.1
461	S	27.4	Very low	30.7	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	77%	0.773	S	S	*	*			trans	-76.3	157.9	-164.6	-40.6	0	0	0	0	117.9
462	S	38.8	Very low	30.7	Very low	117 Å²	117	131.4 Å²	131.4	82%	0.818	77%	0.771	S	S	*	*			trans	69	142.4	157.6	-55.9	0	0	0	0	118.5
463	P	35.4	Very low	30.8	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	78%	0.775	S	S	*	*				-146	143.3	125.4	35.3	-19.5	0	0	0	115.8
464	G	29.7	Very low	30.8	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	78%	0.78	S	S	*	*			trans	-94.9	-173.1	134.3	0	0	0	0	0	108.4
465	V	33.1	Very low	31.1	Very low	147 Å²	147	128.4 Å²	128.4	89%	0.891	78%	0.78	S	S	*	*			cis	-140.7	-147.8	11.6	-84	0	0	0	0	106.8
466	D	29.9	Very low	31.3	Very low	107 Å²	107	125.5 Å²	125.5	57%	0.572	78%	0.775	S	S	*	*			cis	-161.9	167.9	6.9	179.4	46.7	0	0	0	110.1	V468	D466-V468 WeakPolarHBondContact OD2-CB 3.46Å; D466-V468 VanDerWaalsContact OD2-CG2 3.24Å; D466-V468 WeakPolarHBondContact OD2-CG2 3.34Å; D466-V468 PolarHBondContact OD2-N 2.82Å
467	S	29	Very low	31.5	Very low	121 Å²	121	127.9 Å²	127.9	85%	0.846	78%	0.778	S	S	*	*			trans	-158.6	89.7	139.2	-79.8	0	0	0	0	113.1
468	V	32.6	Very low	32	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	77%	0.774	S	S	*	*			trans	-56.7	147.1	159.8	159.3	0	0	0	0	110.7	D466	D466-V468 WeakPolarHBondContact OD2-CB 3.46Å; D466-V468 VanDerWaalsContact OD2-CG2 3.24Å; D466-V468 WeakPolarHBondContact OD2-CG2 3.34Å; D466-V468 PolarHBondContact OD2-N 2.82Å
469	P	51.7	Low	33.3	Very low	108 Å²	108	124.2 Å²	124.2	70%	0.701	77%	0.766	S	S	*	*				-155.6	151.6	69.1	41.1	-19.6	0	0	0	121.2
470	L	28.2	Very low	33.3	Very low	171 Å²	171	128.7 Å²	128.7	90%	0.895	77%	0.771	S	S	*	*				-176.4	172.1	107.6	-95.8	167.6	0	0	0	112.6
471	Q	30.6	Very low	33	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	77%	0.773	S	S	*	*			trans	-112.8	150.7	-164.1	-56.3	177.5	-5.9	0	0	115.1
472	R	27.7	Very low	33.3	Very low	222 Å²	222	130 Å²	130	84%	0.838	78%	0.776	S	S	*	*				-179.7	115.6	107.8	-103	-172.8	172.5	-165.5	-2.5	117.2
473	T	29	Very low	33	Very low	132 Å²	132	129.4 Å²	129.4	81%	0.81	78%	0.778	S	S	*	*			trans	50.4	125.7	133.5	57.9	0	0	0	0	124.2
474	G	27.6	Very low	32.7	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	78%	0.775	S	S	*	*			trans	139.9	86.4	158.3	0	0	0	0	0	113
475	S	32.9	Very low	32.7	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	78%	0.778	S	S	*	*				62.9	125.2	68.3	-137.7	0	0	0	0	112.5
476	Q	29.7	Very low	32.5	Very low	162 Å²	162	127.3 Å²	127.3	76%	0.757	77%	0.769	S	S	*	*			cis	-147	157.6	29.5	-79.6	-174.9	4	0	0	116
477	H	29.5	Very low	32.5	Very low	165 Å²	165	131.3 Å²	131.3	76%	0.764	78%	0.782	S	S	*	*			trans	41	113.7	141.9	-66.6	-62.9	0	0	0	124.3
478	G	37	Very low	32.4	Very low	61 Å²	61	134 Å²	134	63%	0.629	78%	0.781	S	S	*	*				-86.1	-162.2	116	0	0	0	0	0	110.8
479	P	53.9	Low	32.2	Very low	111 Å²	111	135.9 Å²	135.9	72%	0.721	78%	0.776	S	S	*	*			cis	-145	-167.3	22.1	43.3	-23.6	0	0	0	114.8
480	Q	29.2	Very low	31.1	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	78%	0.778	S	S	*	*				-172.1	145.3	117.7	-103	156.8	97.6	0	0	114.4
481	N	31.1	Very low	31.3	Very low	165 Å²	165	132 Å²	132	88%	0.882	77%	0.771	S	S	*	*			trans	-98.6	156.8	165.4	-67.4	-37.7	0	0	0	109.4
482	A	32.7	Very low	31.3	Very low	96 Å²	96	134.5 Å²	134.5	79%	0.793	78%	0.775	S	S	*	*			trans	-175.9	134.8	131.7	0	0	0	0	0	113.2
483	A	32.3	Very low	31.5	Very low	104 Å²	104	128.2 Å²	128.2	86%	0.86	77%	0.77	S	S	*	*			trans	57.1	166	140.8	0	0	0	0	0	121
484	A	29.8	Very low	31.6	Very low	91 Å²	91	126.7 Å²	126.7	75%	0.752	77%	0.771	S	S	*	*			cis	-164.7	156.5	-39.9	0	0	0	0	0	110.4
485	A	30.5	Very low	31.9	Very low	90 Å²	90	126.3 Å²	126.3	74%	0.744	77%	0.768	S	S	*	*			trans	71.3	137.7	150.4	0	0	0	0	0	122.7
486	T	28.9	Very low	32.5	Very low	113 Å²	113	127.4 Å²	127.4	69%	0.693	77%	0.772	S	S	*	*			trans	71.4	122.8	144.1	31.6	0	0	0	0	123.3
487	F	28	Very low	32.5	Very low	191 Å²	191	124 Å²	124	84%	0.838	77%	0.772	S	S	*	*			trans	63.8	157.3	159.7	-62.1	-66.1	0	0	0	116.3
488	Q	28.3	Very low	32.7	Very low	177 Å²	177	120.6 Å²	120.6	83%	0.827	77%	0.766	S	S	*	*			cis	-149.2	-179.5	9.2	-143.1	166.9	36.9	0	0	111.6
489	R	27.1	Very low	32.3	Very low	152 Å²	152	124.2 Å²	124.2	57%	0.574	77%	0.771	S	S	*	*			trans	-71.8	152.9	166.1	-73.5	174.1	-179.4	152.2	0.9	110.5	Y357	Y357-R489 VanDerWaalsContact CD2-NH1 3.3Å; Y357-R489 VanDerWaalsContact CE2-NH1 3.3Å
490	A	30.4	Very low	31.1	Very low	92 Å²	92	129.1 Å²	129.1	76%	0.76	78%	0.777	S	S	*	*			cis	-141.7	-111.8	-11.3	0	0	0	0	0	111
491	S	30.3	Very low	31.1	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	77%	0.772	S	S	*	*			cis	-160.9	176.9	0.5	-159.8	0	0	0	0	111.9
492	Y	32.3	Very low	31.3	Very low	221 Å²	221	124 Å²	124	87%	0.867	77%	0.768	S	S	*	*			trans	-81.4	168.4	168.8	-42.7	-87.3	0	0	0	110.4
493	A	31.1	Very low	32	Very low	90 Å²	90	124 Å²	124	74%	0.744	76%	0.76	S	S	*	*			cis	-165.2	176.6	23.1	0	0	0	0	0	113.1
494	A	31.1	Very low	31.8	Very low	100 Å²	100	128.8 Å²	128.8	83%	0.826	76%	0.758	S	S	*	*			trans	64.7	136.6	149.1	0	0	0	0	0	121.8
495	G	33.6	Very low	31.9	Very low	67 Å²	67	134.1 Å²	134.1	69%	0.691	76%	0.758	S	S	*	*			trans	-83.5	-170.2	153.8	0	0	0	0	0	111.7
496	P	45.3	Very low	31.9	Very low	135 Å²	135	139 Å²	139	88%	0.877	77%	0.766	S	S	*	*				-145.8	-166.8	77.9	40.5	-23.1	0	0	0	115.2
497	A	30.5	Very low	32	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	76%	0.764	S	S	*	*			trans	-62.8	171.6	-179.8	0	0	0	0	0	113.7
498	S	32.5	Very low	31.8	Very low	92 Å²	92	139.7 Å²	139.7	64%	0.643	77%	0.767	S	S	*	*			cis	-177.8	177	44.4	53.4	0	0	0	0	114.3
499	N	29.2	Very low	31.8	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	77%	0.767	S	S	*	*			trans	84.2	120.6	145.4	-71.2	-22.3	0	0	0	122.7
500	Y	29.4	Very low	31.7	Very low	214 Å²	214	138.6 Å²	138.6	84%	0.839	77%	0.77	S	S	*	*				119.7	134.3	115.5	-112.2	-117.6	0	0	0	121.4
501	A	28.8	Very low	32.7	Very low	92 Å²	92	140.1 Å²	140.1	76%	0.76	77%	0.773	S	S	*	*			trans	65.1	119.3	152.1	0	0	0	0	0	122.8
502	D	35.9	Very low	32.5	Very low	150 Å²	150	140.9 Å²	140.9	80%	0.802	78%	0.778	S	S	*	*			trans	-98.3	152.6	145.2	178.8	34.5	0	0	0	107.2
503	P	46.5	Very low	32.3	Very low	97 Å²	97	135.7 Å²	135.7	63%	0.63	77%	0.769	S	S	*	*				-161	163.1	98.6	42.4	-22.3	0	0	0	120.3
504	Y	29.4	Very low	32.2	Very low	204 Å²	204	139.8 Å²	139.8	80%	0.8	77%	0.773	S	S	*	*			trans	82.9	110.3	140.2	-86.1	-55.7	0	0	0	124.6
505	R	30.9	Very low	31.9	Very low	203 Å²	203	140.2 Å²	140.2	77%	0.766	77%	0.77	S	S	*	*			trans	35.2	137.5	132.3	-86.5	-171.8	167.7	-157.6	-1.7	122.8
506	Q	29.5	Very low	32.5	Very low	192 Å²	192	142 Å²	142	90%	0.897	77%	0.769	S	S	*	*				-149.4	170	113.2	-158.2	151.9	-9.4	0	0	112.2
507	L	32.1	Very low	31.9	Very low	128 Å²	128	146.4 Å²	146.4	67%	0.67	77%	0.77	S	S	*	*			trans	-134.1	146.7	-172.4	-90.5	160.5	0	0	0	111.6
508	Q	23.7	Very low	32	Very low	191 Å²	191	146.9 Å²	146.9	89%	0.893	77%	0.768	S	S	*	*			trans	-158.9	163	153.9	-148.2	127.3	8.9	0	0	111.9
509	Y	27.3	Very low	32	Very low	210 Å²	210	152.5 Å²	152.5	82%	0.824	78%	0.781	S	S	*	*			trans	-153.5	125	-161.3	-176.4	-96.9	0	0	0	114.6
510	C	26.4	Very low	32.3	Very low	96 Å²	96	152 Å²	152	65%	0.649	79%	0.788	S	S	*	*			trans	57.2	177.8	159.3	-70.9	0	0	0	0	119.6
511	P	50.3	Low	32.3	Very low	125 Å²	125	145.3 Å²	145.3	81%	0.812	78%	0.783	S	S	*	*			cis	-128.6	-178.9	-29.4	30.6	-11.4	0	0	0	113.4
512	S	25.8	Very low	33.2	Very low	122 Å²	122	146.8 Å²	146.8	85%	0.853	79%	0.786	S	S	*	*			trans	-170.2	172.4	140	-154.9	0	0	0	0	113.4
513	V	29.4	Very low	33.1	Very low	113 Å²	113	144 Å²	144	69%	0.685	78%	0.783	S	S	*	*			trans	-117	162.4	-156.3	-72.9	0	0	0	0	117.2
514	E	27.8	Very low	32.5	Very low	176 Å²	176	147 Å²	147	82%	0.822	79%	0.793	S	S	*	*			trans	66.3	159	150.5	-73.9	162.8	140.3	0	0	119.2
515	S	26	Very low	33	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	79%	0.789	S	S	*	*			cis	-149.9	-179	14.6	-130.6	0	0	0	0	112.4
516	P	46.7	Very low	33.5	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	79%	0.791	S	S	*	*			trans	-110.2	-177.2	-158.7	43.1	-39.3	0	0	0	116.9
517	Y	31.6	Very low	33.6	Very low	227 Å²	227	138.6 Å²	138.6	89%	0.89	79%	0.79	S	S	*	*			trans	-158.4	172.7	136.7	-125.7	-91.9	0	0	0	114.5
518	S	32.2	Very low	33.7	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	80%	0.8	S	S	*	*			trans	-76.6	158	-148.7	-58.9	0	0	0	0	122.2
519	K	34	Very low	34.2	Very low	210 Å²	210	133.6 Å²	133.6	91%	0.913	80%	0.795	S	S	*	*			trans	-47.5	147.5	164.9	-63.8	170.8	172.5	175.5	0	116.6
520	S	33.8	Very low	34.7	Very low	127 Å²	127	131.7 Å²	131.7	89%	0.888	80%	0.798	S	S	*	*				-154.3	163.9	126.3	59	0	0	0	0	110.2
521	G	30.6	Very low	35.3	Very low	72 Å²	72	132 Å²	132	74%	0.742	81%	0.808	S	S	*	*			trans	-151.9	-157	179.6	0	0	0	0	0	110.3
522	P	47.3	Very low	34.6	Very low	124 Å²	124	137.3 Å²	137.3	81%	0.805	81%	0.812	S	S	*	*			cis	-136.1	178.9	-1.3	42.7	-26.6	0	0	0	115.6
523	A	33.9	Very low	34.9	Very low	91 Å²	91	136.9 Å²	136.9	75%	0.752	81%	0.809	S	S	*	*			trans	62.4	147	159.3	0	0	0	0	0	119
524	L	33.8	Very low	35.6	Very low	160 Å²	160	137.2 Å²	137.2	84%	0.838	81%	0.814	S	S	*	*			cis	-168.5	171.5	-9.4	-99	168.3	0	0	0	105.8
525	P	39.9	Very low	36.1	Very low	110 Å²	110	132.2 Å²	132.2	71%	0.714	80%	0.798	S	S	*	*			cis	-118.5	177.4	-34.9	41.1	-27.6	0	0	0	112.3
526	P	40.9	Very low	37.1	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.8	158.4	174.9	36.2	-34.2	0	0	0	114.7
527	E	32.8	Very low	36.8	Very low	188 Å²	188	134.4 Å²	134.4	88%	0.879	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-76.3	154	173.7	-66.1	-175.3	120.4	0	0	113.5	T529	E527-T529 PolarHBondContact O-N 2.71Å
528	G	33.4	Very low	37.5	Very low	85 Å²	85	126.2 Å²	126.2	88%	0.876	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-74.5	120.3	177	0	0	0	0	0	112.9
529	T	35.3	Very low	38.2	Very low	129 Å²	129	127.9 Å²	127.9	79%	0.791	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-78.6	140	-172.2	44	0	0	0	0	115.2	E527	E527-T529 PolarHBondContact O-N 2.71Å
530	L	37.8	Very low	38.7	Very low	170 Å²	170	126.8 Å²	126.8	89%	0.89	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-55.3	131.6	154.6	-71.7	161	0	0	0	110.5	R532	L530-R532 PolarHBondContact O-N 2.89Å
531	A	37.8	Very low	39.2	Very low	103 Å²	103	127 Å²	127	85%	0.851	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-70	126.9	177.1	0	0	0	0	0	111.4
532	R	35.3	Very low	39.7	Very low	235 Å²	235	126.7 Å²	126.7	89%	0.887	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-80.8	146.4	171.5	-74.7	-177.2	167.3	102.5	-5.4	110.6	L530	L530-R532 PolarHBondContact O-N 2.89Å
533	S	32.6	Very low	39.8	Very low	113 Å²	113	126.1 Å²	126.1	79%	0.79	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-59.8	144.3	161.1	-48.7	0	0	0	0	110.4
534	P	44.7	Very low	40.8	Very low	121 Å²	121	131.6 Å²	131.6	79%	0.786	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-67.1	143.3	-179.7	27.3	-34.3	0	0	0	111.9
535	S	38.5	Very low	41.5	Very low	71 Å²	71	130.2 Å²	130.2	50%	0.497	72%	0.72	S	S	.	*	P	Polyproline II helix	trans	-76.3	157.1	174.7	-164.5	0	0	0	0	111.6	D537 S538	S535-D537 WeakPolarHBondContact CB-OD2 3.45Å; S535-D537 PolarHBondContact O-N 3.44Å; S535-D537 PolarHBondContact OG-OD2 3.38Å; S535-S538 PolarHBondContact O-N 2.8Å
536	I	45.3	Very low	42	Very low	136 Å²	136	131.8 Å²	131.8	70%	0.697	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-66.6	-14.9	177.8	-153.3	162.4	0	0	0	112.8	S538 I539	I536-S538 PolarHBondContact O-N 3.01Å; I536-I539 HydrophobicContact CG1-CD1 3.77Å; I536-I539 WeakPolarHBondContact O-CD1 3.38Å; I536-I539 WeakPolarHBondContact O-CG1 3.47Å; I536-I539 PolarHBondContact O-N 3.05Å
537	D	41.3	Very low	42.5	Very low	124 Å²	124	128.4 Å²	128.4	66%	0.663	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-67.7	-17.6	176.8	-49.9	-73.5	0	0	0	113.9	S535 I539	S535-D537 WeakPolarHBondContact CB-OD2 3.45Å; S535-D537 PolarHBondContact O-N 3.44Å; S535-D537 PolarHBondContact OG-OD2 3.38Å; D537-I539 PolarHBondContact O-N 3.06Å; D537-I539 VanDerWaalsContact O-N 3.09Å
538	S	46.8	Very low	44.3	Very low	55 Å²	55	132 Å²	132	39%	0.385	71%	0.71	S	S	.	*	G	3₁₀ helix	trans	-65.8	-9.5	177.6	-65.4	0	0	0	0	114.1	S535 I536 Q540	S535-S538 PolarHBondContact O-N 2.8Å; I536-S538 PolarHBondContact O-N 3.01Å; S538-Q540 VanDerWaalsContact C-N 3.26Å; S538-Q540 PolarHBondContact O-N 3.47Å
539	I	46.4	Very low	46.8	Very low	136 Å²	136	135 Å²	135	70%	0.697	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-74.4	-9.9	-174.9	-63.5	174.5	0	0	0	113.1	I536 D537	I536-I539 HydrophobicContact CG1-CD1 3.77Å; I536-I539 WeakPolarHBondContact O-CD1 3.38Å; I536-I539 WeakPolarHBondContact O-CG1 3.47Å; I536-I539 PolarHBondContact O-N 3.05Å; D537-I539 PolarHBondContact O-N 3.06Å; D537-I539 VanDerWaalsContact O-N 3.09Å
540	Q	43.6	Very low	49.1	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-99.9	8.1	-179.6	-64.9	-168.4	6.6	0	0	115.7	S538	S538-Q540 VanDerWaalsContact C-N 3.26Å; S538-Q540 PolarHBondContact O-N 3.47Å
541	K	45.5	Very low	51.7	Low	131 Å²	131	127.8 Å²	127.8	57%	0.57	65%	0.654	S	S	*	*	S	Bend	trans	-89.9	156.7	171.4	-84.8	-173	149	-121.4	0	112.1	E545	K541-E545 IonicContact NZ-OE2 3.17Å; K541-E545 PolarHBondContact NZ-OE2 2.73Å
542	D	41	Very low	54.3	Low	66 Å²	66	128.6 Å²	128.6	35%	0.353	64%	0.64	S	S	.	*			trans	-57.8	127.5	-177.4	-167.2	-52.2	0	0	0	110.4	R544 E545	D542-R544 PolarHBondContact O-N 3.42Å; D542-R544 VanDerWaalsContact OD1-CB 3.29Å; D542-R544 WeakPolarHBondContact OD1-CB 3.43Å; D542-R544 WeakPolarHBondContact OD1-CG 3.35Å; D542-R544 IonicContact OD1-CZ 3.52Å; D542-R544 PolarHBondContact OD1-N 3.2Å; D542-R544 IonicContact OD1-NE 2.7Å; D542-R544 PolarHBondContact OD1-NE 3.41Å; D542-R544 IonicContact OD1-NH2 3.63Å; D542-R544 IonicContact OD2-CZ 3.04Å; D542-R544 IonicContact OD2-NE 3.52Å; D542-R544 PolarHBondContact OD2-NE 2.73Å; D542-R544 IonicContact OD2-NH2 3.36Å; D542-R544 PolarHBondContact OD2-NH2 2.82Å; D542-E545 PolarHBondContact O-N 3.02Å
543	P	49.9	Very low	57.1	Low	111 Å²	111	119 Å²	119	72%	0.721	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-17.1	178.1	-28.4	36.2	0	0	0	114.8
544	R	53.5	Low	60.2	Low	207 Å²	207	116.9 Å²	116.9	78%	0.781	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-13.1	177.5	-62.7	167.5	-71.5	-171.4	2.5	114.1	D542	D542-R544 PolarHBondContact O-N 3.42Å; D542-R544 VanDerWaalsContact OD1-CB 3.29Å; D542-R544 WeakPolarHBondContact OD1-CB 3.43Å; D542-R544 WeakPolarHBondContact OD1-CG 3.35Å; D542-R544 IonicContact OD1-CZ 3.52Å; D542-R544 PolarHBondContact OD1-N 3.2Å; D542-R544 IonicContact OD1-NE 2.7Å; D542-R544 PolarHBondContact OD1-NE 3.41Å; D542-R544 IonicContact OD1-NH2 3.63Å; D542-R544 IonicContact OD2-CZ 3.04Å; D542-R544 IonicContact OD2-NE 3.52Å; D542-R544 PolarHBondContact OD2-NE 2.73Å; D542-R544 IonicContact OD2-NH2 3.36Å; D542-R544 PolarHBondContact OD2-NH2 2.82Å
545	E	49.2	Very low	62.7	Low	131 Å²	131	113.8 Å²	113.8	61%	0.612	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-22.9	167.6	-70	-166	151	0	0	112.1	K541 D542 G547	K541-E545 IonicContact NZ-OE2 3.17Å; K541-E545 PolarHBondContact NZ-OE2 2.73Å; D542-E545 PolarHBondContact O-N 3.02Å; E545-G547 PolarHBondContact O-N 3.39Å
546	F	49.8	Very low	65.5	Low	142 Å²	142	110.5 Å²	110.5	62%	0.623	54%	0.542	S	S	*	.	S	Bend	trans	-78.7	60.1	168.3	-85.3	-83.4	0	0	0	110.8
547	G	52.9	Low	68	Low	54 Å²	54	104.4 Å²	104.4	56%	0.557	51%	0.51	S	S	*	.			trans	-57.7	146.1	178	0	0	0	0	0	112.4	E545 R549	E545-G547 PolarHBondContact O-N 3.39Å; G547-R549 VanDerWaalsContact C-N 3.28Å; G547-R549 PolarHBondContact O-N 3.14Å
548	W	69.3	Low	70.6	Confident	264 Å²	264	105.3 Å²	105.3	100%	1	51%	0.511	S	S	*	.			trans	-66.2	81.1	176.8	-60.7	92	0	0	0	111
549	R	87.1	Confident	73.1	Confident	147 Å²	147	105.9 Å²	105.9	56%	0.555	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-74.3	122.6	167.6	172.2	172.2	178.4	-101.2	5.6	108.7	G547 P551 E552 E555	G547-R549 VanDerWaalsContact C-N 3.28Å; G547-R549 PolarHBondContact O-N 3.14Å; R549-P551 WeakPolarHBondContact O-CD 3.45Å; R549-E552 IonicContact NH2-OE1 2.89Å; R549-E552 PolarHBondContact NH2-OE1 3.24Å; R549-E555 IonicContact CZ-OE1 3.67Å; R549-E555 VanDerWaalsContact CZ-OE1 3.27Å; R549-E555 IonicContact CZ-OE2 3.4Å; R549-E555 VanDerWaalsContact NH1-CD 3.27Å; R549-E555 IonicContact NH1-OE1 2.87Å; R549-E555 PolarHBondContact NH1-OE1 3.36Å; R549-E555 IonicContact NH1-OE2 3.24Å; R549-E555 PolarHBondContact NH1-OE2 3Å; R549-E555 IonicContact NH2-OE1 3.61Å; R549-E555 PolarHBondContact NH2-OE1 3.45Å; R549-E555 IonicContact NH2-OE2 2.71Å
550	D	83.6	Confident	75.5	Confident	116 Å²	116	99.6 Å²	99.6	62%	0.62	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-59.9	119.9	163	-81.1	-63.7	0	0	0	109.6	Y574	D550-Y574 WeakPolarHBondContact CB-OH 3.32Å; D550-Y574 PolarHBondContact OD1-OH 2.86Å
551	P	90.9	Very high	78.1	Confident	33 Å²	33	97 Å²	97	21%	0.214	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-69.6	137	177.9	28.5	-34.6	0	0	0	110.5	R549 E555 V556 M559 Y574	R549-P551 WeakPolarHBondContact O-CD 3.45Å; P551-E555 HydrophobicContact CB-CB 4.38Å; P551-V556 HydrophobicContact CB-CG2 3.8Å; P551-V556 HydrophobicContact CG-CG2 3.56Å; P551-M559 HydrophobicContact CB-CE 4.08Å; P551-Y574 HydrophobicContact CG-CD1 4.45Å; P551-Y574 HydrophobicContact CG-CE1 3.97Å
552	E	92.9	Very high	80.6	Confident	120 Å²	120	94.4 Å²	94.4	56%	0.561	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-65.1	148.6	178.1	-70.6	174.6	-138.2	0	0	111.1	R549 P554 E555 V556	R549-E552 IonicContact NH2-OE1 2.89Å; R549-E552 PolarHBondContact NH2-OE1 3.24Å; E552-P554 VanDerWaalsContact C-N 3.31Å; E552-P554 VanDerWaalsContact O-N 3.11Å; E552-E555 HydrophobicContact CB-CG 4.24Å; E552-E555 WeakPolarHBondContact O-CA 3.25Å; E552-E555 VanDerWaalsContact O-CB 3.28Å; E552-E555 WeakPolarHBondContact O-CB 3.37Å; E552-E555 PolarHBondContact O-N 2.96Å; E552-V556 PolarHBondContact O-N 3.01Å; E552-V556 VanDerWaalsContact O-N 3.14Å
553	L	95.2	Very high	83.2	Confident	33 Å²	33	99.9 Å²	99.9	17%	0.173	48%	0.477	C	S	.	.	H	α-helix	trans	-50.8	-39.1	-174.2	-173.4	59.9	0	0	0	114.8	V556 I557 L575 L578 I585 E588 I589	L553-V556 PolarHBondContact O-N 2.94Å; L553-I557 HydrophobicContact CD1-CD1 4.29Å; L553-I557 HydrophobicContact CG-CD1 4.11Å; L553-I557 VanDerWaalsContact O-CG1 3.32Å; L553-I557 WeakPolarHBondContact O-CG1 3.45Å; L553-I557 PolarHBondContact O-N 3.34Å; L553-I557 VanDerWaalsContact O-N 3.08Å; L553-L575 HydrophobicContact CD1-CD2 3.51Å; L553-L578 HydrophobicContact CD1-CD1 4.1Å; L553-I585 HydrophobicContact CD2-CG2 4.44Å; L553-E588 HydrophobicContact CD2-CB 4.02Å; L553-E588 HydrophobicContact CD2-CG 3.65Å; L553-I589 HydrophobicContact CD1-CD1 4.18Å; L553-I589 HydrophobicContact CD1-CG1 3.81Å; L553-I589 HydrophobicContact CD2-CG1 4.17Å; L553-I589 HydrophobicContact CG-CG1 4.36Å
554	P	96.8	Very high	85.5	Confident	68 Å²	68	100.6 Å²	100.6	44%	0.442	47%	0.469	S	S	.	.	H	α-helix	trans	-64.7	-36.9	173.3	-18.3	31.6	0	0	0	113.7	E552 I557 Q558 Q592	E552-P554 VanDerWaalsContact C-N 3.31Å; E552-P554 VanDerWaalsContact O-N 3.11Å; P554-I557 PolarHBondContact O-N 3.43Å; P554-Q558 WeakPolarHBondContact O-CB 3.29Å; P554-Q558 PolarHBondContact O-N 2.9Å; P554-Q592 VanDerWaalsContact CA-OE1 3.26Å
555	E	96.4	Very high	87.5	Confident	57 Å²	57	92.6 Å²	92.6	27%	0.266	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-45.5	176.9	-56.7	177.5	-164.6	0	0	110.1	R549 P551 E552 I557 Q558 M559	R549-E555 IonicContact CZ-OE1 3.67Å; R549-E555 VanDerWaalsContact CZ-OE1 3.27Å; R549-E555 IonicContact CZ-OE2 3.4Å; R549-E555 VanDerWaalsContact NH1-CD 3.27Å; R549-E555 IonicContact NH1-OE1 2.87Å; R549-E555 PolarHBondContact NH1-OE1 3.36Å; R549-E555 IonicContact NH1-OE2 3.24Å; R549-E555 PolarHBondContact NH1-OE2 3Å; R549-E555 IonicContact NH2-OE1 3.61Å; R549-E555 PolarHBondContact NH2-OE1 3.45Å; R549-E555 IonicContact NH2-OE2 2.71Å; P551-E555 HydrophobicContact CB-CB 4.38Å; E552-E555 HydrophobicContact CB-CG 4.24Å; E552-E555 WeakPolarHBondContact O-CA 3.25Å; E552-E555 VanDerWaalsContact O-CB 3.28Å; E552-E555 WeakPolarHBondContact O-CB 3.37Å; E552-E555 PolarHBondContact O-N 2.96Å; E555-I557 PolarHBondContact O-N 3.26Å; E555-Q558 WeakPolarHBondContact O-CB 3.26Å; E555-Q558 PolarHBondContact O-N 3.46Å; E555-M559 HydrophobicContact CB-CE 4.2Å; E555-M559 VanDerWaalsContact O-CG 3.3Å; E555-M559 WeakPolarHBondContact O-CG 3.49Å; E555-M559 PolarHBondContact O-N 2.89Å
556	V	97.6	Very high	89.8	Confident	1 Å²	1	89.5 Å²	89.5	1%	0.006	44%	0.437	C	S	.	.	H	α-helix	trans	-63.1	-42.3	178.3	-173.5	0	0	0	0	111.5	P551 E552 L553 Q558 M559 L560 A571 Y574 L575	P551-V556 HydrophobicContact CB-CG2 3.8Å; P551-V556 HydrophobicContact CG-CG2 3.56Å; E552-V556 PolarHBondContact O-N 3.01Å; E552-V556 VanDerWaalsContact O-N 3.14Å; L553-V556 PolarHBondContact O-N 2.94Å; V556-Q558 VanDerWaalsContact C-N 3.29Å; V556-Q558 PolarHBondContact O-N 3.49Å; V556-M559 WeakPolarHBondContact O-CB 3.29Å; V556-M559 PolarHBondContact O-N 3.46Å; V556-M559 VanDerWaalsContact O-N 3.16Å; V556-L560 PolarHBondContact O-N 3.36Å; V556-A571 HydrophobicContact CG1-CB 4.05Å; V556-Y574 HydrophobicContact CB-CD1 4.47Å; V556-Y574 HydrophobicContact CG1-CD1 3.97Å; V556-Y574 HydrophobicContact CG2-CD1 3.7Å; V556-Y574 HydrophobicContact CG2-CE1 3.83Å; V556-L575 HydrophobicContact CB-CD2 4.16Å; V556-L575 HydrophobicContact CG1-CD1 4.38Å; V556-L575 HydrophobicContact CG1-CD2 3.65Å; V556-L575 HydrophobicContact CG1-CG 3.67Å
557	I	97.7	Very high	92.1	Very high	8 Å²	8	84.7 Å²	84.7	4%	0.041	42%	0.419	C	S	.	.	H	α-helix	trans	-63.8	-37.2	176.9	-69.6	171.8	0	0	0	110.5	L553 P554 E555 L560 L575 I589 Q592 L597	L553-I557 HydrophobicContact CD1-CD1 4.29Å; L553-I557 HydrophobicContact CG-CD1 4.11Å; L553-I557 VanDerWaalsContact O-CG1 3.32Å; L553-I557 WeakPolarHBondContact O-CG1 3.45Å; L553-I557 PolarHBondContact O-N 3.34Å; L553-I557 VanDerWaalsContact O-N 3.08Å; P554-I557 PolarHBondContact O-N 3.43Å; E555-I557 PolarHBondContact O-N 3.26Å; I557-L560 WeakPolarHBondContact O-CB 3.47Å; I557-L560 PolarHBondContact O-N 3.02Å; I557-L575 HydrophobicContact CG1-CD1 4.27Å; I557-L575 HydrophobicContact CG1-CD2 4.31Å; I557-I589 HydrophobicContact CD1-CB 4.4Å; I557-I589 HydrophobicContact CD1-CG1 4.12Å; I557-I589 HydrophobicContact CD1-CG2 4.43Å; I557-Q592 HydrophobicContact CD1-CB 3.78Å; I557-Q592 HydrophobicContact CD1-CG 4.46Å; I557-L597 HydrophobicContact CG2-CD1 3.89Å; I557-L597 WeakPolarHBondContact O-CD1 3.32Å
558	Q	97.4	Very high	94.3	Very high	143 Å²	143	83.3 Å²	83.3	67%	0.668	40%	0.398	S	S	*	.	H	α-helix	trans	-67.7	-36.6	172.7	-167.4	177.3	14.3	0	0	112.7	P554 E555 V556 L560 Q561	P554-Q558 WeakPolarHBondContact O-CB 3.29Å; P554-Q558 PolarHBondContact O-N 2.9Å; E555-Q558 WeakPolarHBondContact O-CB 3.26Å; E555-Q558 PolarHBondContact O-N 3.46Å; V556-Q558 VanDerWaalsContact C-N 3.29Å; V556-Q558 PolarHBondContact O-N 3.49Å; Q558-L560 PolarHBondContact O-N 2.96Å; Q558-Q561 PolarHBondContact O-N 3.02Å
559	M	97.9	Very high	95.6	Very high	68 Å²	68	70.9 Å²	70.9	34%	0.335	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-21.4	177.4	-71.5	174.9	-161	0	0	113.7	P551 E555 V556 Q561 H562 V567 A571	P551-M559 HydrophobicContact CB-CE 4.08Å; E555-M559 HydrophobicContact CB-CE 4.2Å; E555-M559 VanDerWaalsContact O-CG 3.3Å; E555-M559 WeakPolarHBondContact O-CG 3.49Å; E555-M559 PolarHBondContact O-N 2.89Å; V556-M559 WeakPolarHBondContact O-CB 3.29Å; V556-M559 PolarHBondContact O-N 3.46Å; V556-M559 VanDerWaalsContact O-N 3.16Å; M559-Q561 PolarHBondContact O-N 3.21Å; M559-H562 VanDerWaalsContact O-CB 3.24Å; M559-H562 WeakPolarHBondContact O-CB 3.4Å; M559-H562 PolarHBondContact O-N 3.48Å; M559-V567 HydrophobicContact CB-CG1 4.06Å; M559-V567 HydrophobicContact CG-CG1 4.31Å; M559-A571 HydrophobicContact CB-CB 3.66Å
560	L	98.1	Very high	96.1	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.016	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-26.2	170.9	-61.1	177.2	0	0	0	112.9	V556 I557 Q558 Q568 A571 A572 L575 L597 L598 L601	V556-L560 PolarHBondContact O-N 3.36Å; I557-L560 WeakPolarHBondContact O-CB 3.47Å; I557-L560 PolarHBondContact O-N 3.02Å; Q558-L560 PolarHBondContact O-N 2.96Å; L560-Q568 WeakPolarHBondContact O-CG 3.28Å; L560-Q568 PolarHBondContact O-NE2 3.2Å; L560-A571 HydrophobicContact CD2-CB 3.95Å; L560-A572 HydrophobicContact CD2-CB 3.97Å; L560-L575 HydrophobicContact CD1-CD1 3.81Å; L560-L575 HydrophobicContact CD2-CD1 4.18Å; L560-L575 HydrophobicContact CG-CD1 4.26Å; L560-L597 HydrophobicContact CB-CB 4.19Å; L560-L597 HydrophobicContact CB-CD1 4.4Å; L560-L597 HydrophobicContact CD1-CB 3.75Å; L560-L597 HydrophobicContact CD1-CD1 4.28Å; L560-L598 HydrophobicContact CD1-CD2 3.96Å; L560-L598 HydrophobicContact CD1-CG 3.89Å; L560-L598 HydrophobicContact CD2-CD2 3.83Å; L560-L601 HydrophobicContact CB-CD1 4.34Å; L560-L601 HydrophobicContact CD2-CD1 4.02Å
561	Q	97.6	Very high	96.8	Very high	133 Å²	133	63.6 Å²	63.6	62%	0.621	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	6	178.3	-60.1	-174.2	-44.8	0	0	113.3	Q558 M559 L597	Q558-Q561 PolarHBondContact O-N 3.02Å; M559-Q561 PolarHBondContact O-N 3.21Å; Q561-L597 HydrophobicContact CG-CD1 4.1Å; Q561-L597 HydrophobicContact CG-CD2 3.96Å; Q561-L597 VanDerWaalsContact NE2-CD2 3.3Å
562	H	97.4	Very high	97.2	Very high	77 Å²	77	62 Å²	62	36%	0.356	31%	0.314	S	S	.	.			trans	-67.9	144.8	-175.6	-159.4	-87.3	0	0	0	112.9	M559 F564 V567 Q568	M559-H562 VanDerWaalsContact O-CB 3.24Å; M559-H562 WeakPolarHBondContact O-CB 3.4Å; M559-H562 PolarHBondContact O-N 3.48Å; H562-F564 AromaticContact CE1-CD2 3.34Å; H562-F564 WeakPolarHBondContact CE1-CD2 3.28Å; H562-F564 AromaticContact CE1-CE2 3.83Å; H562-F564 AromaticContact CE1-CG 4Å; H562-F564 AromaticContact ND1-CD2 3.6Å; H562-F564 AromaticContact ND1-CG 3.84Å; H562-F564 PolarHBondContact ND1-N 2.82Å; H562-F564 PolarHBondContact O-N 3.08Å; H562-V567 HydrophobicContact CB-CB 3.92Å; H562-V567 HydrophobicContact CB-CG1 3.58Å; H562-Q568 HydrophobicContact CB-CG 4.48Å; H562-Q568 WeakPolarHBondContact O-CG 3.32Å; H562-Q568 PolarHBondContact O-NE2 3.47Å
563	Q	96.3	Very high	97.4	Very high	181 Å²	181	58.2 Å²	58.2	85%	0.846	30%	0.303	S	S	*	.	S	Bend	trans	-65.4	-3.7	-179	-64.6	-177.2	80.1	0	0	115.2
564	F	97.1	Very high	97.6	Very high	127 Å²	127	59.5 Å²	59.5	56%	0.557	31%	0.306	S	S	*	.	S	Bend	trans	-115.6	116.7	-177.5	-63.8	-38.3	0	0	0	110.1	H562 S566 V567 Q568	H562-F564 AromaticContact CE1-CD2 3.34Å; H562-F564 WeakPolarHBondContact CE1-CD2 3.28Å; H562-F564 AromaticContact CE1-CE2 3.83Å; H562-F564 AromaticContact CE1-CG 4Å; H562-F564 AromaticContact ND1-CD2 3.6Å; H562-F564 AromaticContact ND1-CG 3.84Å; H562-F564 PolarHBondContact ND1-N 2.82Å; H562-F564 PolarHBondContact O-N 3.08Å; F564-S566 PolarHBondContact O-N 3.08Å; F564-S566 VanDerWaalsContact O-N 3.1Å; F564-V567 HydrophobicContact CB-CB 4.41Å; F564-V567 HydrophobicContact CB-CG2 4.02Å; F564-V567 HydrophobicContact CD2-CG2 4.44Å; F564-V567 WeakPolarHBondContact O-CB 3.39Å; F564-V567 PolarHBondContact O-N 2.87Å; F564-Q568 PolarHBondContact O-N 2.9Å
565	P	97.1	Very high	97.6	Very high	38 Å²	38	56.2 Å²	56.2	25%	0.247	29%	0.285	C	S	.	.	H	α-helix	trans	-53.5	-31.7	-179.3	-33.3	38.8	0	0	0	115.4	Q568 S569 M606 V609	P565-Q568 PolarHBondContact O-N 3.48Å; P565-S569 VanDerWaalsContact O-CB 3.25Å; P565-S569 WeakPolarHBondContact O-CB 3.42Å; P565-S569 PolarHBondContact O-N 2.98Å; P565-M606 HydrophobicContact CB-CG 4.05Å; P565-M606 HydrophobicContact CG-CG 4.19Å; P565-V609 HydrophobicContact CB-CG2 3.95Å; P565-V609 WeakPolarHBondContact O-CG2 3.41Å
566	S	97.3	Very high	97.7	Very high	67 Å²	67	56.5 Å²	56.5	47%	0.469	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-39	175.2	48.1	0	0	0	0	112.7	F564 N570	F564-S566 PolarHBondContact O-N 3.08Å; F564-S566 VanDerWaalsContact O-N 3.1Å; S566-N570 VanDerWaalsContact O-CB 3.3Å; S566-N570 WeakPolarHBondContact O-CB 3.47Å; S566-N570 PolarHBondContact O-N 2.98Å; S566-N570 PolarHBondContact O-ND2 3.48Å
567	V	97.6	Very high	97.7	Very high	41 Å²	41	62.8 Å²	62.8	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-68	-42.2	175	178.9	0	0	0	0	110.3	M559 H562 F564 N570 A571	M559-V567 HydrophobicContact CB-CG1 4.06Å; M559-V567 HydrophobicContact CG-CG1 4.31Å; H562-V567 HydrophobicContact CB-CB 3.92Å; H562-V567 HydrophobicContact CB-CG1 3.58Å; F564-V567 HydrophobicContact CB-CB 4.41Å; F564-V567 HydrophobicContact CB-CG2 4.02Å; F564-V567 HydrophobicContact CD2-CG2 4.44Å; F564-V567 WeakPolarHBondContact O-CB 3.39Å; F564-V567 PolarHBondContact O-N 2.87Å; V567-N570 PolarHBondContact O-N 3.41Å; V567-A571 VanDerWaalsContact O-CB 3.23Å; V567-A571 WeakPolarHBondContact O-CB 3.3Å; V567-A571 PolarHBondContact O-N 2.92Å
568	Q	98.2	Very high	97.5	Very high	24 Å²	24	64.4 Å²	64.4	11%	0.112	32%	0.323	C	S	.	.	H	α-helix	trans	-63.9	-42	176.6	-56.1	-179.3	-71.8	0	0	112	L560 H562 F564 P565 A572 L601	L560-Q568 WeakPolarHBondContact O-CG 3.28Å; L560-Q568 PolarHBondContact O-NE2 3.2Å; H562-Q568 HydrophobicContact CB-CG 4.48Å; H562-Q568 WeakPolarHBondContact O-CG 3.32Å; H562-Q568 PolarHBondContact O-NE2 3.47Å; F564-Q568 PolarHBondContact O-N 2.9Å; P565-Q568 PolarHBondContact O-N 3.48Å; Q568-A572 WeakPolarHBondContact O-CB 3.05Å; Q568-A572 PolarHBondContact O-N 3.43Å; Q568-L601 HydrophobicContact CB-CD2 4.44Å
569	S	98.1	Very high	97.5	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-50.8	176.3	-175.5	0	0	0	0	111.5	P565 A571 A572 A573 E608 S612	P565-S569 VanDerWaalsContact O-CB 3.25Å; P565-S569 WeakPolarHBondContact O-CB 3.42Å; P565-S569 PolarHBondContact O-N 2.98Å; S569-A571 PolarHBondContact O-N 2.63Å; S569-A572 PolarHBondContact O-N 3.41Å; S569-A573 WeakPolarHBondContact O-CB 3.38Å; S569-A573 PolarHBondContact O-N 2.81Å; S569-E608 WeakPolarHBondContact CB-OE1 3.41Å; S569-E608 PolarHBondContact OG-OE1 2.93Å; S569-S612 WeakPolarHBondContact O-CB 3.21Å; S569-S612 PolarHBondContact OG-OG 3.07Å
570	N	97.8	Very high	97.2	Very high	106 Å²	106	61.7 Å²	61.7	57%	0.567	31%	0.308	S	S	*	.	H	α-helix	trans	-62.1	-42	178.3	-72.6	-12.8	0	0	0	112.1	S566 V567 A573 Y574	S566-N570 VanDerWaalsContact O-CB 3.3Å; S566-N570 WeakPolarHBondContact O-CB 3.47Å; S566-N570 PolarHBondContact O-N 2.98Å; S566-N570 PolarHBondContact O-ND2 3.48Å; V567-N570 PolarHBondContact O-N 3.41Å; N570-A573 PolarHBondContact O-N 2.99Å; N570-Y574 WeakPolarHBondContact O-CB 3.38Å; N570-Y574 PolarHBondContact O-N 2.84Å
571	A	98.3	Very high	96.7	Very high	5 Å²	5	64.5 Å²	64.5	4%	0.041	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-44.5	175.7	0	0	0	0	0	111.8	V556 M559 L560 V567 S569 Y574 L575	V556-A571 HydrophobicContact CG1-CB 4.05Å; M559-A571 HydrophobicContact CB-CB 3.66Å; L560-A571 HydrophobicContact CD2-CB 3.95Å; V567-A571 VanDerWaalsContact O-CB 3.23Å; V567-A571 WeakPolarHBondContact O-CB 3.3Å; V567-A571 PolarHBondContact O-N 2.92Å; S569-A571 PolarHBondContact O-N 2.63Å; A571-Y574 PolarHBondContact O-N 3.02Å; A571-L575 WeakPolarHBondContact O-CG 3.46Å; A571-L575 PolarHBondContact O-N 3.42Å
572	A	98.5	Very high	96.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-40.1	175.2	0	0	0	0	0	112.4	L560 Q568 S569 L575 Q576 L598 A616	L560-A572 HydrophobicContact CD2-CB 3.97Å; Q568-A572 WeakPolarHBondContact O-CB 3.05Å; Q568-A572 PolarHBondContact O-N 3.43Å; S569-A572 PolarHBondContact O-N 3.41Å; A572-L575 PolarHBondContact O-N 3.2Å; A572-Q576 WeakPolarHBondContact O-CB 3.34Å; A572-Q576 PolarHBondContact O-N 3.38Å; A572-L598 HydrophobicContact CB-CD2 3.88Å; A572-A616 WeakPolarHBondContact O-CB 3.32Å
573	A	98.1	Very high	96.4	Very high	39 Å²	39	61 Å²	61	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-65.8	-37.3	175.5	0	0	0	0	0	112.6	S569 N570 Q576 H577	S569-A573 WeakPolarHBondContact O-CB 3.38Å; S569-A573 PolarHBondContact O-N 2.81Å; N570-A573 PolarHBondContact O-N 2.99Å; A573-Q576 WeakPolarHBondContact O-CB 3.41Å; A573-Q576 PolarHBondContact O-N 3.03Å; A573-H577 PolarHBondContact O-N 3.41Å
574	Y	97.8	Very high	96.4	Very high	60 Å²	60	60.8 Å²	60.8	24%	0.235	32%	0.322	C	S	.	.	H	α-helix	trans	-66.9	-43.3	173.5	-168	-101.1	0	0	0	111.1	D550 P551 V556 N570 A571 Q576 H577 L578	D550-Y574 WeakPolarHBondContact CB-OH 3.32Å; D550-Y574 PolarHBondContact OD1-OH 2.86Å; P551-Y574 HydrophobicContact CG-CD1 4.45Å; P551-Y574 HydrophobicContact CG-CE1 3.97Å; V556-Y574 HydrophobicContact CB-CD1 4.47Å; V556-Y574 HydrophobicContact CG1-CD1 3.97Å; V556-Y574 HydrophobicContact CG2-CD1 3.7Å; V556-Y574 HydrophobicContact CG2-CE1 3.83Å; N570-Y574 WeakPolarHBondContact O-CB 3.38Å; N570-Y574 PolarHBondContact O-N 2.84Å; A571-Y574 PolarHBondContact O-N 3.02Å; Y574-Q576 VanDerWaalsContact C-N 3.3Å; Y574-Q576 PolarHBondContact O-N 3.41Å; Y574-H577 WeakPolarHBondContact O-CB 3.31Å; Y574-H577 PolarHBondContact O-N 3.12Å; Y574-L578 HydrophobicContact CD1-CD1 3.76Å; Y574-L578 HydrophobicContact CD1-CG 4.1Å; Y574-L578 HydrophobicContact CE1-CD1 3.54Å; Y574-L578 HydrophobicContact CE1-CD2 4.34Å; Y574-L578 HydrophobicContact CE1-CG 4Å; Y574-L578 WeakPolarHBondContact O-CG 3.31Å; Y574-L578 PolarHBondContact O-N 3.43Å
575	L	98	Very high	96.4	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.2	-36.9	171.1	-66.6	-179	0	0	0	112.4	L553 V556 I557 L560 A571 A572 H577 L578 C579 I589 L598 A616	L553-L575 HydrophobicContact CD1-CD2 3.51Å; V556-L575 HydrophobicContact CB-CD2 4.16Å; V556-L575 HydrophobicContact CG1-CD1 4.38Å; V556-L575 HydrophobicContact CG1-CD2 3.65Å; V556-L575 HydrophobicContact CG1-CG 3.67Å; I557-L575 HydrophobicContact CG1-CD1 4.27Å; I557-L575 HydrophobicContact CG1-CD2 4.31Å; L560-L575 HydrophobicContact CD1-CD1 3.81Å; L560-L575 HydrophobicContact CD2-CD1 4.18Å; L560-L575 HydrophobicContact CG-CD1 4.26Å; A571-L575 WeakPolarHBondContact O-CG 3.46Å; A571-L575 PolarHBondContact O-N 3.42Å; A572-L575 PolarHBondContact O-N 3.2Å; L575-H577 VanDerWaalsContact C-N 3.34Å; L575-L578 PolarHBondContact O-N 3.15Å; L575-C579 VanDerWaalsContact O-CB 3.28Å; L575-C579 WeakPolarHBondContact O-CB 3.17Å; L575-C579 PolarHBondContact O-N 3.36Å; L575-C579 PolarHBondContact O-SG 3.16Å; L575-I589 HydrophobicContact CD2-CD1 3.93Å; L575-I589 HydrophobicContact CD2-CG1 4.24Å; L575-L598 HydrophobicContact CD1-CD1 4.28Å; L575-A616 HydrophobicContact CB-CB 4.48Å
576	Q	97.8	Very high	96.5	Very high	63 Å²	63	55.1 Å²	55.1	29%	0.294	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-43.3	174	178.9	179.6	-6.5	0	0	111.7	A572 A573 Y574 G615 A616 N619	A572-Q576 WeakPolarHBondContact O-CB 3.34Å; A572-Q576 PolarHBondContact O-N 3.38Å; A573-Q576 WeakPolarHBondContact O-CB 3.41Å; A573-Q576 PolarHBondContact O-N 3.03Å; Y574-Q576 VanDerWaalsContact C-N 3.3Å; Y574-Q576 PolarHBondContact O-N 3.41Å; Q576-G615 VanDerWaalsContact CD-C 3.48Å; Q576-G615 VanDerWaalsContact CD-CA 3.5Å; Q576-A616 HydrophobicContact CB-CB 4.14Å; Q576-N619 PolarHBondContact O-ND2 3.37Å
577	H	96.6	Very high	96.5	Very high	133 Å²	133	53.7 Å²	53.7	62%	0.616	29%	0.287	S	S	*	.	H	α-helix	trans	-63.9	-52.4	175	175.1	69.9	0	0	0	111.6	A573 Y574 L575 C579 F580	A573-H577 PolarHBondContact O-N 3.41Å; Y574-H577 WeakPolarHBondContact O-CB 3.31Å; Y574-H577 PolarHBondContact O-N 3.12Å; L575-H577 VanDerWaalsContact C-N 3.34Å; H577-C579 PolarHBondContact O-N 3.18Å; H577-F580 VanDerWaalsContact O-CB 3.24Å; H577-F580 WeakPolarHBondContact O-CB 3.42Å; H577-F580 PolarHBondContact O-N 3.14Å
578	L	95.4	Very high	96.5	Very high	41 Å²	41	54.2 Å²	54.2	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-27	178.6	-66.4	-175.8	0	0	0	113.2	L553 Y574 L575 F580 I585	L553-L578 HydrophobicContact CD1-CD1 4.1Å; Y574-L578 HydrophobicContact CD1-CD1 3.76Å; Y574-L578 HydrophobicContact CD1-CG 4.1Å; Y574-L578 HydrophobicContact CE1-CD1 3.54Å; Y574-L578 HydrophobicContact CE1-CD2 4.34Å; Y574-L578 HydrophobicContact CE1-CG 4Å; Y574-L578 WeakPolarHBondContact O-CG 3.31Å; Y574-L578 PolarHBondContact O-N 3.43Å; L575-L578 PolarHBondContact O-N 3.15Å; L578-F580 VanDerWaalsContact C-N 3.26Å; L578-F580 PolarHBondContact O-N 3.03Å; L578-I585 HydrophobicContact CB-CD1 4.37Å; L578-I585 HydrophobicContact CB-CG2 3.96Å
579	C	95.7	Very high	96.5	Very high	1 Å²	1	53 Å²	53	1%	0.007	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	3.3	174	-69	0	0	0	0	114.4	L575 H577 K586 I589 N619 L620	L575-C579 VanDerWaalsContact O-CB 3.28Å; L575-C579 WeakPolarHBondContact O-CB 3.17Å; L575-C579 PolarHBondContact O-N 3.36Å; L575-C579 PolarHBondContact O-SG 3.16Å; H577-C579 PolarHBondContact O-N 3.18Å; C579-K586 HydrophobicContact CB-CG 4.11Å; C579-K586 WeakPolarHBondContact O-CE 3.39Å; C579-K586 PolarHBondContact O-NZ 3.47Å; C579-I589 WeakPolarHBondContact SG-CD1 3.41Å; C579-N619 HydrophobicContact CB-CB 3.65Å; C579-L620 WeakPolarHBondContact SG-CD2 3.42Å
580	F	92.9	Very high	96.5	Very high	154 Å²	154	57 Å²	57	68%	0.675	30%	0.295	S	S	*	.	S	Bend	trans	-82	118.4	176.6	-166.8	-98.9	0	0	0	110.7	H577 L578 D582	H577-F580 VanDerWaalsContact O-CB 3.24Å; H577-F580 WeakPolarHBondContact O-CB 3.42Å; H577-F580 PolarHBondContact O-N 3.14Å; L578-F580 VanDerWaalsContact C-N 3.26Å; L578-F580 PolarHBondContact O-N 3.03Å; F580-D582 PolarHBondContact O-N 3.49Å
581	G	86.1	Confident	96.5	Very high	62 Å²	62	60.7 Å²	60.7	64%	0.639	30%	0.301	S	S	*	.	S	Bend	trans	76.3	-44.3	-179.9	0	0	0	0	0	115.8
582	D	93.4	Very high	96.5	Very high	61 Å²	61	63.3 Å²	63.3	33%	0.326	31%	0.313	S	S	.	.			trans	-75.8	130.6	-175.3	-164.7	-56.1	0	0	0	112.5	F580 K584 I585 K586	F580-D582 PolarHBondContact O-N 3.49Å; D582-K584 VanDerWaalsContact OD1-CA 3.3Å; D582-K584 WeakPolarHBondContact OD1-CA 3.33Å; D582-K584 VanDerWaalsContact OD1-CB 3.32Å; D582-K584 WeakPolarHBondContact OD1-CB 3.37Å; D582-K584 PolarHBondContact OD1-N 3.1Å; D582-I585 HydrophobicContact CB-CB 4.22Å; D582-I585 HydrophobicContact CB-CD1 3.98Å; D582-I585 HydrophobicContact CB-CG1 4.2Å; D582-I585 PolarHBondContact OD1-N 2.94Å; D582-K586 WeakPolarHBondContact O-CD 3.23Å; D582-K586 WeakPolarHBondContact O-CE 3.44Å; D582-K586 VanDerWaalsContact O-CG 3.28Å; D582-K586 WeakPolarHBondContact O-CG 3.37Å
583	N	96.2	Very high	96.5	Very high	74 Å²	74	65 Å²	65	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-100.4	-20.5	176	-61.1	-57	0	0	0	113.8	A587 N626	N583-A587 WeakPolarHBondContact O-CB 3.47Å; N583-A587 PolarHBondContact O-N 3.19Å; N583-A587 VanDerWaalsContact O-N 3.1Å; N583-N626 PolarHBondContact OD1-ND2 3.39Å
584	K	96.7	Very high	96.5	Very high	177 Å²	177	63.2 Å²	63.2	77%	0.77	32%	0.315	S	S	*	.	H	α-helix	trans	-67.2	-47.9	173.4	-61.6	176.9	178.9	176	0	109.9	D582 K586 A587 E588	D582-K584 VanDerWaalsContact OD1-CA 3.3Å; D582-K584 WeakPolarHBondContact OD1-CA 3.33Å; D582-K584 VanDerWaalsContact OD1-CB 3.32Å; D582-K584 WeakPolarHBondContact OD1-CB 3.37Å; D582-K584 PolarHBondContact OD1-N 3.1Å; K584-K586 VanDerWaalsContact C-N 3.32Å; K584-K586 PolarHBondContact O-N 2.8Å; K584-A587 PolarHBondContact O-N 2.95Å; K584-E588 WeakPolarHBondContact O-CB 3.23Å; K584-E588 PolarHBondContact O-N 3.22Å
585	I	96.9	Very high	96.5	Very high	42 Å²	42	60.5 Å²	60.5	22%	0.215	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-44.8	176.9	-69.9	177.2	0	0	0	110.6	L553 L578 D582 A587 E588 I589	L553-I585 HydrophobicContact CD2-CG2 4.44Å; L578-I585 HydrophobicContact CB-CD1 4.37Å; L578-I585 HydrophobicContact CB-CG2 3.96Å; D582-I585 HydrophobicContact CB-CB 4.22Å; D582-I585 HydrophobicContact CB-CD1 3.98Å; D582-I585 HydrophobicContact CB-CG1 4.2Å; D582-I585 PolarHBondContact OD1-N 2.94Å; I585-A587 PolarHBondContact O-N 2.74Å; I585-E588 PolarHBondContact O-N 3.41Å; I585-I589 HydrophobicContact CG2-CD1 3.75Å; I585-I589 HydrophobicContact CG2-CG1 4.45Å; I585-I589 WeakPolarHBondContact O-CG1 3.33Å; I585-I589 PolarHBondContact O-N 2.71Å
586	K	98.1	Very high	96.5	Very high	5 Å²	5	63.8 Å²	63.8	2%	0.022	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-44.6	177	-61.9	173.5	-173.1	-172	0	112.5	C579 D582 K584 E588 I589 R590 N619 L620 N629	C579-K586 HydrophobicContact CB-CG 4.11Å; C579-K586 WeakPolarHBondContact O-CE 3.39Å; C579-K586 PolarHBondContact O-NZ 3.47Å; D582-K586 WeakPolarHBondContact O-CD 3.23Å; D582-K586 WeakPolarHBondContact O-CE 3.44Å; D582-K586 VanDerWaalsContact O-CG 3.28Å; D582-K586 WeakPolarHBondContact O-CG 3.37Å; K584-K586 VanDerWaalsContact C-N 3.32Å; K584-K586 PolarHBondContact O-N 2.8Å; K586-E588 VanDerWaalsContact C-N 3.27Å; K586-E588 PolarHBondContact O-N 2.83Å; K586-I589 PolarHBondContact O-N 2.89Å; K586-R590 PolarHBondContact O-N 2.71Å; K586-R590 VanDerWaalsContact O-N 3.08Å; K586-N619 WeakPolarHBondContact CE-O 3.39Å; K586-N619 PolarHBondContact NZ-O 3.48Å; K586-L620 HydrophobicContact CB-CD2 4.03Å; K586-L620 HydrophobicContact CG-CD2 4.17Å; K586-N629 WeakPolarHBondContact CB-ND2 3.37Å
587	A	97.9	Very high	96.6	Very high	36 Å²	36	62.3 Å²	62.3	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-33.8	176.3	0	0	0	0	0	112	N583 K584 I585 R590 R591	N583-A587 WeakPolarHBondContact O-CB 3.47Å; N583-A587 PolarHBondContact O-N 3.19Å; N583-A587 VanDerWaalsContact O-N 3.1Å; K584-A587 PolarHBondContact O-N 2.95Å; I585-A587 PolarHBondContact O-N 2.74Å; A587-R590 WeakPolarHBondContact O-CB 3.45Å; A587-R590 PolarHBondContact O-N 3.19Å; A587-R591 PolarHBondContact O-N 3.02Å
588	E	97.8	Very high	96.7	Very high	52 Å²	52	56 Å²	56	24%	0.243	29%	0.285	C	S	.	.	H	α-helix	trans	-73.4	-41.1	177.1	-174.1	56.7	-157.2	0	0	112.5	L553 K584 I585 K586 R590 R591 Q592	L553-E588 HydrophobicContact CD2-CB 4.02Å; L553-E588 HydrophobicContact CD2-CG 3.65Å; K584-E588 WeakPolarHBondContact O-CB 3.23Å; K584-E588 PolarHBondContact O-N 3.22Å; I585-E588 PolarHBondContact O-N 3.41Å; K586-E588 VanDerWaalsContact C-N 3.27Å; K586-E588 PolarHBondContact O-N 2.83Å; E588-R590 VanDerWaalsContact C-N 3.26Å; E588-R590 PolarHBondContact O-N 2.92Å; E588-R591 VanDerWaalsContact CD-NE 3.35Å; E588-R591 WeakPolarHBondContact O-CA 3.32Å; E588-R591 WeakPolarHBondContact O-CB 3.41Å; E588-R591 PolarHBondContact O-N 3.22Å; E588-R591 IonicContact OE1-CZ 3.56Å; E588-R591 IonicContact OE1-NE 3.8Å; E588-R591 PolarHBondContact OE1-NE 3.26Å; E588-R591 IonicContact OE1-NH2 3.12Å; E588-R591 PolarHBondContact OE1-NH2 2.75Å; E588-R591 IonicContact OE2-CZ 2.7Å; E588-R591 IonicContact OE2-NE 2.61Å; E588-R591 PolarHBondContact OE2-NE 2.68Å; E588-R591 IonicContact OE2-NH2 3.35Å; E588-Q592 PolarHBondContact O-N 3.17Å; E588-Q592 PolarHBondContact OE1-NE2 3.36Å
589	I	98.4	Very high	96.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-38.6	171.5	-68.4	160.7	0	0	0	110.8	L553 I557 L575 C579 I585 K586 G593 G594 L620	L553-I589 HydrophobicContact CD1-CD1 4.18Å; L553-I589 HydrophobicContact CD1-CG1 3.81Å; L553-I589 HydrophobicContact CD2-CG1 4.17Å; L553-I589 HydrophobicContact CG-CG1 4.36Å; I557-I589 HydrophobicContact CD1-CB 4.4Å; I557-I589 HydrophobicContact CD1-CG1 4.12Å; I557-I589 HydrophobicContact CD1-CG2 4.43Å; L575-I589 HydrophobicContact CD2-CD1 3.93Å; L575-I589 HydrophobicContact CD2-CG1 4.24Å; C579-I589 WeakPolarHBondContact SG-CD1 3.41Å; I585-I589 HydrophobicContact CG2-CD1 3.75Å; I585-I589 HydrophobicContact CG2-CG1 4.45Å; I585-I589 WeakPolarHBondContact O-CG1 3.33Å; I585-I589 PolarHBondContact O-N 2.71Å; K586-I589 PolarHBondContact O-N 2.89Å; I589-G593 PolarHBondContact O-N 2.83Å; I589-G594 PolarHBondContact O-N 3.44Å; I589-L620 HydrophobicContact CB-CD2 3.93Å; I589-L620 HydrophobicContact CD1-CD2 3.97Å; I589-L620 HydrophobicContact CG2-CD1 4.16Å; I589-L620 HydrophobicContact CG2-CD2 3.81Å
590	R	98.4	Very high	97	Very high	85 Å²	85	58.5 Å²	58.5	32%	0.321	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-47.9	169.6	177.8	-178.1	59.8	136.1	-11.4	111.6	K586 A587 E588 Q592 G593 I595 D628 N629 A632	K586-R590 PolarHBondContact O-N 2.71Å; K586-R590 VanDerWaalsContact O-N 3.08Å; A587-R590 WeakPolarHBondContact O-CB 3.45Å; A587-R590 PolarHBondContact O-N 3.19Å; E588-R590 VanDerWaalsContact C-N 3.26Å; E588-R590 PolarHBondContact O-N 2.92Å; R590-Q592 VanDerWaalsContact C-N 3.26Å; R590-Q592 PolarHBondContact O-N 3.23Å; R590-G593 PolarHBondContact O-N 3.28Å; R590-I595 HydrophobicContact CB-CD1 3.72Å; R590-I595 HydrophobicContact CB-CG1 4.48Å; R590-I595 HydrophobicContact CG-CD1 4.04Å; R590-D628 IonicContact CZ-OD2 2.7Å; R590-D628 IonicContact NH1-OD1 3.47Å; R590-D628 IonicContact NH1-OD2 3.27Å; R590-D628 PolarHBondContact NH1-OD2 3.37Å; R590-D628 IonicContact NH2-OD2 3.42Å; R590-D628 PolarHBondContact NH2-OD2 3.3Å; R590-N629 WeakPolarHBondContact CD-OD1 3.23Å; R590-N629 PolarHBondContact NE-OD1 3.24Å; R590-A632 HydrophobicContact CG-CB 4.05Å
591	R	98	Very high	97.2	Very high	184 Å²	184	51.8 Å²	51.8	69%	0.694	27%	0.27	S	S	*	.	H	α-helix	trans	-59.4	-36.8	-178.4	-166.4	-177.5	73.9	93.2	0.6	112.4	A587 E588 G593	A587-R591 PolarHBondContact O-N 3.02Å; E588-R591 VanDerWaalsContact CD-NE 3.35Å; E588-R591 WeakPolarHBondContact O-CA 3.32Å; E588-R591 WeakPolarHBondContact O-CB 3.41Å; E588-R591 PolarHBondContact O-N 3.22Å; E588-R591 IonicContact OE1-CZ 3.56Å; E588-R591 IonicContact OE1-NE 3.8Å; E588-R591 PolarHBondContact OE1-NE 3.26Å; E588-R591 IonicContact OE1-NH2 3.12Å; E588-R591 PolarHBondContact OE1-NH2 2.75Å; E588-R591 IonicContact OE2-CZ 2.7Å; E588-R591 IonicContact OE2-NE 2.61Å; E588-R591 PolarHBondContact OE2-NE 2.68Å; E588-R591 IonicContact OE2-NH2 3.35Å; R591-G593 VanDerWaalsContact C-N 3.31Å
592	Q	97.7	Very high	97.8	Very high	61 Å²	61	48.8 Å²	48.8	29%	0.285	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6.5	176.9	-61.7	-172.7	33.9	0	0	113.9	P554 I557 E588 R590 G594	P554-Q592 VanDerWaalsContact CA-OE1 3.26Å; I557-Q592 HydrophobicContact CD1-CB 3.78Å; I557-Q592 HydrophobicContact CD1-CG 4.46Å; E588-Q592 PolarHBondContact O-N 3.17Å; E588-Q592 PolarHBondContact OE1-NE2 3.36Å; R590-Q592 VanDerWaalsContact C-N 3.26Å; R590-Q592 PolarHBondContact O-N 3.23Å; Q592-G594 VanDerWaalsContact C-N 3.28Å; Q592-G594 PolarHBondContact O-N 3.3Å
593	G	97.6	Very high	97.9	Very high	36 Å²	36	49 Å²	49	37%	0.371	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.9	175.6	0	0	0	0	0	115.7	I589 R590 R591 I595 Q596	I589-G593 PolarHBondContact O-N 2.83Å; R590-G593 PolarHBondContact O-N 3.28Å; R591-G593 VanDerWaalsContact C-N 3.31Å; G593-I595 PolarHBondContact O-N 2.74Å; G593-Q596 PolarHBondContact O-N 2.7Å
594	G	98.4	Very high	97.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-20.4	-176.2	0	0	0	0	0	114.8	I589 Q592 Q596 L597 L598	I589-G594 PolarHBondContact O-N 3.44Å; Q592-G594 VanDerWaalsContact C-N 3.28Å; Q592-G594 PolarHBondContact O-N 3.3Å; G594-Q596 VanDerWaalsContact C-N 3.34Å; G594-Q596 PolarHBondContact O-N 3.02Å; G594-L597 PolarHBondContact O-N 3.19Å; G594-L598 WeakPolarHBondContact O-CG 3.09Å; G594-L598 PolarHBondContact O-N 3.48Å
595	I	98.7	Very high	97.8	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-38.2	171.9	-64.8	-179.1	0	0	0	111.8	R590 G593 V599 L620 N629 A632 L633	R590-I595 HydrophobicContact CB-CD1 3.72Å; R590-I595 HydrophobicContact CB-CG1 4.48Å; R590-I595 HydrophobicContact CG-CD1 4.04Å; G593-I595 PolarHBondContact O-N 2.74Å; I595-V599 WeakPolarHBondContact O-CG2 3.35Å; I595-V599 PolarHBondContact O-N 2.93Å; I595-L620 HydrophobicContact CG1-CD1 4.39Å; I595-N629 HydrophobicContact CD1-CB 3.98Å; I595-A632 HydrophobicContact CD1-CB 3.97Å; I595-L633 HydrophobicContact CG2-CB 4Å
596	Q	98.5	Very high	97.8	Very high	69 Å²	69	51.3 Å²	51.3	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-48	176.6	-175.9	64.6	62.6	0	0	110.1	G593 G594 L598 V599 D600 C636	G593-Q596 PolarHBondContact O-N 2.7Å; G594-Q596 VanDerWaalsContact C-N 3.34Å; G594-Q596 PolarHBondContact O-N 3.02Å; Q596-L598 VanDerWaalsContact C-N 3.32Å; Q596-L598 PolarHBondContact O-N 2.76Å; Q596-V599 CarbonylContact O-C 2.89Å; Q596-V599 WeakPolarHBondContact O-CA 3.3Å; Q596-V599 WeakPolarHBondContact O-CB 3.39Å; Q596-V599 PolarHBondContact O-N 3.45Å; Q596-D600 PolarHBondContact NE2-OD1 2.98Å; Q596-D600 PolarHBondContact O-N 2.87Å; Q596-C636 PolarHBondContact NE2-O 2.87Å; Q596-C636 VanDerWaalsContact OE1-CA 3.32Å; Q596-C636 PolarHBondContact OE1-SG 2.96Å
597	L	98.6	Very high	97.7	Very high	31 Å²	31	54.6 Å²	54.6	16%	0.162	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-42.9	-179.8	-55.5	-178.1	0	0	0	111.8	I557 L560 Q561 G594 V599 D600 L601	I557-L597 HydrophobicContact CG2-CD1 3.89Å; I557-L597 WeakPolarHBondContact O-CD1 3.32Å; L560-L597 HydrophobicContact CB-CB 4.19Å; L560-L597 HydrophobicContact CB-CD1 4.4Å; L560-L597 HydrophobicContact CD1-CB 3.75Å; L560-L597 HydrophobicContact CD1-CD1 4.28Å; Q561-L597 HydrophobicContact CG-CD1 4.1Å; Q561-L597 HydrophobicContact CG-CD2 3.96Å; Q561-L597 VanDerWaalsContact NE2-CD2 3.3Å; G594-L597 PolarHBondContact O-N 3.19Å; L597-V599 VanDerWaalsContact C-N 3.32Å; L597-V599 PolarHBondContact O-N 3.36Å; L597-D600 PolarHBondContact O-N 2.83Å; L597-L601 WeakPolarHBondContact O-CG 3.49Å; L597-L601 PolarHBondContact O-N 3.13Å; L597-L601 VanDerWaalsContact O-N 3.11Å
598	L	98.8	Very high	97.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.5	-28.6	175.1	-70.5	170.7	0	0	0	113.4	L560 A572 L575 G594 Q596 L601 A613 A616 L617 L620	L560-L598 HydrophobicContact CD1-CD2 3.96Å; L560-L598 HydrophobicContact CD1-CG 3.89Å; L560-L598 HydrophobicContact CD2-CD2 3.83Å; A572-L598 HydrophobicContact CB-CD2 3.88Å; L575-L598 HydrophobicContact CD1-CD1 4.28Å; G594-L598 WeakPolarHBondContact O-CG 3.09Å; G594-L598 PolarHBondContact O-N 3.48Å; Q596-L598 VanDerWaalsContact C-N 3.32Å; Q596-L598 PolarHBondContact O-N 2.76Å; L598-L601 HydrophobicContact CD2-CD1 4.47Å; L598-A613 HydrophobicContact CD2-CB 4.4Å; L598-A616 HydrophobicContact CD1-CB 3.84Å; L598-A616 HydrophobicContact CD2-CB 3.94Å; L598-L617 HydrophobicContact CB-CD1 4.46Å; L598-L617 HydrophobicContact CB-CD2 3.68Å; L598-L617 HydrophobicContact CB-CG 3.98Å; L598-L617 HydrophobicContact CD1-CD2 4.29Å; L598-L620 HydrophobicContact CD1-CD1 3.37Å
599	V	98.8	Very high	97.6	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	26%	0.257	C	S	.	.	H	α-helix	trans	-73.6	-39.6	171.8	165.3	0	0	0	0	111.3	I595 Q596 L597 L601 L602 L617 L633 C636 A641	I595-V599 WeakPolarHBondContact O-CG2 3.35Å; I595-V599 PolarHBondContact O-N 2.93Å; Q596-V599 CarbonylContact O-C 2.89Å; Q596-V599 WeakPolarHBondContact O-CA 3.3Å; Q596-V599 WeakPolarHBondContact O-CB 3.39Å; Q596-V599 PolarHBondContact O-N 3.45Å; L597-V599 VanDerWaalsContact C-N 3.32Å; L597-V599 PolarHBondContact O-N 3.36Å; V599-L601 VanDerWaalsContact C-N 3.28Å; V599-L601 PolarHBondContact O-N 3.26Å; V599-L602 VanDerWaalsContact O-CB 3.23Å; V599-L602 WeakPolarHBondContact O-CB 3.29Å; V599-L602 WeakPolarHBondContact O-CG 3.43Å; V599-L602 PolarHBondContact O-N 3.24Å; V599-L617 HydrophobicContact CG2-CD1 4.29Å; V599-L617 HydrophobicContact CG2-CD2 4.4Å; V599-L633 HydrophobicContact CG2-CG 4.2Å; V599-C636 HydrophobicContact CB-CB 4.45Å; V599-C636 HydrophobicContact CG1-CB 4.47Å; V599-C636 HydrophobicContact CG2-CB 4.3Å; V599-A641 HydrophobicContact CG1-CB 4.08Å
600	D	98.2	Very high	97.6	Very high	89 Å²	89	55.8 Å²	55.8	48%	0.476	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-35.9	178.2	-59.1	-24.2	0	0	0	111.3	Q596 L597 L602 D603	Q596-D600 PolarHBondContact NE2-OD1 2.98Å; Q596-D600 PolarHBondContact O-N 2.87Å; L597-D600 PolarHBondContact O-N 2.83Å; D600-L602 PolarHBondContact O-N 3.27Å; D600-L602 VanDerWaalsContact O-N 3.16Å; D600-D603 PolarHBondContact O-N 2.9Å
601	L	98.3	Very high	97.6	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-64.2	-11.6	173.8	-68.6	178.9	0	0	0	114.3	L560 Q568 L597 L598 V599 H604 V609 H610 A613	L560-L601 HydrophobicContact CB-CD1 4.34Å; L560-L601 HydrophobicContact CD2-CD1 4.02Å; Q568-L601 HydrophobicContact CB-CD2 4.44Å; L597-L601 WeakPolarHBondContact O-CG 3.49Å; L597-L601 PolarHBondContact O-N 3.13Å; L597-L601 VanDerWaalsContact O-N 3.11Å; L598-L601 HydrophobicContact CD2-CD1 4.47Å; V599-L601 VanDerWaalsContact C-N 3.28Å; V599-L601 PolarHBondContact O-N 3.26Å; L601-H604 VanDerWaalsContact O-CB 3.25Å; L601-H604 WeakPolarHBondContact O-CB 3.17Å; L601-H604 PolarHBondContact O-N 3.13Å; L601-V609 HydrophobicContact CB-CG1 4.01Å; L601-V609 HydrophobicContact CD1-CG1 4.29Å; L601-V609 HydrophobicContact CD2-CG1 3.88Å; L601-V609 HydrophobicContact CG-CG1 4.27Å; L601-H610 PolarHBondContact O-CD2 3.14Å; L601-A613 HydrophobicContact CB-CB 3.91Å; L601-A613 HydrophobicContact CD1-CB 4.47Å
602	L	97.9	Very high	97.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-76	-18.6	177.3	-59	179.8	0	0	0	114.3	V599 D600 A613 C614 L617 A641 L642 L645	V599-L602 VanDerWaalsContact O-CB 3.23Å; V599-L602 WeakPolarHBondContact O-CB 3.29Å; V599-L602 WeakPolarHBondContact O-CG 3.43Å; V599-L602 PolarHBondContact O-N 3.24Å; D600-L602 PolarHBondContact O-N 3.27Å; D600-L602 VanDerWaalsContact O-N 3.16Å; L602-A613 HydrophobicContact CD2-CB 4.29Å; L602-C614 WeakPolarHBondContact CD2-SG 3.45Å; L602-L617 HydrophobicContact CD1-CD1 3.84Å; L602-L617 HydrophobicContact CD2-CD1 4.09Å; L602-L617 HydrophobicContact CG-CD1 4.2Å; L602-A641 HydrophobicContact CB-CB 4.27Å; L602-A641 HydrophobicContact CD1-CB 3.89Å; L602-L642 HydrophobicContact CD1-CD2 3.89Å; L602-L642 HydrophobicContact CD1-CG 3.96Å; L602-L645 HydrophobicContact CB-CD2 4.42Å; L602-L645 HydrophobicContact CD2-CD2 4.04Å
603	D	96.1	Very high	97.7	Very high	64 Å²	64	43.6 Å²	43.6	34%	0.342	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-103.3	19.3	172.8	-86.5	-59.5	0	0	0	112.2	D600 R644 K648	D600-D603 PolarHBondContact O-N 2.9Å; D603-R644 IonicContact OD1-NE 3.6Å; D603-R644 IonicContact OD2-CZ 3.38Å; D603-R644 IonicContact OD2-NE 2.71Å; D603-R644 PolarHBondContact OD2-NE 2.87Å; D603-R644 IonicContact OD2-NH2 2.73Å; D603-R644 PolarHBondContact OD2-NH2 2.9Å; D603-K648 IonicContact OD1-NZ 3.47Å; D603-K648 PolarHBondContact OD1-NZ 2.94Å
604	H	96.6	Very high	97.7	Very high	46 Å²	46	41.9 Å²	41.9	21%	0.213	20%	0.198	C	C	.	.	S	Bend	trans	-68.7	-179.8	172.8	-170.2	-124.9	0	0	0	112.2	L601 M606 V609 H610	L601-H604 VanDerWaalsContact O-CB 3.25Å; L601-H604 WeakPolarHBondContact O-CB 3.17Å; L601-H604 PolarHBondContact O-N 3.13Å; H604-M606 VanDerWaalsContact CE1-CG 3.44Å; H604-M606 WeakPolarHBondContact CE1-CG 3.44Å; H604-M606 PolarHBondContact ND1-N 2.91Å; H604-V609 HydrophobicContact CB-CG1 4.2Å; H604-V609 WeakPolarHBondContact ND1-CB 3.49Å; H604-H610 PolarHBondContact O-NE2 3.01Å
605	R	94.7	Very high	97.7	Very high	212 Å²	212	41.9 Å²	41.9	80%	0.8	20%	0.198	S	C	*	.	S	Bend	trans	-105.5	-9.6	-178	69.3	-177.8	175.8	-163.6	-3.2	115
606	M	96.3	Very high	97.7	Very high	84 Å²	84	41.7 Å²	41.7	41%	0.414	20%	0.197	S	C	.	.			trans	-109.1	125.1	-175.8	-58.2	-62.6	-71.7	0	0	110.7	P565 H604 E608 V609 H610	P565-M606 HydrophobicContact CB-CG 4.05Å; P565-M606 HydrophobicContact CG-CG 4.19Å; H604-M606 VanDerWaalsContact CE1-CG 3.44Å; H604-M606 WeakPolarHBondContact CE1-CG 3.44Å; H604-M606 PolarHBondContact ND1-N 2.91Å; M606-E608 VanDerWaalsContact C-N 3.26Å; M606-E608 PolarHBondContact O-N 2.9Å; M606-V609 HydrophobicContact CB-CB 4.44Å; M606-V609 HydrophobicContact CB-CG2 4.19Å; M606-V609 PolarHBondContact O-N 3.08Å; M606-H610 PolarHBondContact O-N 2.87Å
607	T	95.9	Very high	97.7	Very high	74 Å²	74	38.4 Å²	38.4	45%	0.454	18%	0.182	S	C	.	.	H	α-helix	trans	-61.6	-30	179.6	45.4	0	0	0	0	113.8	H610 R611 I654	T607-H610 VanDerWaalsContact CA-CE1 3.45Å; T607-H610 WeakPolarHBondContact CA-CE1 3.4Å; T607-H610 PolarHBondContact O-N 3.08Å; T607-R611 WeakPolarHBondContact O-CB 3.33Å; T607-R611 PolarHBondContact O-N 2.72Å; T607-R611 PolarHBondContact O-NH1 3.14Å; T607-I654 HydrophobicContact CG2-CD1 4.06Å; T607-I654 WeakPolarHBondContact O-CD1 3.43Å
608	E	96.5	Very high	97.7	Very high	89 Å²	89	40 Å²	40	42%	0.416	19%	0.185	S	C	.	.	H	α-helix	trans	-63	-48.4	174.7	-159.8	-158	125.8	0	0	111.3	S569 M606 H610 R611 S612	S569-E608 WeakPolarHBondContact CB-OE1 3.41Å; S569-E608 PolarHBondContact OG-OE1 2.93Å; M606-E608 VanDerWaalsContact C-N 3.26Å; M606-E608 PolarHBondContact O-N 2.9Å; E608-H610 VanDerWaalsContact C-N 3.33Å; E608-H610 PolarHBondContact O-N 3.44Å; E608-R611 WeakPolarHBondContact O-CB 3.13Å; E608-R611 PolarHBondContact O-N 2.77Å; E608-R611 VanDerWaalsContact O-N 3.15Å; E608-S612 PolarHBondContact O-N 2.97Å; E608-S612 PolarHBondContact O-OG 3.06Å
609	V	98.1	Very high	97.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-39.7	176.3	174.5	0	0	0	0	111.3	P565 L601 H604 M606 R611 A613	P565-V609 HydrophobicContact CB-CG2 3.95Å; P565-V609 WeakPolarHBondContact O-CG2 3.41Å; L601-V609 HydrophobicContact CB-CG1 4.01Å; L601-V609 HydrophobicContact CD1-CG1 4.29Å; L601-V609 HydrophobicContact CD2-CG1 3.88Å; L601-V609 HydrophobicContact CG-CG1 4.27Å; H604-V609 HydrophobicContact CB-CG1 4.2Å; H604-V609 WeakPolarHBondContact ND1-CB 3.49Å; M606-V609 HydrophobicContact CB-CB 4.44Å; M606-V609 HydrophobicContact CB-CG2 4.19Å; M606-V609 PolarHBondContact O-N 3.08Å; V609-R611 PolarHBondContact O-N 3.46Å; V609-A613 WeakPolarHBondContact O-CB 3.26Å; V609-A613 PolarHBondContact O-N 3.04Å
610	H	97.9	Very high	97.7	Very high	24 Å²	24	41.3 Å²	41.3	11%	0.111	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-44.3	173.8	-63.5	155.4	0	0	0	112.5	L601 H604 M606 T607 E608 C614 L645 I654	L601-H610 PolarHBondContact O-CD2 3.14Å; H604-H610 PolarHBondContact O-NE2 3.01Å; M606-H610 PolarHBondContact O-N 2.87Å; T607-H610 VanDerWaalsContact CA-CE1 3.45Å; T607-H610 WeakPolarHBondContact CA-CE1 3.4Å; T607-H610 PolarHBondContact O-N 3.08Å; E608-H610 VanDerWaalsContact C-N 3.33Å; E608-H610 PolarHBondContact O-N 3.44Å; H610-C614 VanDerWaalsContact O-CB 3.23Å; H610-C614 WeakPolarHBondContact O-CB 3.35Å; H610-C614 PolarHBondContact O-N 3.22Å; H610-C614 PolarHBondContact O-SG 2.83Å; H610-L645 HydrophobicContact CB-CD2 4.22Å; H610-I654 HydrophobicContact CB-CD1 3.92Å; H610-I654 HydrophobicContact CB-CG2 4.38Å
611	R	98.1	Very high	97.7	Very high	60 Å²	60	37.1 Å²	37.1	23%	0.226	17%	0.17	C	C	.	.	H	α-helix	trans	-62.2	-53.2	179.3	168.6	-172.8	-82.1	84.1	1.7	110.7	T607 E608 V609 A613 C614 G615 D651 E653 I654 L657	T607-R611 WeakPolarHBondContact O-CB 3.33Å; T607-R611 PolarHBondContact O-N 2.72Å; T607-R611 PolarHBondContact O-NH1 3.14Å; E608-R611 WeakPolarHBondContact O-CB 3.13Å; E608-R611 PolarHBondContact O-N 2.77Å; E608-R611 VanDerWaalsContact O-N 3.15Å; V609-R611 PolarHBondContact O-N 3.46Å; R611-A613 PolarHBondContact O-N 3.32Å; R611-C614 PolarHBondContact O-N 3.05Å; R611-G615 PolarHBondContact O-N 3.19Å; R611-D651 IonicContact CZ-OD2 2.87Å; R611-D651 IonicContact NH1-OD2 3.56Å; R611-D651 PolarHBondContact NH1-OD2 3.42Å; R611-D651 IonicContact NH2-OD1 2.64Å; R611-D651 PolarHBondContact NH2-OD1 3.04Å; R611-D651 IonicContact NH2-OD2 2.67Å; R611-D651 PolarHBondContact NH2-OD2 2.87Å; R611-E653 VanDerWaalsContact CD-OE1 3.3Å; R611-E653 WeakPolarHBondContact CD-OE1 3.43Å; R611-E653 WeakPolarHBondContact CG-OE1 3.43Å; R611-E653 IonicContact CZ-OE1 3.69Å; R611-E653 IonicContact CZ-OE2 3.11Å; R611-E653 IonicContact NE-OE1 2.7Å; R611-E653 PolarHBondContact NE-OE1 3.19Å; R611-E653 IonicContact NE-OE2 3.84Å; R611-E653 PolarHBondContact NE-OE2 2.81Å; R611-E653 IonicContact NH2-OE2 2.76Å; R611-E653 PolarHBondContact NH2-OE2 3.07Å; R611-I654 HydrophobicContact CB-CG1 4.32Å; R611-L657 HydrophobicContact CB-CD1 4.39Å; R611-L657 HydrophobicContact CG-CD1 4.09Å
612	S	98.4	Very high	97.6	Very high	13 Å²	13	43.6 Å²	43.6	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-42.7	178.7	-52.7	0	0	0	0	112.4	S569 E608 G615 A616	S569-S612 WeakPolarHBondContact O-CB 3.21Å; S569-S612 PolarHBondContact OG-OG 3.07Å; E608-S612 PolarHBondContact O-N 2.97Å; E608-S612 PolarHBondContact O-OG 3.06Å; S612-G615 PolarHBondContact O-N 3.03Å; S612-A616 PolarHBondContact O-N 2.91Å
613	A	98.6	Very high	97.4	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-44.4	177	0	0	0	0	0	112.7	L598 L601 L602 V609 R611 G615 A616 L617	L598-A613 HydrophobicContact CD2-CB 4.4Å; L601-A613 HydrophobicContact CB-CB 3.91Å; L601-A613 HydrophobicContact CD1-CB 4.47Å; L602-A613 HydrophobicContact CD2-CB 4.29Å; V609-A613 WeakPolarHBondContact O-CB 3.26Å; V609-A613 PolarHBondContact O-N 3.04Å; R611-A613 PolarHBondContact O-N 3.32Å; A613-G615 VanDerWaalsContact C-N 3.32Å; A613-G615 PolarHBondContact O-N 2.8Å; A613-A616 PolarHBondContact O-N 2.95Å; A613-L617 VanDerWaalsContact O-CG 3.31Å; A613-L617 WeakPolarHBondContact O-CG 3.43Å; A613-L617 PolarHBondContact O-N 2.93Å
614	C	98.4	Very high	97.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-36.6	175.6	-67.8	0	0	0	0	112	L602 H610 R611 R618 L657	L602-C614 WeakPolarHBondContact CD2-SG 3.45Å; H610-C614 VanDerWaalsContact O-CB 3.23Å; H610-C614 WeakPolarHBondContact O-CB 3.35Å; H610-C614 PolarHBondContact O-N 3.22Å; H610-C614 PolarHBondContact O-SG 2.83Å; R611-C614 PolarHBondContact O-N 3.05Å; C614-R618 VanDerWaalsContact O-CB 3.29Å; C614-R618 WeakPolarHBondContact O-CB 3.46Å; C614-R618 PolarHBondContact O-N 3.24Å; C614-L657 HydrophobicContact CB-CB 3.72Å; C614-L657 HydrophobicContact CB-CD1 4.32Å
615	G	98.4	Very high	97.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-47.8	174	0	0	0	0	0	112.5	Q576 R611 S612 A613 R618 N619	Q576-G615 VanDerWaalsContact CD-C 3.48Å; Q576-G615 VanDerWaalsContact CD-CA 3.5Å; R611-G615 PolarHBondContact O-N 3.19Å; S612-G615 PolarHBondContact O-N 3.03Å; A613-G615 VanDerWaalsContact C-N 3.32Å; A613-G615 PolarHBondContact O-N 2.8Å; G615-R618 PolarHBondContact O-N 3.18Å; G615-N619 PolarHBondContact O-N 2.75Å
616	A	98.6	Very high	97.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.2	-49.5	174.4	0	0	0	0	0	111.9	A572 L575 Q576 L598 S612 A613 R618 N619 L620	A572-A616 WeakPolarHBondContact O-CB 3.32Å; L575-A616 HydrophobicContact CB-CB 4.48Å; Q576-A616 HydrophobicContact CB-CB 4.14Å; L598-A616 HydrophobicContact CD1-CB 3.84Å; L598-A616 HydrophobicContact CD2-CB 3.94Å; S612-A616 PolarHBondContact O-N 2.91Å; A613-A616 PolarHBondContact O-N 2.95Å; A616-R618 PolarHBondContact O-N 3.38Å; A616-N619 PolarHBondContact O-N 3Å; A616-L620 WeakPolarHBondContact O-CB 3.43Å; A616-L620 WeakPolarHBondContact O-CG 3.28Å; A616-L620 PolarHBondContact O-N 2.99Å
617	L	98.8	Very high	97.3	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-43.5	176.8	-68.5	175	0	0	0	111.7	L598 V599 L602 A613 N619 L620 V621 L633 V661	L598-L617 HydrophobicContact CB-CD1 4.46Å; L598-L617 HydrophobicContact CB-CD2 3.68Å; L598-L617 HydrophobicContact CB-CG 3.98Å; L598-L617 HydrophobicContact CD1-CD2 4.29Å; V599-L617 HydrophobicContact CG2-CD1 4.29Å; V599-L617 HydrophobicContact CG2-CD2 4.4Å; L602-L617 HydrophobicContact CD1-CD1 3.84Å; L602-L617 HydrophobicContact CD2-CD1 4.09Å; L602-L617 HydrophobicContact CG-CD1 4.2Å; A613-L617 VanDerWaalsContact O-CG 3.31Å; A613-L617 WeakPolarHBondContact O-CG 3.43Å; A613-L617 PolarHBondContact O-N 2.93Å; L617-N619 VanDerWaalsContact C-N 3.28Å; L617-N619 PolarHBondContact O-N 2.71Å; L617-L620 HydrophobicContact CD2-CD1 4.31Å; L617-L620 PolarHBondContact O-N 3.03Å; L617-V621 VanDerWaalsContact O-CG2 3.27Å; L617-V621 WeakPolarHBondContact O-CG2 3.46Å; L617-V621 PolarHBondContact O-N 3.46Å; L617-L633 HydrophobicContact CB-CD1 4.35Å; L617-L633 HydrophobicContact CD1-CD1 4.47Å; L617-L633 HydrophobicContact CD2-CD1 3.96Å; L617-L633 HydrophobicContact CG-CD1 4.49Å; L617-V661 HydrophobicContact CB-CG2 4.23Å
618	R	98.4	Very high	97.4	Very high	64 Å²	64	40.7 Å²	40.7	24%	0.242	21%	0.206	C	C	.	.	H	α-helix	trans	-55.8	-42.8	178.9	-173.3	179.3	-178.2	171.9	6.5	111.2	C614 G615 A616 Y622 E656 V661 N664	C614-R618 VanDerWaalsContact O-CB 3.29Å; C614-R618 WeakPolarHBondContact O-CB 3.46Å; C614-R618 PolarHBondContact O-N 3.24Å; G615-R618 PolarHBondContact O-N 3.18Å; A616-R618 PolarHBondContact O-N 3.38Å; R618-Y622 PolarHBondContact O-N 3.17Å; R618-E656 IonicContact CZ-OE1 2.73Å; R618-E656 VanDerWaalsContact CZ-OE1 3.27Å; R618-E656 IonicContact NH1-OE1 2.73Å; R618-E656 PolarHBondContact NH1-OE1 3.24Å; R618-E656 IonicContact NH2-OE1 3.56Å; R618-E656 PolarHBondContact NH2-OE1 3Å; R618-V661 HydrophobicContact CB-CG2 3.86Å; R618-N664 PolarHBondContact O-ND2 3.1Å
619	N	98.4	Very high	97.5	Very high	34 Å²	34	36.6 Å²	36.6	18%	0.182	19%	0.186	C	C	.	.	H	α-helix	trans	-75.1	-42.3	178	-73.5	1.8	0	0	0	112.6	Q576 C579 K586 G615 A616 L617 V621 Y622	Q576-N619 PolarHBondContact O-ND2 3.37Å; C579-N619 HydrophobicContact CB-CB 3.65Å; K586-N619 WeakPolarHBondContact CE-O 3.39Å; K586-N619 PolarHBondContact NZ-O 3.48Å; G615-N619 PolarHBondContact O-N 2.75Å; A616-N619 PolarHBondContact O-N 3Å; L617-N619 VanDerWaalsContact C-N 3.28Å; L617-N619 PolarHBondContact O-N 2.71Å; N619-V621 VanDerWaalsContact C-N 3.29Å; N619-V621 PolarHBondContact O-N 3.44Å; N619-Y622 PolarHBondContact O-N 3Å
620	L	98.2	Very high	97.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.7	-39.8	177.1	-82.4	163.2	0	0	0	113.3	C579 K586 I589 I595 L598 A616 L617 N629	C579-L620 WeakPolarHBondContact SG-CD2 3.42Å; K586-L620 HydrophobicContact CB-CD2 4.03Å; K586-L620 HydrophobicContact CG-CD2 4.17Å; I589-L620 HydrophobicContact CB-CD2 3.93Å; I589-L620 HydrophobicContact CD1-CD2 3.97Å; I589-L620 HydrophobicContact CG2-CD1 4.16Å; I589-L620 HydrophobicContact CG2-CD2 3.81Å; I595-L620 HydrophobicContact CG1-CD1 4.39Å; L598-L620 HydrophobicContact CD1-CD1 3.37Å; A616-L620 WeakPolarHBondContact O-CB 3.43Å; A616-L620 WeakPolarHBondContact O-CG 3.28Å; A616-L620 PolarHBondContact O-N 2.99Å; L617-L620 HydrophobicContact CD2-CD1 4.31Å; L617-L620 PolarHBondContact O-N 3.03Å; L620-N629 PolarHBondContact O-ND2 2.87Å
621	V	98.2	Very high	97.5	Very high	1 Å²	1	38 Å²	38	1%	0.006	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	1.4	-178.9	-58.4	0	0	0	0	114.5	L617 N619 K630 L633 V661 N664 L665	L617-V621 VanDerWaalsContact O-CG2 3.27Å; L617-V621 WeakPolarHBondContact O-CG2 3.46Å; L617-V621 PolarHBondContact O-N 3.46Å; N619-V621 VanDerWaalsContact C-N 3.29Å; N619-V621 PolarHBondContact O-N 3.44Å; V621-K630 HydrophobicContact CB-CG 3.94Å; V621-K630 HydrophobicContact CG1-CG 4.31Å; V621-K630 WeakPolarHBondContact O-CE 3.44Å; V621-L633 HydrophobicContact CG1-CB 4.39Å; V621-L633 HydrophobicContact CG1-CD1 3.72Å; V621-V661 HydrophobicContact CG2-CG1 4.03Å; V621-N664 HydrophobicContact CG2-CB 3.61Å; V621-L665 HydrophobicContact CB-CD2 4.26Å; V621-L665 HydrophobicContact CG1-CD2 4Å; V621-L665 HydrophobicContact CG2-CD2 4.43Å; V621-L665 HydrophobicContact CG2-CG 4.45Å
622	Y	97.4	Very high	97.5	Very high	149 Å²	149	36.1 Å²	36.1	58%	0.584	19%	0.192	S	C	*	.			trans	-76.5	136.8	-179.5	-177.7	-100.6	0	0	0	112.7	R618 N619 N626	R618-Y622 PolarHBondContact O-N 3.17Å; N619-Y622 PolarHBondContact O-N 3Å; Y622-N626 PolarHBondContact O-ND2 3.27Å
623	G	94.1	Very high	97.6	Very high	30 Å²	30	35.5 Å²	35.5	31%	0.309	19%	0.187	S	C	.	.	S	Bend	trans	91	161.5	177.9	0	0	0	0	0	114.4	K630	G623-K630 WeakPolarHBondContact O-CE 3.35Å; G623-K630 PolarHBondContact O-NZ 3.39Å
624	K	92.3	Very high	97.6	Very high	174 Å²	174	39.4 Å²	39.4	76%	0.757	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-77.7	-29.7	-178	-172.9	168.6	-177.9	169.3	0	113.7	N626 D627	K624-N626 PolarHBondContact O-N 3.3Å; K624-N626 VanDerWaalsContact O-N 3.11Å; K624-D627 PolarHBondContact O-N 3.48Å
625	A	93.8	Very high	97.6	Very high	81 Å²	81	44.4 Å²	44.4	67%	0.669	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-63.4	-14.8	174.6	0	0	0	0	0	113.6
626	N	96.3	Very high	97.5	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-105.5	18.8	-177.4	-63.1	-60.3	0	0	0	113.1	N583 Y622 K624 D628 N629 K630	N583-N626 PolarHBondContact OD1-ND2 3.39Å; Y622-N626 PolarHBondContact O-ND2 3.27Å; K624-N626 PolarHBondContact O-N 3.3Å; K624-N626 VanDerWaalsContact O-N 3.11Å; N626-D628 PolarHBondContact O-N 3.19Å; N626-N629 HydrophobicContact CB-CB 4.36Å; N626-N629 WeakPolarHBondContact O-CA 3.32Å; N626-N629 WeakPolarHBondContact O-CB 3.46Å; N626-N629 PolarHBondContact O-N 3.43Å; N626-N629 PolarHBondContact OD1-ND2 3.28Å; N626-N629 VanDerWaalsContact OD1-ND2 3.13Å; N626-K630 PolarHBondContact O-N 2.98Å; N626-K630 VanDerWaalsContact O-N 3.13Å
627	D	97.6	Very high	97.5	Very high	42 Å²	42	47.3 Å²	47.3	23%	0.225	26%	0.256	C	S	.	.	H	α-helix	trans	-54.3	-38.5	174.2	-80.1	8.8	0	0	0	111.7	K624 N629 K630 I631	K624-D627 PolarHBondContact O-N 3.48Å; D627-N629 VanDerWaalsContact C-N 3.26Å; D627-N629 PolarHBondContact O-N 2.88Å; D627-K630 WeakPolarHBondContact O-CA 3.45Å; D627-K630 VanDerWaalsContact O-CB 3.28Å; D627-K630 WeakPolarHBondContact O-CB 3.36Å; D627-K630 PolarHBondContact O-N 3.19Å; D627-K630 WeakPolarHBondContact OD1-CD 3.47Å; D627-K630 WeakPolarHBondContact OD1-CE 3.34Å; D627-K630 IonicContact OD1-NZ 3.55Å; D627-K630 PolarHBondContact OD1-NZ 3.42Å; D627-I631 WeakPolarHBondContact O-CG1 3.38Å; D627-I631 PolarHBondContact O-N 3.29Å
628	D	98.2	Very high	97.5	Very high	90 Å²	90	47.3 Å²	47.3	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-51.8	-37.6	170	-107.5	20.1	0	0	0	114.1	R590 N626 A632	R590-D628 IonicContact CZ-OD2 2.7Å; R590-D628 IonicContact NH1-OD1 3.47Å; R590-D628 IonicContact NH1-OD2 3.27Å; R590-D628 PolarHBondContact NH1-OD2 3.37Å; R590-D628 IonicContact NH2-OD2 3.42Å; R590-D628 PolarHBondContact NH2-OD2 3.3Å; N626-D628 PolarHBondContact O-N 3.19Å; D628-A632 WeakPolarHBondContact O-CB 3.48Å; D628-A632 PolarHBondContact O-N 2.94Å; D628-A632 VanDerWaalsContact O-N 3.09Å
629	N	98.5	Very high	97.5	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-77.3	-33.2	175.7	-55.5	-16.9	0	0	0	111.5	K586 R590 I595 L620 N626 D627 A632 L633	K586-N629 WeakPolarHBondContact CB-ND2 3.37Å; R590-N629 WeakPolarHBondContact CD-OD1 3.23Å; R590-N629 PolarHBondContact NE-OD1 3.24Å; I595-N629 HydrophobicContact CD1-CB 3.98Å; L620-N629 PolarHBondContact O-ND2 2.87Å; N626-N629 HydrophobicContact CB-CB 4.36Å; N626-N629 WeakPolarHBondContact O-CA 3.32Å; N626-N629 WeakPolarHBondContact O-CB 3.46Å; N626-N629 PolarHBondContact O-N 3.43Å; N626-N629 PolarHBondContact OD1-ND2 3.28Å; N626-N629 VanDerWaalsContact OD1-ND2 3.13Å; D627-N629 VanDerWaalsContact C-N 3.26Å; D627-N629 PolarHBondContact O-N 2.88Å; N629-A632 PolarHBondContact O-N 3.35Å; N629-L633 WeakPolarHBondContact O-CB 3.5Å; N629-L633 PolarHBondContact O-N 3.28Å
630	K	98.6	Very high	97.5	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	25%	0.25	C	C	.	.	H	α-helix	trans	-63.1	-45.7	174	-57.7	174.4	-170.1	159.4	0	110.2	V621 G623 N626 D627 L633 K634 N664 L665 S667 C668 L671	V621-K630 HydrophobicContact CB-CG 3.94Å; V621-K630 HydrophobicContact CG1-CG 4.31Å; V621-K630 WeakPolarHBondContact O-CE 3.44Å; G623-K630 WeakPolarHBondContact O-CE 3.35Å; G623-K630 PolarHBondContact O-NZ 3.39Å; N626-K630 PolarHBondContact O-N 2.98Å; N626-K630 VanDerWaalsContact O-N 3.13Å; D627-K630 WeakPolarHBondContact O-CA 3.45Å; D627-K630 VanDerWaalsContact O-CB 3.28Å; D627-K630 WeakPolarHBondContact O-CB 3.36Å; D627-K630 PolarHBondContact O-N 3.19Å; D627-K630 WeakPolarHBondContact OD1-CD 3.47Å; D627-K630 WeakPolarHBondContact OD1-CE 3.34Å; D627-K630 IonicContact OD1-NZ 3.55Å; D627-K630 PolarHBondContact OD1-NZ 3.42Å; K630-L633 PolarHBondContact O-N 2.86Å; K630-K634 PolarHBondContact O-N 3.02Å; K630-N664 WeakPolarHBondContact CE-O 3.39Å; K630-L665 HydrophobicContact CB-CD2 3.71Å; K630-L665 HydrophobicContact CG-CD2 4.01Å; K630-S667 PolarHBondContact NZ-OG 3.42Å; K630-C668 HydrophobicContact CD-CB 3.74Å; K630-L671 HydrophobicContact CB-CD1 3.55Å
631	I	98.6	Very high	97.5	Very high	55 Å²	55	44.9 Å²	44.9	28%	0.282	25%	0.25	S	S	.	.	H	α-helix	trans	-61.8	-44.8	174.5	-60.8	-53.7	0	0	0	110.9	D627 K634 N635 A670 L671	D627-I631 WeakPolarHBondContact O-CG1 3.38Å; D627-I631 PolarHBondContact O-N 3.29Å; I631-K634 PolarHBondContact O-N 3.36Å; I631-N635 WeakPolarHBondContact O-CB 3.44Å; I631-N635 VanDerWaalsContact O-CG 3.3Å; I631-N635 PolarHBondContact O-N 3.34Å; I631-A670 HydrophobicContact CD1-CB 3.98Å; I631-L671 HydrophobicContact CD1-CD2 3.79Å; I631-L671 HydrophobicContact CD1-CG 4.02Å
632	A	98.7	Very high	97.5	Very high	20 Å²	20	44.9 Å²	44.9	17%	0.165	25%	0.25	C	C	.	.	H	α-helix	trans	-57.8	-51.1	175.8	0	0	0	0	0	111.9	R590 I595 D628 N629 K634 N635 C636	R590-A632 HydrophobicContact CG-CB 4.05Å; I595-A632 HydrophobicContact CD1-CB 3.97Å; D628-A632 WeakPolarHBondContact O-CB 3.48Å; D628-A632 PolarHBondContact O-N 2.94Å; D628-A632 VanDerWaalsContact O-N 3.09Å; N629-A632 PolarHBondContact O-N 3.35Å; A632-K634 VanDerWaalsContact C-N 3.32Å; A632-K634 PolarHBondContact O-N 2.86Å; A632-N635 PolarHBondContact O-N 2.86Å; A632-C636 PolarHBondContact O-N 2.91Å; A632-C636 PolarHBondContact O-SG 3.07Å
633	L	98.8	Very high	97.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-56	-44.9	177.4	-176.5	160	0	0	0	111.8	I595 V599 L617 V621 N629 K630 C636 G638 I639 L642 V661 L665	I595-L633 HydrophobicContact CG2-CB 4Å; V599-L633 HydrophobicContact CG2-CG 4.2Å; L617-L633 HydrophobicContact CB-CD1 4.35Å; L617-L633 HydrophobicContact CD1-CD1 4.47Å; L617-L633 HydrophobicContact CD2-CD1 3.96Å; L617-L633 HydrophobicContact CG-CD1 4.49Å; V621-L633 HydrophobicContact CG1-CB 4.39Å; V621-L633 HydrophobicContact CG1-CD1 3.72Å; N629-L633 WeakPolarHBondContact O-CB 3.5Å; N629-L633 PolarHBondContact O-N 3.28Å; K630-L633 PolarHBondContact O-N 2.86Å; L633-C636 PolarHBondContact O-N 2.93Å; L633-G638 WeakPolarHBondContact O-CA 3.41Å; L633-G638 PolarHBondContact O-N 2.91Å; L633-I639 HydrophobicContact CD2-CG1 4.38Å; L633-L642 HydrophobicContact CD2-CD1 4.2Å; L633-V661 HydrophobicContact CD1-CG1 4.05Å; L633-L665 HydrophobicContact CB-CD2 4.46Å; L633-L665 HydrophobicContact CD1-CD1 4.46Å; L633-L665 HydrophobicContact CD1-CD2 4.31Å; L633-L665 HydrophobicContact CD2-CD1 3.69Å; L633-L665 HydrophobicContact CD2-CD2 4.08Å
634	K	98.5	Very high	97.7	Very high	81 Å²	81	41.6 Å²	41.6	35%	0.352	23%	0.228	S	C	.	.	H	α-helix	trans	-63.8	-39	176.1	169.4	-96.6	154.6	-170.9	0	112	K630 I631 A632 C636 G637 I639 L671	K630-K634 PolarHBondContact O-N 3.02Å; I631-K634 PolarHBondContact O-N 3.36Å; A632-K634 VanDerWaalsContact C-N 3.32Å; A632-K634 PolarHBondContact O-N 2.86Å; K634-C636 VanDerWaalsContact C-N 3.34Å; K634-G637 PolarHBondContact O-N 3.22Å; K634-I639 HydrophobicContact CB-CD1 3.86Å; K634-I639 HydrophobicContact CB-CG1 4.45Å; K634-I639 HydrophobicContact CG-CD1 3.88Å; K634-L671 HydrophobicContact CB-CD1 4.41Å; K634-L671 HydrophobicContact CB-CD2 3.56Å; K634-L671 HydrophobicContact CD-CD2 3.86Å; K634-L671 HydrophobicContact CG-CD2 3.59Å
635	N	98.3	Very high	98	Very high	105 Å²	105	33.4 Å²	33.4	56%	0.561	19%	0.192	S	C	*	.	H	α-helix	trans	-70.3	-30.2	177.9	-71.7	-16.7	0	0	0	112.5	I631 A632 G637	I631-N635 WeakPolarHBondContact O-CB 3.44Å; I631-N635 VanDerWaalsContact O-CG 3.3Å; I631-N635 PolarHBondContact O-N 3.34Å; A632-N635 PolarHBondContact O-N 2.86Å; N635-G637 PolarHBondContact O-N 2.94Å
636	C	97.8	Very high	98.2	Very high	32 Å²	32	29.8 Å²	29.8	22%	0.216	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	1.9	170.1	-66.5	0	0	0	0	114.3	Q596 V599 A632 L633 K634 G638	Q596-C636 PolarHBondContact NE2-O 2.87Å; Q596-C636 VanDerWaalsContact OE1-CA 3.32Å; Q596-C636 PolarHBondContact OE1-SG 2.96Å; V599-C636 HydrophobicContact CB-CB 4.45Å; V599-C636 HydrophobicContact CG1-CB 4.47Å; V599-C636 HydrophobicContact CG2-CB 4.3Å; A632-C636 PolarHBondContact O-N 2.91Å; A632-C636 PolarHBondContact O-SG 3.07Å; L633-C636 PolarHBondContact O-N 2.93Å; K634-C636 VanDerWaalsContact C-N 3.34Å; C636-G638 VanDerWaalsContact C-N 3.3Å; C636-G638 PolarHBondContact O-N 3.22Å
637	G	98.2	Very high	98.1	Very high	30 Å²	30	37.9 Å²	37.9	31%	0.309	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	15.4	-174.7	0	0	0	0	0	114.2	K634 N635 I639 P640 A641	K634-G637 PolarHBondContact O-N 3.22Å; N635-G637 PolarHBondContact O-N 2.94Å; G637-I639 PolarHBondContact O-N 2.93Å; G637-P640 VanDerWaalsContact O-CD 3.31Å; G637-P640 WeakPolarHBondContact O-CD 3.49Å; G637-A641 PolarHBondContact O-N 3.45Å; G637-A641 VanDerWaalsContact O-N 3.1Å
638	G	98.4	Very high	98	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-28.9	-172.5	0	0	0	0	0	114.9	L633 C636 A641 L642	L633-G638 WeakPolarHBondContact O-CA 3.41Å; L633-G638 PolarHBondContact O-N 2.91Å; C636-G638 VanDerWaalsContact C-N 3.3Å; C636-G638 PolarHBondContact O-N 3.22Å; G638-A641 PolarHBondContact O-N 3.42Å; G638-L642 WeakPolarHBondContact O-CB 3.43Å; G638-L642 WeakPolarHBondContact O-CD1 3.41Å; G638-L642 WeakPolarHBondContact O-CG 3.27Å; G638-L642 PolarHBondContact O-N 3.37Å
639	I	98.6	Very high	97.8	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-54.5	174.4	-67.4	169	0	0	0	110.3	L633 K634 G637 A641 L642 V643 L662 L665 P674 I675 D678	L633-I639 HydrophobicContact CD2-CG1 4.38Å; K634-I639 HydrophobicContact CB-CD1 3.86Å; K634-I639 HydrophobicContact CB-CG1 4.45Å; K634-I639 HydrophobicContact CG-CD1 3.88Å; G637-I639 PolarHBondContact O-N 2.93Å; I639-A641 VanDerWaalsContact C-N 3.27Å; I639-A641 PolarHBondContact O-N 3.05Å; I639-L642 PolarHBondContact O-N 3.47Å; I639-V643 WeakPolarHBondContact O-CB 3.27Å; I639-V643 VanDerWaalsContact O-CG2 3.27Å; I639-V643 WeakPolarHBondContact O-CG2 3.49Å; I639-V643 PolarHBondContact O-N 2.89Å; I639-L662 HydrophobicContact CG2-CD2 4.43Å; I639-L665 HydrophobicContact CG1-CD1 3.89Å; I639-P674 HydrophobicContact CD1-CB 4.29Å; I639-I675 HydrophobicContact CD1-CG1 3.88Å; I639-D678 HydrophobicContact CG2-CB 3.71Å
640	P	98.4	Very high	97.4	Very high	45 Å²	45	44.7 Å²	44.7	29%	0.292	23%	0.228	S	C	.	.	H	α-helix	trans	-53.6	-36.9	169.3	-31.4	35.7	0	0	0	114.9	G637 V643 R644 D678	G637-P640 VanDerWaalsContact O-CD 3.31Å; G637-P640 WeakPolarHBondContact O-CD 3.49Å; P640-V643 PolarHBondContact O-N 2.84Å; P640-R644 WeakPolarHBondContact O-CG 3.42Å; P640-R644 PolarHBondContact O-N 3.48Å; P640-R644 PolarHBondContact O-NH1 2.89Å; P640-D678 WeakPolarHBondContact CD-OD2 3.43Å; P640-D678 WeakPolarHBondContact CG-OD2 3.49Å
641	A	98.6	Very high	97.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-67.4	-48.5	178.5	0	0	0	0	0	112.7	V599 L602 G637 G638 I639 V643 R644 L645	V599-A641 HydrophobicContact CG1-CB 4.08Å; L602-A641 HydrophobicContact CB-CB 4.27Å; L602-A641 HydrophobicContact CD1-CB 3.89Å; G637-A641 PolarHBondContact O-N 3.45Å; G637-A641 VanDerWaalsContact O-N 3.1Å; G638-A641 PolarHBondContact O-N 3.42Å; I639-A641 VanDerWaalsContact C-N 3.27Å; I639-A641 PolarHBondContact O-N 3.05Å; A641-V643 VanDerWaalsContact C-N 3.28Å; A641-V643 PolarHBondContact O-N 3.1Å; A641-R644 WeakPolarHBondContact O-CB 3.48Å; A641-R644 PolarHBondContact O-N 3.29Å; A641-L645 PolarHBondContact O-N 3.42Å
642	L	98.6	Very high	96.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56.3	-43.2	172.4	-71.5	164.3	0	0	0	111.2	L602 L633 G638 I639 L645 L646 V658 V661 L662 L665	L602-L642 HydrophobicContact CD1-CD2 3.89Å; L602-L642 HydrophobicContact CD1-CG 3.96Å; L633-L642 HydrophobicContact CD2-CD1 4.2Å; G638-L642 WeakPolarHBondContact O-CB 3.43Å; G638-L642 WeakPolarHBondContact O-CD1 3.41Å; G638-L642 WeakPolarHBondContact O-CG 3.27Å; G638-L642 PolarHBondContact O-N 3.37Å; I639-L642 PolarHBondContact O-N 3.47Å; L642-L645 PolarHBondContact O-N 3.44Å; L642-L646 WeakPolarHBondContact O-CB 3.38Å; L642-L646 PolarHBondContact O-N 3.39Å; L642-V658 HydrophobicContact CB-CG1 4.07Å; L642-V658 HydrophobicContact CD2-CB 4.43Å; L642-V658 HydrophobicContact CD2-CG1 4.14Å; L642-V658 HydrophobicContact CD2-CG2 4.11Å; L642-V658 WeakPolarHBondContact O-CG1 3.39Å; L642-V661 HydrophobicContact CD1-CB 4.03Å; L642-V661 HydrophobicContact CD1-CG1 3.46Å; L642-V661 VanDerWaalsContact CD1-CG1 3.46Å; L642-V661 HydrophobicContact CD2-CB 4.11Å; L642-V661 HydrophobicContact CD2-CG1 4.2Å; L642-V661 HydrophobicContact CD2-CG2 4.27Å; L642-V661 HydrophobicContact CG-CG1 4.49Å; L642-L662 HydrophobicContact CB-CD2 4.38Å; L642-L662 HydrophobicContact CD1-CD2 4.22Å; L642-L665 HydrophobicContact CD1-CD1 3.96Å
643	V	98.1	Very high	96.6	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-39.9	177.4	170.8	0	0	0	0	112.2	I639 P640 A641 L646 R647 A679 V682	I639-V643 WeakPolarHBondContact O-CB 3.27Å; I639-V643 VanDerWaalsContact O-CG2 3.27Å; I639-V643 WeakPolarHBondContact O-CG2 3.49Å; I639-V643 PolarHBondContact O-N 2.89Å; P640-V643 PolarHBondContact O-N 2.84Å; A641-V643 VanDerWaalsContact C-N 3.28Å; A641-V643 PolarHBondContact O-N 3.1Å; V643-L646 PolarHBondContact O-N 3.48Å; V643-R647 WeakPolarHBondContact O-CG 3.29Å; V643-R647 PolarHBondContact O-N 2.99Å; V643-A679 HydrophobicContact CG2-CB 3.63Å; V643-V682 HydrophobicContact CG1-CB 4.06Å; V643-V682 HydrophobicContact CG1-CG1 4.13Å; V643-V682 HydrophobicContact CG1-CG2 3.64Å
644	R	97.7	Very high	96.5	Very high	104 Å²	104	52.6 Å²	52.6	39%	0.392	26%	0.264	S	S	.	.	H	α-helix	trans	-60.2	-47.1	171.7	-77.7	-170.6	-58.7	-85.8	10	110.9	D603 P640 A641 L646 R647 K648	D603-R644 IonicContact OD1-NE 3.6Å; D603-R644 IonicContact OD2-CZ 3.38Å; D603-R644 IonicContact OD2-NE 2.71Å; D603-R644 PolarHBondContact OD2-NE 2.87Å; D603-R644 IonicContact OD2-NH2 2.73Å; D603-R644 PolarHBondContact OD2-NH2 2.9Å; P640-R644 WeakPolarHBondContact O-CG 3.42Å; P640-R644 PolarHBondContact O-N 3.48Å; P640-R644 PolarHBondContact O-NH1 2.89Å; A641-R644 WeakPolarHBondContact O-CB 3.48Å; A641-R644 PolarHBondContact O-N 3.29Å; R644-L646 PolarHBondContact O-N 2.93Å; R644-R647 PolarHBondContact O-N 3.14Å; R644-K648 VanDerWaalsContact O-CG 3.3Å; R644-K648 WeakPolarHBondContact O-CG 3.26Å; R644-K648 PolarHBondContact O-N 3.49Å; R644-K648 VanDerWaalsContact O-N 3.12Å
645	L	97.9	Very high	96.4	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-43	179.9	-176.8	55.2	0	0	0	111.5	L602 H610 A641 L642 R647 K648 T649 I654 V658	L602-L645 HydrophobicContact CB-CD2 4.42Å; L602-L645 HydrophobicContact CD2-CD2 4.04Å; H610-L645 HydrophobicContact CB-CD2 4.22Å; A641-L645 PolarHBondContact O-N 3.42Å; L642-L645 PolarHBondContact O-N 3.44Å; L645-R647 VanDerWaalsContact C-N 3.29Å; L645-R647 PolarHBondContact O-N 3.26Å; L645-K648 PolarHBondContact O-N 3.37Å; L645-T649 HydrophobicContact CD1-CG2 4.5Å; L645-T649 VanDerWaalsContact O-CG2 3.29Å; L645-T649 WeakPolarHBondContact O-CG2 3.4Å; L645-T649 PolarHBondContact O-N 2.9Å; L645-I654 HydrophobicContact CD1-CG2 4.34Å; L645-I654 HydrophobicContact CD2-CG2 3.96Å; L645-I654 HydrophobicContact CG-CG2 4.07Å; L645-V658 HydrophobicContact CD2-CG2 3.83Å; L645-V658 HydrophobicContact CG-CG2 4.17Å
646	L	97.3	Very high	96.3	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-33.2	176.5	-174.2	58.1	0	0	0	113.5	L642 V643 R644 R655 V658 T659 V682 L683 V687	L642-L646 WeakPolarHBondContact O-CB 3.38Å; L642-L646 PolarHBondContact O-N 3.39Å; V643-L646 PolarHBondContact O-N 3.48Å; R644-L646 PolarHBondContact O-N 2.93Å; L646-R655 HydrophobicContact CD1-CB 4.24Å; L646-R655 HydrophobicContact CD1-CG 4.01Å; L646-V658 HydrophobicContact CB-CG1 3.99Å; L646-T659 HydrophobicContact CD1-CG2 4.38Å; L646-T659 HydrophobicContact CD2-CG2 4.42Å; L646-V682 HydrophobicContact CD2-CG1 4.23Å; L646-V682 HydrophobicContact CG-CG1 4.42Å; L646-L683 HydrophobicContact CD2-CD2 3.98Å; L646-V687 HydrophobicContact CD1-CG2 4.12Å; L646-V687 HydrophobicContact CD2-CG2 4.28Å
647	R	95.7	Very high	96.3	Very high	174 Å²	174	47.3 Å²	47.3	66%	0.657	23%	0.233	S	C	*	.	H	α-helix	trans	-75.7	-30.5	173.3	-67	-179.5	-169.1	176.2	5.2	113.2	V643 R644 L645 V682	V643-R647 WeakPolarHBondContact O-CG 3.29Å; V643-R647 PolarHBondContact O-N 2.99Å; R644-R647 PolarHBondContact O-N 3.14Å; L645-R647 VanDerWaalsContact C-N 3.29Å; L645-R647 PolarHBondContact O-N 3.26Å; R647-V682 HydrophobicContact CG-CG1 3.6Å; R647-V682 VanDerWaalsContact NE-CG2 3.26Å
648	K	94.3	Very high	96.3	Very high	131 Å²	131	45.9 Å²	45.9	57%	0.57	22%	0.218	S	C	*	.	H	α-helix	trans	-84.3	-35.5	-174.8	-73.2	170.8	176.7	-176	0	113.5	D603 R644 L645	D603-K648 IonicContact OD1-NZ 3.47Å; D603-K648 PolarHBondContact OD1-NZ 2.94Å; R644-K648 VanDerWaalsContact O-CG 3.3Å; R644-K648 WeakPolarHBondContact O-CG 3.26Å; R644-K648 PolarHBondContact O-N 3.49Å; R644-K648 VanDerWaalsContact O-N 3.12Å; L645-K648 PolarHBondContact O-N 3.37Å
649	T	93.9	Very high	96.3	Very high	19 Å²	19	45.9 Å²	45.9	12%	0.117	22%	0.218	C	C	.	.			trans	-98	137.2	-166.4	-164.7	0	0	0	0	113.8	L645 D651 I654 R655	L645-T649 HydrophobicContact CD1-CG2 4.5Å; L645-T649 VanDerWaalsContact O-CG2 3.29Å; L645-T649 WeakPolarHBondContact O-CG2 3.4Å; L645-T649 PolarHBondContact O-N 2.9Å; T649-D651 PolarHBondContact OG1-N 3.46Å; T649-I654 HydrophobicContact CG2-CB 4.18Å; T649-I654 HydrophobicContact CG2-CG2 3.85Å; T649-R655 HydrophobicContact CG2-CG 3.8Å
650	T	90.8	Very high	96.3	Very high	127 Å²	127	45.9 Å²	45.9	78%	0.779	22%	0.218	S	C	*	.			trans	-95.1	-18	170.4	50	0	0	0	0	112.9	L652	T650-L652 PolarHBondContact O-N 2.94Å
651	D	93.1	Very high	96.4	Very high	42 Å²	42	43.7 Å²	43.7	23%	0.225	21%	0.205	C	C	.	.			trans	-58.3	115.7	178.1	-179.5	-33.5	0	0	0	110.4	R611 T649 E653 I654 R655	R611-D651 IonicContact CZ-OD2 2.87Å; R611-D651 IonicContact NH1-OD2 3.56Å; R611-D651 PolarHBondContact NH1-OD2 3.42Å; R611-D651 IonicContact NH2-OD1 2.64Å; R611-D651 PolarHBondContact NH2-OD1 3.04Å; R611-D651 IonicContact NH2-OD2 2.67Å; R611-D651 PolarHBondContact NH2-OD2 2.87Å; T649-D651 PolarHBondContact OG1-N 3.46Å; D651-E653 VanDerWaalsContact C-N 3.31Å; D651-E653 PolarHBondContact O-N 3.46Å; D651-E653 WeakPolarHBondContact OD1-CB 3.4Å; D651-E653 PolarHBondContact OD1-N 2.71Å; D651-I654 HydrophobicContact CB-CB 4.19Å; D651-I654 HydrophobicContact CB-CD1 3.86Å; D651-I654 HydrophobicContact CB-CG1 4.06Å; D651-I654 PolarHBondContact O-N 2.85Å; D651-I654 PolarHBondContact OD1-N 2.88Å; D651-I654 VanDerWaalsContact OD1-N 3.12Å; D651-I654 WeakPolarHBondContact OD2-CD1 3.29Å; D651-R655 VanDerWaalsContact O-CG 3.26Å; D651-R655 WeakPolarHBondContact O-CG 3.38Å; D651-R655 PolarHBondContact O-N 3.14Å
652	L	91.7	Very high	96.4	Very high	108 Å²	108	43.7 Å²	43.7	57%	0.565	20%	0.204	S	C	*	.	H	α-helix	trans	-65.8	-31.5	-175.3	-68	176.4	0	0	0	113	T650 R655 E656	T650-L652 PolarHBondContact O-N 2.94Å; L652-R655 PolarHBondContact O-N 3.35Å; L652-E656 PolarHBondContact O-N 3.18Å
653	E	94.3	Very high	96.4	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	22%	0.216	S	C	.	.	H	α-helix	trans	-73	-42.8	-179.9	-166.2	-166.2	144.5	0	0	110.3	R611 D651 R655 E656 L657	R611-E653 VanDerWaalsContact CD-OE1 3.3Å; R611-E653 WeakPolarHBondContact CD-OE1 3.43Å; R611-E653 WeakPolarHBondContact CG-OE1 3.43Å; R611-E653 IonicContact CZ-OE1 3.69Å; R611-E653 IonicContact CZ-OE2 3.11Å; R611-E653 IonicContact NE-OE1 2.7Å; R611-E653 PolarHBondContact NE-OE1 3.19Å; R611-E653 IonicContact NE-OE2 3.84Å; R611-E653 PolarHBondContact NE-OE2 2.81Å; R611-E653 IonicContact NH2-OE2 2.76Å; R611-E653 PolarHBondContact NH2-OE2 3.07Å; D651-E653 VanDerWaalsContact C-N 3.31Å; D651-E653 PolarHBondContact O-N 3.46Å; D651-E653 WeakPolarHBondContact OD1-CB 3.4Å; D651-E653 PolarHBondContact OD1-N 2.71Å; E653-R655 VanDerWaalsContact C-N 3.29Å; E653-R655 PolarHBondContact O-N 3.28Å; E653-E656 PolarHBondContact O-N 3.02Å; E653-L657 WeakPolarHBondContact O-CB 3.46Å; E653-L657 VanDerWaalsContact O-CG 3.31Å; E653-L657 WeakPolarHBondContact O-CG 3.48Å; E653-L657 PolarHBondContact O-N 3.04Å
654	I	96.5	Very high	96.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-40	172.1	-59.8	174.2	0	0	0	110.1	T607 H610 R611 L645 T649 D651 L657 V658	T607-I654 HydrophobicContact CG2-CD1 4.06Å; T607-I654 WeakPolarHBondContact O-CD1 3.43Å; H610-I654 HydrophobicContact CB-CD1 3.92Å; H610-I654 HydrophobicContact CB-CG2 4.38Å; R611-I654 HydrophobicContact CB-CG1 4.32Å; L645-I654 HydrophobicContact CD1-CG2 4.34Å; L645-I654 HydrophobicContact CD2-CG2 3.96Å; L645-I654 HydrophobicContact CG-CG2 4.07Å; T649-I654 HydrophobicContact CG2-CB 4.18Å; T649-I654 HydrophobicContact CG2-CG2 3.85Å; D651-I654 HydrophobicContact CB-CB 4.19Å; D651-I654 HydrophobicContact CB-CD1 3.86Å; D651-I654 HydrophobicContact CB-CG1 4.06Å; D651-I654 PolarHBondContact O-N 2.85Å; D651-I654 PolarHBondContact OD1-N 2.88Å; D651-I654 VanDerWaalsContact OD1-N 3.12Å; D651-I654 WeakPolarHBondContact OD2-CD1 3.29Å; I654-L657 PolarHBondContact O-N 2.87Å; I654-V658 HydrophobicContact CG2-CG2 4.17Å; I654-V658 WeakPolarHBondContact O-CB 3.35Å; I654-V658 VanDerWaalsContact O-CG2 3.23Å; I654-V658 WeakPolarHBondContact O-CG2 3.31Å; I654-V658 PolarHBondContact O-N 3.23Å
655	R	96.6	Very high	96.4	Very high	39 Å²	39	42.8 Å²	42.8	15%	0.147	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-38.2	175.1	-66.7	168.6	75.1	-175.6	5.9	112	L646 T649 D651 L652 E653 T659 A686 H691 V712	L646-R655 HydrophobicContact CD1-CB 4.24Å; L646-R655 HydrophobicContact CD1-CG 4.01Å; T649-R655 HydrophobicContact CG2-CG 3.8Å; D651-R655 VanDerWaalsContact O-CG 3.26Å; D651-R655 WeakPolarHBondContact O-CG 3.38Å; D651-R655 PolarHBondContact O-N 3.14Å; L652-R655 PolarHBondContact O-N 3.35Å; E653-R655 VanDerWaalsContact C-N 3.29Å; E653-R655 PolarHBondContact O-N 3.28Å; R655-T659 WeakPolarHBondContact O-CB 3.34Å; R655-T659 WeakPolarHBondContact O-CG2 3.5Å; R655-T659 PolarHBondContact O-N 3.2Å; R655-T659 PolarHBondContact O-OG1 3.01Å; R655-A686 PolarHBondContact NH2-O 3.31Å; R655-H691 PolarHBondContact NH2-NE2 3.03Å; R655-H691 VanDerWaalsContact NH2-NE2 3.19Å; R655-V712 HydrophobicContact CB-CG1 3.9Å; R655-V712 HydrophobicContact CB-CG2 4.31Å
656	E	96.3	Very high	96.5	Very high	52 Å²	52	42.7 Å²	42.7	24%	0.243	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-47.7	174.9	-158.2	-133.7	108.4	0	0	111.5	R618 L652 E653 T659 G660 Q711 V712 N715	R618-E656 IonicContact CZ-OE1 2.73Å; R618-E656 VanDerWaalsContact CZ-OE1 3.27Å; R618-E656 IonicContact NH1-OE1 2.73Å; R618-E656 PolarHBondContact NH1-OE1 3.24Å; R618-E656 IonicContact NH2-OE1 3.56Å; R618-E656 PolarHBondContact NH2-OE1 3Å; L652-E656 PolarHBondContact O-N 3.18Å; E653-E656 PolarHBondContact O-N 3.02Å; E656-T659 PolarHBondContact O-N 2.96Å; E656-T659 PolarHBondContact O-OG1 3.05Å; E656-G660 PolarHBondContact O-N 3.39Å; E656-Q711 VanDerWaalsContact CD-CG 3.42Å; E656-Q711 HydrophobicContact CG-CB 3.93Å; E656-Q711 HydrophobicContact CG-CG 3.57Å; E656-V712 HydrophobicContact CB-CG2 4.09Å; E656-V712 HydrophobicContact CG-CG2 4.47Å; E656-N715 PolarHBondContact O-ND2 3.08Å
657	L	98.2	Very high	96.5	Very high	15 Å²	15	45.3 Å²	45.3	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-51.2	177.2	-69.9	166.3	0	0	0	111	R611 C614 E653 I654 T659 G660 V661	R611-L657 HydrophobicContact CB-CD1 4.39Å; R611-L657 HydrophobicContact CG-CD1 4.09Å; C614-L657 HydrophobicContact CB-CB 3.72Å; C614-L657 HydrophobicContact CB-CD1 4.32Å; E653-L657 WeakPolarHBondContact O-CB 3.46Å; E653-L657 VanDerWaalsContact O-CG 3.31Å; E653-L657 WeakPolarHBondContact O-CG 3.48Å; E653-L657 PolarHBondContact O-N 3.04Å; I654-L657 PolarHBondContact O-N 2.87Å; L657-T659 PolarHBondContact O-N 3.24Å; L657-G660 CarbonylContact O-C 3.58Å; L657-G660 WeakPolarHBondContact O-CA 3.3Å; L657-G660 PolarHBondContact O-N 2.8Å; L657-G660 VanDerWaalsContact O-N 3.1Å; L657-V661 WeakPolarHBondContact O-CG2 3.48Å; L657-V661 PolarHBondContact O-N 3.36Å
658	V	98.6	Very high	96.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.7	-46.2	180	168.5	0	0	0	0	112.1	L642 L645 L646 I654 G660 V661 L662	L642-V658 HydrophobicContact CB-CG1 4.07Å; L642-V658 HydrophobicContact CD2-CB 4.43Å; L642-V658 HydrophobicContact CD2-CG1 4.14Å; L642-V658 HydrophobicContact CD2-CG2 4.11Å; L642-V658 WeakPolarHBondContact O-CG1 3.39Å; L645-V658 HydrophobicContact CD2-CG2 3.83Å; L645-V658 HydrophobicContact CG-CG2 4.17Å; L646-V658 HydrophobicContact CB-CG1 3.99Å; I654-V658 HydrophobicContact CG2-CG2 4.17Å; I654-V658 WeakPolarHBondContact O-CB 3.35Å; I654-V658 VanDerWaalsContact O-CG2 3.23Å; I654-V658 WeakPolarHBondContact O-CG2 3.31Å; I654-V658 PolarHBondContact O-N 3.23Å; V658-G660 VanDerWaalsContact C-N 3.28Å; V658-G660 PolarHBondContact O-N 3.08Å; V658-V661 PolarHBondContact O-N 2.88Å; V658-L662 HydrophobicContact CG1-CD1 4.32Å; V658-L662 WeakPolarHBondContact O-CG 3.5Å; V658-L662 PolarHBondContact O-N 3.2Å
659	T	98.4	Very high	96.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-31.8	175.2	52	0	0	0	0	112.1	L646 R655 E656 L657 L662 W663 L683 V687 V712 N715 A716	L646-T659 HydrophobicContact CD1-CG2 4.38Å; L646-T659 HydrophobicContact CD2-CG2 4.42Å; R655-T659 WeakPolarHBondContact O-CB 3.34Å; R655-T659 WeakPolarHBondContact O-CG2 3.5Å; R655-T659 PolarHBondContact O-N 3.2Å; R655-T659 PolarHBondContact O-OG1 3.01Å; E656-T659 PolarHBondContact O-N 2.96Å; E656-T659 PolarHBondContact O-OG1 3.05Å; L657-T659 PolarHBondContact O-N 3.24Å; T659-L662 PolarHBondContact O-N 3.4Å; T659-W663 WeakPolarHBondContact O-CB 3.39Å; T659-W663 PolarHBondContact O-N 3.11Å; T659-L683 HydrophobicContact CG2-CD2 4.11Å; T659-V687 HydrophobicContact CG2-CG2 4.24Å; T659-V712 HydrophobicContact CG2-CG1 3.93Å; T659-N715 VanDerWaalsContact OG1-CB 3.31Å; T659-N715 WeakPolarHBondContact OG1-CB 3.31Å; T659-N715 PolarHBondContact OG1-ND2 2.95Å; T659-A716 HydrophobicContact CG2-CB 4.32Å
660	G	98.4	Very high	96.8	Very high	1 Å²	1	39 Å²	39	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-39.6	172.5	0	0	0	0	0	113.3	E656 L657 V658 W663 N664 N715	E656-G660 PolarHBondContact O-N 3.39Å; L657-G660 CarbonylContact O-C 3.58Å; L657-G660 WeakPolarHBondContact O-CA 3.3Å; L657-G660 PolarHBondContact O-N 2.8Å; L657-G660 VanDerWaalsContact O-N 3.1Å; V658-G660 VanDerWaalsContact C-N 3.28Å; V658-G660 PolarHBondContact O-N 3.08Å; G660-W663 PolarHBondContact O-N 2.79Å; G660-N664 PolarHBondContact O-N 2.79Å; G660-N715 PolarHBondContact N-ND2 2.72Å
661	V	98.8	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-48.3	171.6	-176.8	0	0	0	0	109.9	L617 R618 V621 L633 L642 L657 V658 W663 N664 L665	L617-V661 HydrophobicContact CB-CG2 4.23Å; R618-V661 HydrophobicContact CB-CG2 3.86Å; V621-V661 HydrophobicContact CG2-CG1 4.03Å; L633-V661 HydrophobicContact CD1-CG1 4.05Å; L642-V661 HydrophobicContact CD1-CB 4.03Å; L642-V661 HydrophobicContact CD1-CG1 3.46Å; L642-V661 VanDerWaalsContact CD1-CG1 3.46Å; L642-V661 HydrophobicContact CD2-CB 4.11Å; L642-V661 HydrophobicContact CD2-CG1 4.2Å; L642-V661 HydrophobicContact CD2-CG2 4.27Å; L642-V661 HydrophobicContact CG-CG1 4.49Å; L657-V661 WeakPolarHBondContact O-CG2 3.48Å; L657-V661 PolarHBondContact O-N 3.36Å; V658-V661 PolarHBondContact O-N 2.88Å; V661-W663 VanDerWaalsContact C-N 3.31Å; V661-W663 PolarHBondContact O-N 3.42Å; V661-N664 PolarHBondContact O-N 2.81Å; V661-L665 HydrophobicContact CG1-CD1 3.9Å; V661-L665 HydrophobicContact CG1-CG 4.23Å; V661-L665 VanDerWaalsContact O-CG 3.27Å; V661-L665 WeakPolarHBondContact O-CG 3.36Å; V661-L665 PolarHBondContact O-N 3.48Å
662	L	98.8	Very high	97.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-36.9	178.5	-68.9	170.2	0	0	0	112.6	I639 L642 V658 T659 L665 S666 L683 C719	I639-L662 HydrophobicContact CG2-CD2 4.43Å; L642-L662 HydrophobicContact CB-CD2 4.38Å; L642-L662 HydrophobicContact CD1-CD2 4.22Å; V658-L662 HydrophobicContact CG1-CD1 4.32Å; V658-L662 WeakPolarHBondContact O-CG 3.5Å; V658-L662 PolarHBondContact O-N 3.2Å; T659-L662 PolarHBondContact O-N 3.4Å; L662-L665 HydrophobicContact CD2-CD1 4.41Å; L662-L665 PolarHBondContact O-N 2.58Å; L662-S666 WeakPolarHBondContact O-CB 3.27Å; L662-S666 PolarHBondContact O-N 3.41Å; L662-S666 PolarHBondContact O-OG 2.67Å; L662-L683 HydrophobicContact CD1-CD2 4.08Å; L662-C719 VanDerWaalsContact C-SG 3.57Å; L662-C719 PolarHBondContact O-SG 3.31Å
663	W	98.6	Very high	97.7	Very high	67 Å²	67	29.4 Å²	29.4	25%	0.254	16%	0.158	S	C	.	.	H	α-helix	trans	-65.6	-46.3	173.4	-172.7	17.4	0	0	0	111.7	T659 G660 V661 L665 S666 N715 G718 C719	T659-W663 WeakPolarHBondContact O-CB 3.39Å; T659-W663 PolarHBondContact O-N 3.11Å; G660-W663 PolarHBondContact O-N 2.79Å; V661-W663 VanDerWaalsContact C-N 3.31Å; V661-W663 PolarHBondContact O-N 3.42Å; W663-L665 VanDerWaalsContact C-N 3.35Å; W663-L665 PolarHBondContact O-N 2.82Å; W663-S666 PolarHBondContact O-N 2.86Å; W663-S666 PolarHBondContact O-OG 2.64Å; W663-N715 HydrophobicContact CE3-CB 4.24Å; W663-N715 WeakPolarHBondContact CZ3-OD1 3.46Å; W663-G718 PolarHBondContact NE1-O 2.95Å; W663-C719 HydrophobicContact CB-CB 4.19Å
664	N	98.5	Very high	97.9	Very high	25 Å²	25	26.1 Å²	26.1	13%	0.134	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-42.6	174.6	-74.7	-9	0	0	0	112.1	R618 V621 K630 G660 V661 S667	R618-N664 PolarHBondContact O-ND2 3.1Å; V621-N664 HydrophobicContact CG2-CB 3.61Å; K630-N664 WeakPolarHBondContact CE-O 3.39Å; G660-N664 PolarHBondContact O-N 2.79Å; V661-N664 PolarHBondContact O-N 2.81Å; N664-S667 PolarHBondContact O-N 2.87Å; N664-S667 PolarHBondContact O-OG 3.19Å
665	L	98.8	Very high	98	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-43.4	177.3	-69.2	169.8	0	0	0	112.4	V621 K630 L633 I639 L642 V661 L662 W663 S667 C668 L671 I675	V621-L665 HydrophobicContact CB-CD2 4.26Å; V621-L665 HydrophobicContact CG1-CD2 4Å; V621-L665 HydrophobicContact CG2-CD2 4.43Å; V621-L665 HydrophobicContact CG2-CG 4.45Å; K630-L665 HydrophobicContact CB-CD2 3.71Å; K630-L665 HydrophobicContact CG-CD2 4.01Å; L633-L665 HydrophobicContact CB-CD2 4.46Å; L633-L665 HydrophobicContact CD1-CD1 4.46Å; L633-L665 HydrophobicContact CD1-CD2 4.31Å; L633-L665 HydrophobicContact CD2-CD1 3.69Å; L633-L665 HydrophobicContact CD2-CD2 4.08Å; I639-L665 HydrophobicContact CG1-CD1 3.89Å; L642-L665 HydrophobicContact CD1-CD1 3.96Å; V661-L665 HydrophobicContact CG1-CD1 3.9Å; V661-L665 HydrophobicContact CG1-CG 4.23Å; V661-L665 VanDerWaalsContact O-CG 3.27Å; V661-L665 WeakPolarHBondContact O-CG 3.36Å; V661-L665 PolarHBondContact O-N 3.48Å; L662-L665 HydrophobicContact CD2-CD1 4.41Å; L662-L665 PolarHBondContact O-N 2.58Å; W663-L665 VanDerWaalsContact C-N 3.35Å; W663-L665 PolarHBondContact O-N 2.82Å; L665-S667 PolarHBondContact O-N 2.64Å; L665-C668 PolarHBondContact O-N 2.88Å; L665-C668 VanDerWaalsContact O-N 3.07Å; L665-L671 HydrophobicContact CB-CD1 4.24Å; L665-L671 HydrophobicContact CD2-CD1 3.88Å; L665-I675 HydrophobicContact CB-CD1 3.87Å
666	S	98.4	Very high	98.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.8	-13.1	-177.6	67.5	0	0	0	0	115.2	L662 W663 C668 K672 N722	L662-S666 WeakPolarHBondContact O-CB 3.27Å; L662-S666 PolarHBondContact O-N 3.41Å; L662-S666 PolarHBondContact O-OG 2.67Å; W663-S666 PolarHBondContact O-N 2.86Å; W663-S666 PolarHBondContact O-OG 2.64Å; S666-C668 PolarHBondContact O-N 2.93Å; S666-K672 WeakPolarHBondContact O-CE 3.44Å; S666-K672 WeakPolarHBondContact O-CG 3.45Å; S666-N722 WeakPolarHBondContact O-CB 3.18Å; S666-N722 WeakPolarHBondContact OG-CB 3.29Å; S666-N722 PolarHBondContact OG-ND2 3.11Å
667	S	97.5	Very high	98.1	Very high	59 Å²	59	28.1 Å²	28.1	41%	0.413	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.7	172.5	67.4	0	0	0	0	114.1	K630 N664 L665	K630-S667 PolarHBondContact NZ-OG 3.42Å; N664-S667 PolarHBondContact O-N 2.87Å; N664-S667 PolarHBondContact O-OG 3.19Å; L665-S667 PolarHBondContact O-N 2.64Å
668	C	97.6	Very high	98.1	Very high	8 Å²	8	30.5 Å²	30.5	5%	0.054	17%	0.168	C	C	.	.	S	Bend	trans	-96.1	122.3	175.8	-175.1	0	0	0	0	110.7	K630 L665 S666 A670 L671 K672	K630-C668 HydrophobicContact CD-CB 3.74Å; L665-C668 PolarHBondContact O-N 2.88Å; L665-C668 VanDerWaalsContact O-N 3.07Å; S666-C668 PolarHBondContact O-N 2.93Å; C668-A670 VanDerWaalsContact C-N 3.31Å; C668-A670 PolarHBondContact O-N 2.87Å; C668-L671 HydrophobicContact CB-CB 4.5Å; C668-L671 HydrophobicContact CB-CD1 4.38Å; C668-L671 HydrophobicContact CB-CG 4.3Å; C668-L671 PolarHBondContact O-N 3.43Å; C668-K672 PolarHBondContact O-N 2.93Å
669	D	96.3	Very high	98.1	Very high	115 Å²	115	30.5 Å²	30.5	62%	0.615	17%	0.168	S	C	*	.	H	α-helix	trans	-56.2	-42.5	-174.3	-66.3	-58	0	0	0	113.4	L671 K672	D669-L671 PolarHBondContact O-N 3.23Å; D669-L671 VanDerWaalsContact O-N 3.07Å; D669-K672 PolarHBondContact O-N 3.17Å; D669-K672 VanDerWaalsContact O-N 3.14Å; D669-K672 VanDerWaalsContact OD1-CE 3.24Å; D669-K672 WeakPolarHBondContact OD1-CE 3.39Å; D669-K672 IonicContact OD1-NZ 2.8Å; D669-K672 PolarHBondContact OD1-NZ 3.46Å
670	A	97	Very high	98.1	Very high	70 Å²	70	31 Å²	31	58%	0.579	17%	0.171	S	C	*	.	H	α-helix	trans	-63.5	-13.1	178.5	0	0	0	0	0	114.2	I631 C668	I631-A670 HydrophobicContact CD1-CB 3.98Å; C668-A670 VanDerWaalsContact C-N 3.31Å; C668-A670 PolarHBondContact O-N 2.87Å
671	L	98.4	Very high	98	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-105.2	-10.7	177.5	-61.2	-170.7	0	0	0	114.3	K630 I631 K634 L665 C668 D669 M673 P674 I675	K630-L671 HydrophobicContact CB-CD1 3.55Å; I631-L671 HydrophobicContact CD1-CD2 3.79Å; I631-L671 HydrophobicContact CD1-CG 4.02Å; K634-L671 HydrophobicContact CB-CD1 4.41Å; K634-L671 HydrophobicContact CB-CD2 3.56Å; K634-L671 HydrophobicContact CD-CD2 3.86Å; K634-L671 HydrophobicContact CG-CD2 3.59Å; L665-L671 HydrophobicContact CB-CD1 4.24Å; L665-L671 HydrophobicContact CD2-CD1 3.88Å; C668-L671 HydrophobicContact CB-CB 4.5Å; C668-L671 HydrophobicContact CB-CD1 4.38Å; C668-L671 HydrophobicContact CB-CG 4.3Å; C668-L671 PolarHBondContact O-N 3.43Å; D669-L671 PolarHBondContact O-N 3.23Å; D669-L671 VanDerWaalsContact O-N 3.07Å; L671-M673 VanDerWaalsContact C-N 3.34Å; L671-M673 PolarHBondContact O-N 2.62Å; L671-P674 WeakPolarHBondContact O-CD 3.25Å; L671-I675 HydrophobicContact CB-CD1 4.25Å; L671-I675 VanDerWaalsContact O-CG1 3.28Å; L671-I675 WeakPolarHBondContact O-CG1 3.14Å; L671-I675 PolarHBondContact O-N 3.08Å
672	K	98.3	Very high	98	Very high	22 Å²	22	34 Å²	34	10%	0.096	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-43.1	-177.2	-66.2	177.2	179.5	170.5	0	111.9	S666 C668 D669 I675 I676 N722 V723 S725 A726	S666-K672 WeakPolarHBondContact O-CE 3.44Å; S666-K672 WeakPolarHBondContact O-CG 3.45Å; C668-K672 PolarHBondContact O-N 2.93Å; D669-K672 PolarHBondContact O-N 3.17Å; D669-K672 VanDerWaalsContact O-N 3.14Å; D669-K672 VanDerWaalsContact OD1-CE 3.24Å; D669-K672 WeakPolarHBondContact OD1-CE 3.39Å; D669-K672 IonicContact OD1-NZ 2.8Å; D669-K672 PolarHBondContact OD1-NZ 3.46Å; K672-I675 PolarHBondContact O-N 3.42Å; K672-I676 WeakPolarHBondContact O-CG1 3.26Å; K672-I676 PolarHBondContact O-N 2.92Å; K672-N722 WeakPolarHBondContact CE-O 3.1Å; K672-V723 HydrophobicContact CB-CB 4.24Å; K672-V723 HydrophobicContact CB-CG1 4.02Å; K672-V723 HydrophobicContact CG-CG1 4.2Å; K672-S725 PolarHBondContact NZ-OG 2.9Å; K672-A726 HydrophobicContact CB-CB 3.52Å; K672-A726 HydrophobicContact CD-CB 3.83Å; K672-A726 HydrophobicContact CG-CB 4.3Å
673	M	97.8	Very high	98	Very high	52 Å²	52	34.1 Å²	34.1	26%	0.256	20%	0.195	S	C	.	.	H	α-helix	trans	-69.6	-45.1	177.3	-74	-56.5	-59.5	0	0	114.1	L671 I675 I676 Q677 E729 A730	L671-M673 VanDerWaalsContact C-N 3.34Å; L671-M673 PolarHBondContact O-N 2.62Å; M673-I675 VanDerWaalsContact C-N 3.29Å; M673-I675 PolarHBondContact O-N 3.5Å; M673-I676 HydrophobicContact CE-CG2 4.41Å; M673-I676 WeakPolarHBondContact O-CB 3.26Å; M673-I676 PolarHBondContact O-N 3.38Å; M673-I676 VanDerWaalsContact O-N 3.14Å; M673-Q677 WeakPolarHBondContact O-CG 3.39Å; M673-Q677 PolarHBondContact O-N 2.62Å; M673-E729 HydrophobicContact CE-CB 4.41Å; M673-E729 HydrophobicContact CE-CG 3.78Å; M673-A730 HydrophobicContact SD-CB 3.91Å
674	P	98.1	Very high	97.9	Very high	23 Å²	23	30.9 Å²	30.9	15%	0.149	18%	0.183	C	C	.	.	H	α-helix	trans	-52.7	-41.3	168.3	-31.8	35.6	0	0	0	114.2	I639 L671 Q677 D678	I639-P674 HydrophobicContact CD1-CB 4.29Å; L671-P674 WeakPolarHBondContact O-CD 3.25Å; P674-Q677 PolarHBondContact O-N 3.28Å; P674-D678 PolarHBondContact O-N 2.67Å
675	I	98.7	Very high	97.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-69	-36.7	177.4	-66.9	167.2	0	0	0	111.5	I639 L665 L671 K672 M673 Q677 A679 L680 V723	I639-I675 HydrophobicContact CD1-CG1 3.88Å; L665-I675 HydrophobicContact CB-CD1 3.87Å; L671-I675 HydrophobicContact CB-CD1 4.25Å; L671-I675 VanDerWaalsContact O-CG1 3.28Å; L671-I675 WeakPolarHBondContact O-CG1 3.14Å; L671-I675 PolarHBondContact O-N 3.08Å; K672-I675 PolarHBondContact O-N 3.42Å; M673-I675 VanDerWaalsContact C-N 3.29Å; M673-I675 PolarHBondContact O-N 3.5Å; I675-Q677 VanDerWaalsContact C-N 3.3Å; I675-Q677 PolarHBondContact O-N 3.26Å; I675-A679 HydrophobicContact CG2-CB 4.12Å; I675-A679 WeakPolarHBondContact O-CA 3.4Å; I675-A679 VanDerWaalsContact O-CB 3.31Å; I675-A679 WeakPolarHBondContact O-CB 3.36Å; I675-A679 PolarHBondContact O-N 2.91Å; I675-L680 PolarHBondContact O-N 3.48Å; I675-V723 HydrophobicContact CB-CG1 4.03Å; I675-V723 HydrophobicContact CG2-CG1 3.81Å
676	I	98.4	Very high	97.5	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-60.6	-39.8	170.5	-73.3	-75.1	0	0	0	111.5	K672 M673 L680 V723 A730 R733 M734	K672-I676 WeakPolarHBondContact O-CG1 3.26Å; K672-I676 PolarHBondContact O-N 2.92Å; M673-I676 HydrophobicContact CE-CG2 4.41Å; M673-I676 WeakPolarHBondContact O-CB 3.26Å; M673-I676 PolarHBondContact O-N 3.38Å; M673-I676 VanDerWaalsContact O-N 3.14Å; I676-L680 HydrophobicContact CD1-CD2 4.14Å; I676-L680 HydrophobicContact CG2-CD2 4.34Å; I676-L680 WeakPolarHBondContact O-CB 3.21Å; I676-V723 HydrophobicContact CD1-CB 3.97Å; I676-V723 HydrophobicContact CD1-CG2 3.54Å; I676-V723 HydrophobicContact CG1-CB 3.88Å; I676-V723 HydrophobicContact CG1-CG2 3.98Å; I676-A730 HydrophobicContact CD1-CB 4.22Å; I676-A730 HydrophobicContact CG1-CB 4.08Å; I676-R733 HydrophobicContact CG2-CB 3.98Å; I676-R733 HydrophobicContact CG2-CG 4.4Å; I676-M734 HydrophobicContact CD1-CG 3.61Å; I676-M734 HydrophobicContact CD1-SD 3.79Å
677	Q	97.3	Very high	97.3	Very high	126 Å²	126	35.5 Å²	35.5	59%	0.589	21%	0.212	S	C	*	.	H	α-helix	trans	-73.4	-50.6	-178.2	-71.4	167.1	-27.8	0	0	112.3	M673 P674 I675	M673-Q677 WeakPolarHBondContact O-CG 3.39Å; M673-Q677 PolarHBondContact O-N 2.62Å; P674-Q677 PolarHBondContact O-N 3.28Å; I675-Q677 VanDerWaalsContact C-N 3.3Å; I675-Q677 PolarHBondContact O-N 3.26Å
678	D	97.4	Very high	97.2	Very high	66 Å²	66	32.7 Å²	32.7	35%	0.353	19%	0.192	S	C	.	.	H	α-helix	trans	-86.6	-36.7	-172.6	-69.5	-28.5	0	0	0	113.6	I639 P640 P674	I639-D678 HydrophobicContact CG2-CB 3.71Å; P640-D678 WeakPolarHBondContact CD-OD2 3.43Å; P640-D678 WeakPolarHBondContact CG-OD2 3.49Å; P674-D678 PolarHBondContact O-N 2.67Å
679	A	98.4	Very high	97	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-25.9	-163.1	0	0	0	0	0	115.2	V643 I675 A681 V682 L683	V643-A679 HydrophobicContact CG2-CB 3.63Å; I675-A679 HydrophobicContact CG2-CB 4.12Å; I675-A679 WeakPolarHBondContact O-CA 3.4Å; I675-A679 VanDerWaalsContact O-CB 3.31Å; I675-A679 WeakPolarHBondContact O-CB 3.36Å; I675-A679 PolarHBondContact O-N 2.91Å; A679-A681 PolarHBondContact O-N 2.72Å; A679-V682 PolarHBondContact O-N 2.97Å; A679-L683 HydrophobicContact CB-CD1 4.11Å; A679-L683 HydrophobicContact CB-CG 4.37Å; A679-L683 PolarHBondContact O-N 3.47Å
680	L	98.4	Very high	96.6	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.047	18%	0.181	C	C	.	.	H	α-helix	trans	-51.2	-54.8	-172.4	173.8	59.4	0	0	0	113.7	I675 I676 V682 T684 L720 R733 M734 C737 L740	I675-L680 PolarHBondContact O-N 3.48Å; I676-L680 HydrophobicContact CD1-CD2 4.14Å; I676-L680 HydrophobicContact CG2-CD2 4.34Å; I676-L680 WeakPolarHBondContact O-CB 3.21Å; L680-V682 PolarHBondContact O-N 2.85Å; L680-T684 WeakPolarHBondContact O-CB 3.41Å; L680-T684 PolarHBondContact O-N 2.7Å; L680-T684 PolarHBondContact O-OG1 3.01Å; L680-L720 HydrophobicContact CD1-CD2 3.69Å; L680-R733 HydrophobicContact CD2-CB 4.02Å; L680-M734 HydrophobicContact CD1-CG 3.85Å; L680-M734 HydrophobicContact CD2-CG 3.93Å; L680-C737 HydrophobicContact CD2-CB 4.28Å; L680-C737 HydrophobicContact CG-CB 4.3Å; L680-L740 HydrophobicContact CD1-CD2 3.89Å
681	A	97.4	Very high	96.2	Very high	57 Å²	57	27.9 Å²	27.9	47%	0.471	16%	0.158	S	C	.	.	H	α-helix	trans	-64.6	-25.9	-179.5	0	0	0	0	0	112.6	A679 N685	A679-A681 PolarHBondContact O-N 2.72Å; A681-N685 WeakPolarHBondContact O-CB 3.3Å; A681-N685 PolarHBondContact O-N 2.99Å; A681-N685 PolarHBondContact O-ND2 2.9Å
682	V	97.6	Very high	95.7	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.055	16%	0.158	C	C	.	.	H	α-helix	trans	-85.8	-43.1	-178	-173.1	0	0	0	0	111.3	V643 L646 R647 A679 L680 T684 A686	V643-V682 HydrophobicContact CG1-CB 4.06Å; V643-V682 HydrophobicContact CG1-CG1 4.13Å; V643-V682 HydrophobicContact CG1-CG2 3.64Å; L646-V682 HydrophobicContact CD2-CG1 4.23Å; L646-V682 HydrophobicContact CG-CG1 4.42Å; R647-V682 HydrophobicContact CG-CG1 3.6Å; R647-V682 VanDerWaalsContact NE-CG2 3.26Å; A679-V682 PolarHBondContact O-N 2.97Å; L680-V682 PolarHBondContact O-N 2.85Å; V682-T684 PolarHBondContact O-N 3.48Å; V682-A686 HydrophobicContact CG1-CB 4.32Å; V682-A686 WeakPolarHBondContact O-CA 3.09Å; V682-A686 WeakPolarHBondContact O-CB 3.42Å; V682-A686 PolarHBondContact O-N 3.17Å
683	L	98.3	Very high	94.9	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-56.9	-43.7	169.7	-70.6	171	0	0	0	109.7	L646 T659 L662 A679 V687 I688 A716 C719 L720	L646-L683 HydrophobicContact CD2-CD2 3.98Å; T659-L683 HydrophobicContact CG2-CD2 4.11Å; L662-L683 HydrophobicContact CD1-CD2 4.08Å; A679-L683 HydrophobicContact CB-CD1 4.11Å; A679-L683 HydrophobicContact CB-CG 4.37Å; A679-L683 PolarHBondContact O-N 3.47Å; L683-V687 CarbonylContact O-C 3.22Å; L683-V687 WeakPolarHBondContact O-CA 3.48Å; L683-V687 VanDerWaalsContact O-CB 3.29Å; L683-V687 WeakPolarHBondContact O-CB 3.24Å; L683-V687 PolarHBondContact O-N 2.7Å; L683-I688 WeakPolarHBondContact O-CG1 3.43Å; L683-I688 PolarHBondContact O-N 3.42Å; L683-A716 HydrophobicContact CD2-CB 4.02Å; L683-C719 HydrophobicContact CD1-CB 4.39Å; L683-L720 HydrophobicContact CB-CD2 4.47Å; L683-L720 HydrophobicContact CD1-CD2 3.97Å; L683-L720 HydrophobicContact CD1-CG 4.39Å
684	T	97.2	Very high	94.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	I	π-helix	trans	-63	-61.9	178	-54.8	0	0	0	0	112	L680 V682 I688 I689 C737 L740	L680-T684 WeakPolarHBondContact O-CB 3.41Å; L680-T684 PolarHBondContact O-N 2.7Å; L680-T684 PolarHBondContact O-OG1 3.01Å; V682-T684 PolarHBondContact O-N 3.48Å; T684-I688 PolarHBondContact O-N 3.43Å; T684-I689 HydrophobicContact CG2-CD1 3.86Å; T684-I689 HydrophobicContact CG2-CG1 4.16Å; T684-I689 PolarHBondContact O-N 3.44Å; T684-C737 PolarHBondContact OG1-SG 2.96Å; T684-C737 VanDerWaalsContact OG1-SG 3.41Å; T684-L740 HydrophobicContact CG2-CB 3.77Å; T684-L740 HydrophobicContact CG2-CD1 4.17Å; T684-L740 HydrophobicContact CG2-CG 4.5Å
685	N	95.1	Very high	92.9	Very high	96 Å²	96	34.4 Å²	34.4	51%	0.513	18%	0.184	S	C	.	.	I	π-helix	trans	-75.2	-29.1	-172.3	-70.3	-74	0	0	0	114.3	A681 P690	A681-N685 WeakPolarHBondContact O-CB 3.3Å; A681-N685 PolarHBondContact O-N 2.99Å; A681-N685 PolarHBondContact O-ND2 2.9Å; N685-P690 VanDerWaalsContact O-CD 3.29Å; N685-P690 WeakPolarHBondContact O-CD 3.41Å; N685-P690 VanDerWaalsContact O-CG 3.26Å; N685-P690 WeakPolarHBondContact O-CG 3.36Å
686	A	93.7	Very high	90.8	Very high	26 Å²	26	38.2 Å²	38.2	22%	0.215	20%	0.204	C	C	.	.	I	π-helix	trans	-100.4	-11.4	-178.5	0	0	0	0	0	114.1	R655 V682	R655-A686 PolarHBondContact NH2-O 3.31Å; V682-A686 HydrophobicContact CG1-CB 4.32Å; V682-A686 WeakPolarHBondContact O-CA 3.09Å; V682-A686 WeakPolarHBondContact O-CB 3.42Å; V682-A686 PolarHBondContact O-N 3.17Å
687	V	94.3	Very high	88.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-130.2	-62.9	177.4	-172.5	0	0	0	0	112.6	L646 T659 L683 I689 H691 V712 A716	L646-V687 HydrophobicContact CD1-CG2 4.12Å; L646-V687 HydrophobicContact CD2-CG2 4.28Å; T659-V687 HydrophobicContact CG2-CG2 4.24Å; L683-V687 CarbonylContact O-C 3.22Å; L683-V687 WeakPolarHBondContact O-CA 3.48Å; L683-V687 VanDerWaalsContact O-CB 3.29Å; L683-V687 WeakPolarHBondContact O-CB 3.24Å; L683-V687 PolarHBondContact O-N 2.7Å; V687-I689 PolarHBondContact O-N 3.08Å; V687-H691 VanDerWaalsContact O-CB 3.25Å; V687-H691 WeakPolarHBondContact O-CB 2.94Å; V687-H691 PolarHBondContact O-CD2 3.29Å; V687-H691 PolarHBondContact O-N 2.89Å; V687-V712 HydrophobicContact CG1-CB 4.5Å; V687-V712 HydrophobicContact CG1-CG1 3.83Å; V687-V712 HydrophobicContact CG2-CG1 4.2Å; V687-A716 HydrophobicContact CB-CB 4.09Å; V687-A716 HydrophobicContact CG1-CB 3.66Å
688	I	95.3	Very high	85.8	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.242	C	C	.	.	I	π-helix	trans	-60.7	-52.3	-170.4	-51.7	-54.5	0	0	0	111.1	L683 T684 S692 L713 A716 T717 L720 L740 A743 L744	L683-I688 WeakPolarHBondContact O-CG1 3.43Å; L683-I688 PolarHBondContact O-N 3.42Å; T684-I688 PolarHBondContact O-N 3.43Å; I688-S692 WeakPolarHBondContact O-CB 3.16Å; I688-S692 PolarHBondContact O-N 3.39Å; I688-S692 PolarHBondContact O-OG 2.82Å; I688-L713 HydrophobicContact CD1-CD1 3.82Å; I688-A716 HydrophobicContact CD1-CB 3.7Å; I688-T717 HydrophobicContact CD1-CG2 3.82Å; I688-L720 HydrophobicContact CD1-CD1 4.05Å; I688-L720 HydrophobicContact CG1-CD1 3.78Å; I688-L740 HydrophobicContact CB-CD1 4.45Å; I688-L740 HydrophobicContact CG1-CD1 4.23Å; I688-L740 HydrophobicContact CG2-CD1 4.14Å; I688-A743 HydrophobicContact CG2-CB 3.96Å; I688-L744 HydrophobicContact CG2-CD2 4.26Å
689	I	93.2	Very high	83.2	Confident	6 Å²	6	46 Å²	46	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-55.9	-178.9	-68.1	169.5	0	0	0	111	T684 V687 H691 S692 W694 E695 A743	T684-I689 HydrophobicContact CG2-CD1 3.86Å; T684-I689 HydrophobicContact CG2-CG1 4.16Å; T684-I689 PolarHBondContact O-N 3.44Å; V687-I689 PolarHBondContact O-N 3.08Å; I689-H691 VanDerWaalsContact C-N 3.34Å; I689-H691 PolarHBondContact O-N 3Å; I689-S692 PolarHBondContact O-N 3.35Å; I689-S692 PolarHBondContact O-OG 3.49Å; I689-W694 HydrophobicContact CD1-CZ3 4.33Å; I689-W694 HydrophobicContact CG1-CE3 4.27Å; I689-W694 HydrophobicContact CG1-CZ3 4.44Å; I689-W694 HydrophobicContact CG2-CE3 4.15Å; I689-E695 HydrophobicContact CG2-CG 3.67Å; I689-E695 WeakPolarHBondContact CG2-OE2 3.2Å; I689-A743 HydrophobicContact CG1-CB 4.04Å
690	P	89.6	Confident	80.5	Confident	62 Å²	62	50.5 Å²	50.5	40%	0.403	28%	0.284	S	S	.	.	H	α-helix	trans	-66.7	-28.3	-176.5	-23	35.2	0	0	0	115.1	N685	N685-P690 VanDerWaalsContact O-CD 3.29Å; N685-P690 WeakPolarHBondContact O-CD 3.41Å; N685-P690 VanDerWaalsContact O-CG 3.26Å; N685-P690 WeakPolarHBondContact O-CG 3.36Å
691	H	87.6	Confident	77.8	Confident	23 Å²	23	55.1 Å²	55.1	11%	0.106	31%	0.308	C	S	.	.	H	α-helix	trans	-92.3	-12.9	177.8	-65.7	-119	0	0	0	113.1	R655 V687 I689 G693 S710 L713	R655-H691 PolarHBondContact NH2-NE2 3.03Å; R655-H691 VanDerWaalsContact NH2-NE2 3.19Å; V687-H691 VanDerWaalsContact O-CB 3.25Å; V687-H691 WeakPolarHBondContact O-CB 2.94Å; V687-H691 PolarHBondContact O-CD2 3.29Å; V687-H691 PolarHBondContact O-N 2.89Å; I689-H691 VanDerWaalsContact C-N 3.34Å; I689-H691 PolarHBondContact O-N 3Å; H691-G693 VanDerWaalsContact C-N 3.34Å; H691-S710 PolarHBondContact ND1-OG 3.39Å; H691-L713 HydrophobicContact CB-CB 3.98Å; H691-L713 HydrophobicContact CB-CD1 4.21Å; H691-L713 HydrophobicContact CB-CD2 4.17Å; H691-L713 HydrophobicContact CB-CG 4.34Å
692	S	87.6	Confident	75.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.007	33%	0.327	C	S	.	.	H	α-helix	trans	-70.9	-30.6	173.2	65.3	0	0	0	0	113.2	I688 I689 W694 Y746	I688-S692 WeakPolarHBondContact O-CB 3.16Å; I688-S692 PolarHBondContact O-N 3.39Å; I688-S692 PolarHBondContact O-OG 2.82Å; I689-S692 PolarHBondContact O-N 3.35Å; I689-S692 PolarHBondContact O-OG 3.49Å; S692-W694 VanDerWaalsContact C-N 3.33Å; S692-W694 VanDerWaalsContact OG-CB 3.26Å; S692-W694 WeakPolarHBondContact OG-CB 3.45Å; S692-W694 PolarHBondContact OG-N 2.92Å; S692-W694 VanDerWaalsContact OG-N 3.08Å; S692-Y746 WeakPolarHBondContact O-CD1 2.84Å; S692-Y746 VanDerWaalsContact O-CE1 3.26Å; S692-Y746 WeakPolarHBondContact O-CE1 3.28Å
693	G	82.5	Confident	72.9	Confident	3 Å²	3	67.2 Å²	67.2	3%	0.031	35%	0.353	C	S	.	.			trans	83.4	-0.6	-168.7	0	0	0	0	0	115.2	H691 E695 N696	H691-G693 VanDerWaalsContact C-N 3.34Å; G693-E695 VanDerWaalsContact C-N 3.32Å; G693-E695 PolarHBondContact O-N 2.85Å; G693-N696 WeakPolarHBondContact CA-ND2 3.41Å; G693-N696 WeakPolarHBondContact O-CB 3.02Å; G693-N696 PolarHBondContact O-N 3.27Å
694	W	82.4	Confident	70.4	Confident	93 Å²	93	72.1 Å²	72.1	35%	0.352	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-37.4	-175.1	177.4	56.1	0	0	0	114.5	I689 S692 D742 A743 Y746	I689-W694 HydrophobicContact CD1-CZ3 4.33Å; I689-W694 HydrophobicContact CG1-CE3 4.27Å; I689-W694 HydrophobicContact CG1-CZ3 4.44Å; I689-W694 HydrophobicContact CG2-CE3 4.15Å; S692-W694 VanDerWaalsContact C-N 3.33Å; S692-W694 VanDerWaalsContact OG-CB 3.26Å; S692-W694 WeakPolarHBondContact OG-CB 3.45Å; S692-W694 PolarHBondContact OG-N 2.92Å; S692-W694 VanDerWaalsContact OG-N 3.08Å; W694-D742 HydrophobicContact CD2-CB 4.02Å; W694-D742 HydrophobicContact CH2-CB 3.87Å; W694-D742 HydrophobicContact CZ2-CB 3.28Å; W694-D742 HydrophobicContact CZ3-CB 4.45Å; W694-A743 HydrophobicContact CB-CB 4.35Å; W694-A743 HydrophobicContact CE3-CB 4.38Å; W694-Y746 HydrophobicContact CB-CD1 4.23Å; W694-Y746 HydrophobicContact CB-CD2 4.34Å; W694-Y746 HydrophobicContact CB-CG 3.96Å; W694-Y746 AromaticContact CD1-CD2 3.86Å; W694-Y746 HydrophobicContact CG-CG 4.43Å
695	E	70.4	Confident	68	Low	138 Å²	138	78.9 Å²	78.9	65%	0.645	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.6	178.3	-68.3	-176.4	152.4	0	0	114.2	I689 G693 S697	I689-E695 HydrophobicContact CG2-CG 3.67Å; I689-E695 WeakPolarHBondContact CG2-OE2 3.2Å; G693-E695 VanDerWaalsContact C-N 3.32Å; G693-E695 PolarHBondContact O-N 2.85Å; E695-S697 PolarHBondContact O-N 2.89Å
696	N	55.9	Low	65.8	Low	81 Å²	81	82.3 Å²	82.3	43%	0.433	42%	0.422	S	S	.	.			trans	-74.8	115	-177.5	-74.5	-41.6	0	0	0	111.3	G693	G693-N696 WeakPolarHBondContact CA-ND2 3.41Å; G693-N696 WeakPolarHBondContact O-CB 3.02Å; G693-N696 PolarHBondContact O-N 3.27Å
697	S	44.4	Very low	63.9	Low	89 Å²	89	82.7 Å²	82.7	62%	0.622	42%	0.42	S	S	*	.			trans	-51.2	148.8	170.7	-177.5	0	0	0	0	112	E695 L699	E695-S697 PolarHBondContact O-N 2.89Å; S697-L699 PolarHBondContact O-N 3.38Å
698	P	44.4	Very low	61.9	Low	121 Å²	121	83.2 Å²	83.2	79%	0.786	42%	0.423	S	S	*	.	S	Bend	trans	-64.6	19.9	-170.4	-23.8	35.6	0	0	0	118.2
699	L	42.9	Very low	60.2	Low	151 Å²	151	87.9 Å²	87.9	79%	0.791	46%	0.455	S	S	*	.	S	Bend	trans	-109.9	18.8	-171.5	-131.8	77.1	0	0	0	113.9	S697	S697-L699 PolarHBondContact O-N 3.38Å
700	Q	43.1	Very low	59.7	Low	95 Å²	95	88.5 Å²	88.5	44%	0.444	46%	0.46	S	S	.	.			trans	-143.3	55.4	-173.4	-70.8	-68	-80.8	0	0	112.8	D702 R703	Q700-D702 PolarHBondContact O-N 3.3Å; Q700-R703 PolarHBondContact O-N 2.89Å
701	D	41.7	Very low	59.8	Low	106 Å²	106	88.1 Å²	88.1	57%	0.567	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-60.5	-39.8	-179.2	-88	-40.6	0	0	0	113.8	R703 K704	D701-R703 PolarHBondContact O-N 2.73Å; D701-K704 WeakPolarHBondContact O-CB 3.36Å; D701-K704 PolarHBondContact O-N 3.24Å; D701-K704 VanDerWaalsContact O-N 3.11Å; D701-K704 VanDerWaalsContact OD1-CE 3.29Å; D701-K704 WeakPolarHBondContact OD1-CE 3.48Å; D701-K704 IonicContact OD1-NZ 3.83Å; D701-K704 PolarHBondContact OD1-NZ 3.05Å
702	D	42.6	Very low	60.1	Low	163 Å²	163	87.3 Å²	87.3	87%	0.872	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-59	-19	-179.2	-75.7	-36.3	0	0	0	114.6	Q700	Q700-D702 PolarHBondContact O-N 3.3Å
703	R	48.8	Very low	60.4	Low	156 Å²	156	87.3 Å²	87.3	59%	0.589	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-83.4	-15.3	-179.8	-67.4	-169.8	-178.2	-161	-1.3	114.1	Q700 D701 I705 Q706	Q700-R703 PolarHBondContact O-N 2.89Å; D701-R703 PolarHBondContact O-N 2.73Å; R703-I705 VanDerWaalsContact C-N 3.32Å; R703-I705 PolarHBondContact O-N 2.79Å; R703-Q706 PolarHBondContact O-N 3.12Å
704	K	46.5	Very low	61.1	Low	104 Å²	104	91.8 Å²	91.8	45%	0.452	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-61.7	-37.8	-173.1	-72.4	174.1	173.7	170.9	0	113.1	D701 Q706	D701-K704 WeakPolarHBondContact O-CB 3.36Å; D701-K704 PolarHBondContact O-N 3.24Å; D701-K704 VanDerWaalsContact O-N 3.11Å; D701-K704 VanDerWaalsContact OD1-CE 3.29Å; D701-K704 WeakPolarHBondContact OD1-CE 3.48Å; D701-K704 IonicContact OD1-NZ 3.83Å; D701-K704 PolarHBondContact OD1-NZ 3.05Å; K704-Q706 VanDerWaalsContact C-N 3.27Å; K704-Q706 PolarHBondContact O-N 2.86Å
705	I	46.4	Very low	61.8	Low	143 Å²	143	87.3 Å²	87.3	73%	0.733	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-73.8	-14.4	-172.4	-59.2	173.5	0	0	0	112.8	R703	R703-I705 VanDerWaalsContact C-N 3.32Å; R703-I705 PolarHBondContact O-N 2.79Å
706	Q	49.2	Very low	63.2	Low	167 Å²	167	80.8 Å²	80.8	78%	0.78	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-100.6	-3.4	-176	-134.1	175.5	23.5	0	0	114.5	R703 K704	R703-Q706 PolarHBondContact O-N 3.12Å; K704-Q706 VanDerWaalsContact C-N 3.27Å; K704-Q706 PolarHBondContact O-N 2.86Å
707	L	52.6	Low	65.2	Low	34 Å²	34	76.9 Å²	76.9	18%	0.178	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-43.7	-170.6	-69.8	172	0	0	0	113.7	S709 S710	L707-S709 VanDerWaalsContact C-N 3.32Å; L707-S709 PolarHBondContact O-N 3.38Å; L707-S710 WeakPolarHBondContact O-CB 3.24Å; L707-S710 PolarHBondContact O-N 3.32Å; L707-S710 VanDerWaalsContact O-N 3.11Å
708	H	53.1	Low	67.7	Low	12 Å²	12	72.7 Å²	72.7	6%	0.056	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-25.2	-174.5	-62.5	-80.8	0	0	0	113.7	S710 V747 S750 E756 T761	H708-S710 PolarHBondContact O-N 2.99Å; H708-V747 PolarHBondContact CE1-O 2.69Å; H708-V747 VanDerWaalsContact CE1-O 3.28Å; H708-S750 WeakPolarHBondContact NE2-CB 3.3Å; H708-E756 HydrophobicContact CB-CB 4.47Å; H708-E756 WeakPolarHBondContact CB-OE1 3.48Å; H708-E756 WeakPolarHBondContact CB-OE2 3.47Å; H708-E756 IonicContact CD2-OE2 3.2Å; H708-E756 PolarHBondContact CD2-OE2 3.41Å; H708-E756 VanDerWaalsContact CD2-OE2 3.24Å; H708-E756 IonicContact CG-OE2 2.71Å; H708-T761 PolarHBondContact O-OG1 3.38Å
709	S	59.1	Low	70.3	Confident	98 Å²	98	66.9 Å²	66.9	69%	0.685	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-5.1	171.3	-163.2	0	0	0	0	113.7	L707 Q711	L707-S709 VanDerWaalsContact C-N 3.32Å; L707-S709 PolarHBondContact O-N 3.38Å; S709-Q711 PolarHBondContact O-N 3.35Å
710	S	82	Confident	73	Confident	19 Å²	19	59.8 Å²	59.8	13%	0.133	29%	0.293	C	S	.	.			trans	-61.7	104.6	177.8	177.7	0	0	0	0	111.9	H691 L707 H708 V712 L713 R714	H691-S710 PolarHBondContact ND1-OG 3.39Å; L707-S710 WeakPolarHBondContact O-CB 3.24Å; L707-S710 PolarHBondContact O-N 3.32Å; L707-S710 VanDerWaalsContact O-N 3.11Å; H708-S710 PolarHBondContact O-N 2.99Å; S710-V712 PolarHBondContact O-N 2.98Å; S710-L713 WeakPolarHBondContact O-CB 3.43Å; S710-L713 PolarHBondContact O-N 3.08Å; S710-L713 PolarHBondContact OG-N 2.82Å; S710-R714 PolarHBondContact O-N 3.29Å
711	Q	91.7	Very high	75.6	Confident	53 Å²	53	56.7 Å²	56.7	25%	0.248	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-25.1	174.7	-173.6	62	48.2	0	0	111.8	E656 S709 N715	E656-Q711 VanDerWaalsContact CD-CG 3.42Å; E656-Q711 HydrophobicContact CG-CB 3.93Å; E656-Q711 HydrophobicContact CG-CG 3.57Å; S709-Q711 PolarHBondContact O-N 3.35Å; Q711-N715 PolarHBondContact NE2-OD1 2.9Å; Q711-N715 WeakPolarHBondContact O-CB 3.24Å; Q711-N715 PolarHBondContact O-N 3.33Å; Q711-N715 PolarHBondContact O-OD1 3.34Å
712	V	94.4	Very high	78.3	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-45.7	171.7	-166.7	0	0	0	0	111	R655 E656 T659 V687 S710 N715 A716	R655-V712 HydrophobicContact CB-CG1 3.9Å; R655-V712 HydrophobicContact CB-CG2 4.31Å; E656-V712 HydrophobicContact CB-CG2 4.09Å; E656-V712 HydrophobicContact CG-CG2 4.47Å; T659-V712 HydrophobicContact CG2-CG1 3.93Å; V687-V712 HydrophobicContact CG1-CB 4.5Å; V687-V712 HydrophobicContact CG1-CG1 3.83Å; V687-V712 HydrophobicContact CG2-CG1 4.2Å; S710-V712 PolarHBondContact O-N 2.98Å; V712-N715 PolarHBondContact O-N 3.18Å; V712-A716 WeakPolarHBondContact O-CB 3.45Å; V712-A716 PolarHBondContact O-N 3.29Å
713	L	95.3	Very high	81	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-41.3	174.7	-179.8	62.9	0	0	0	111.5	I688 H691 S710 A716 T717 V747 T761	I688-L713 HydrophobicContact CD1-CD1 3.82Å; H691-L713 HydrophobicContact CB-CB 3.98Å; H691-L713 HydrophobicContact CB-CD1 4.21Å; H691-L713 HydrophobicContact CB-CD2 4.17Å; H691-L713 HydrophobicContact CB-CG 4.34Å; S710-L713 WeakPolarHBondContact O-CB 3.43Å; S710-L713 PolarHBondContact O-N 3.08Å; S710-L713 PolarHBondContact OG-N 2.82Å; L713-A716 PolarHBondContact O-N 3.41Å; L713-T717 HydrophobicContact CD1-CG2 4.01Å; L713-T717 HydrophobicContact CG-CG2 4.37Å; L713-T717 WeakPolarHBondContact O-CB 3.45Å; L713-T717 VanDerWaalsContact O-CG2 3.31Å; L713-T717 WeakPolarHBondContact O-CG2 3.49Å; L713-T717 PolarHBondContact O-N 2.97Å; L713-T717 PolarHBondContact O-OG1 3.25Å; L713-V747 HydrophobicContact CD2-CG2 4.33Å; L713-T761 HydrophobicContact CD2-CG2 3.86Å; L713-T761 HydrophobicContact CG-CG2 3.87Å
714	R	96.2	Very high	83.3	Confident	96 Å²	96	37.7 Å²	37.7	36%	0.362	19%	0.188	S	C	.	.	H	α-helix	trans	-60.9	-43.5	175.3	-176.2	178.8	170	-161.2	11.2	112.2	S710 T717 G718 K760 N764	S710-R714 PolarHBondContact O-N 3.29Å; R714-T717 PolarHBondContact O-OG1 3.25Å; R714-T717 VanDerWaalsContact O-OG1 3.08Å; R714-G718 PolarHBondContact O-N 2.92Å; R714-K760 HydrophobicContact CG-CB 4.48Å; R714-N764 PolarHBondContact O-ND2 2.85Å
715	N	97.8	Very high	85.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.7	-45	175.7	-72.2	-5.5	0	0	0	111.6	E656 T659 G660 W663 Q711 V712 G718 C719	E656-N715 PolarHBondContact O-ND2 3.08Å; T659-N715 VanDerWaalsContact OG1-CB 3.31Å; T659-N715 WeakPolarHBondContact OG1-CB 3.31Å; T659-N715 PolarHBondContact OG1-ND2 2.95Å; G660-N715 PolarHBondContact N-ND2 2.72Å; W663-N715 HydrophobicContact CE3-CB 4.24Å; W663-N715 WeakPolarHBondContact CZ3-OD1 3.46Å; Q711-N715 PolarHBondContact NE2-OD1 2.9Å; Q711-N715 WeakPolarHBondContact O-CB 3.24Å; Q711-N715 PolarHBondContact O-N 3.33Å; Q711-N715 PolarHBondContact O-OD1 3.34Å; V712-N715 PolarHBondContact O-N 3.18Å; N715-G718 PolarHBondContact O-N 2.79Å; N715-C719 WeakPolarHBondContact O-CB 3.36Å; N715-C719 PolarHBondContact O-N 2.86Å
716	A	98.2	Very high	87.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-44.5	179.8	0	0	0	0	0	112.5	T659 L683 V687 I688 V712 L713 G718 C719 L720	T659-A716 HydrophobicContact CG2-CB 4.32Å; L683-A716 HydrophobicContact CD2-CB 4.02Å; V687-A716 HydrophobicContact CB-CB 4.09Å; V687-A716 HydrophobicContact CG1-CB 3.66Å; I688-A716 HydrophobicContact CD1-CB 3.7Å; V712-A716 WeakPolarHBondContact O-CB 3.45Å; V712-A716 PolarHBondContact O-N 3.29Å; L713-A716 PolarHBondContact O-N 3.41Å; A716-G718 VanDerWaalsContact C-N 3.33Å; A716-G718 PolarHBondContact O-N 3.07Å; A716-C719 WeakPolarHBondContact O-CB 3.35Å; A716-C719 PolarHBondContact O-N 3.26Å; A716-L720 WeakPolarHBondContact O-CG 3.42Å; A716-L720 PolarHBondContact O-N 3.25Å
717	T	98.2	Very high	89.8	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.5	-36.3	173.4	54.7	0	0	0	0	111.8	I688 L713 R714 L720 R721 L744 N764	I688-T717 HydrophobicContact CD1-CG2 3.82Å; L713-T717 HydrophobicContact CD1-CG2 4.01Å; L713-T717 HydrophobicContact CG-CG2 4.37Å; L713-T717 WeakPolarHBondContact O-CB 3.45Å; L713-T717 VanDerWaalsContact O-CG2 3.31Å; L713-T717 WeakPolarHBondContact O-CG2 3.49Å; L713-T717 PolarHBondContact O-N 2.97Å; L713-T717 PolarHBondContact O-OG1 3.25Å; R714-T717 PolarHBondContact O-OG1 3.25Å; R714-T717 VanDerWaalsContact O-OG1 3.08Å; T717-L720 PolarHBondContact O-N 3.31Å; T717-R721 WeakPolarHBondContact O-CB 3.27Å; T717-R721 PolarHBondContact O-N 3.31Å; T717-L744 HydrophobicContact CG2-CD2 4.25Å; T717-N764 PolarHBondContact OG1-ND2 3.25Å
718	G	98.4	Very high	91.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-41	172.6	0	0	0	0	0	113	W663 R714 N715 A716 N722 N764	W663-G718 PolarHBondContact NE1-O 2.95Å; R714-G718 PolarHBondContact O-N 2.92Å; N715-G718 PolarHBondContact O-N 2.79Å; A716-G718 VanDerWaalsContact C-N 3.33Å; A716-G718 PolarHBondContact O-N 3.07Å; G718-N722 PolarHBondContact O-N 3.28Å; G718-N764 WeakPolarHBondContact CA-ND2 3.49Å; G718-N764 PolarHBondContact N-ND2 3.18Å; G718-N764 VanDerWaalsContact N-ND2 3.18Å
719	C	98.6	Very high	93.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-48.7	173.2	-173.4	0	0	0	0	111.5	L662 W663 L683 N715 A716 R721 N722 V723	L662-C719 VanDerWaalsContact C-SG 3.57Å; L662-C719 PolarHBondContact O-SG 3.31Å; W663-C719 HydrophobicContact CB-CB 4.19Å; L683-C719 HydrophobicContact CD1-CB 4.39Å; N715-C719 WeakPolarHBondContact O-CB 3.36Å; N715-C719 PolarHBondContact O-N 2.86Å; A716-C719 WeakPolarHBondContact O-CB 3.35Å; A716-C719 PolarHBondContact O-N 3.26Å; C719-R721 PolarHBondContact O-N 2.83Å; C719-N722 PolarHBondContact O-N 3.4Å; C719-V723 PolarHBondContact O-N 3.34Å
720	L	98.7	Very high	95.3	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-64.8	-37.3	179.6	-68.7	-174.6	0	0	0	113	L680 L683 I688 A716 T717 V723 S724 M734 L740 I768	L680-L720 HydrophobicContact CD1-CD2 3.69Å; L683-L720 HydrophobicContact CB-CD2 4.47Å; L683-L720 HydrophobicContact CD1-CD2 3.97Å; L683-L720 HydrophobicContact CD1-CG 4.39Å; I688-L720 HydrophobicContact CD1-CD1 4.05Å; I688-L720 HydrophobicContact CG1-CD1 3.78Å; A716-L720 WeakPolarHBondContact O-CG 3.42Å; A716-L720 PolarHBondContact O-N 3.25Å; T717-L720 PolarHBondContact O-N 3.31Å; L720-V723 HydrophobicContact CD2-CG2 4.27Å; L720-V723 WeakPolarHBondContact O-CG2 3.38Å; L720-V723 PolarHBondContact O-N 3.33Å; L720-S724 WeakPolarHBondContact O-CB 3.37Å; L720-S724 PolarHBondContact O-N 2.64Å; L720-M734 HydrophobicContact CB-CE 3.98Å; L720-M734 HydrophobicContact CD2-CE 4.35Å; L720-L740 HydrophobicContact CD1-CD1 3.78Å; L720-L740 HydrophobicContact CD1-CD2 4.44Å; L720-I768 HydrophobicContact CB-CD1 3.76Å; L720-I768 HydrophobicContact CB-CG1 4.39Å
721	R	98.4	Very high	96	Very high	30 Å²	30	20 Å²	20	11%	0.113	10%	0.103	C	C	.	.	H	α-helix	trans	-55.5	-51.9	171.7	173.6	-176.8	178.5	164.2	2.5	111.1	T717 C719 V723 S724 E763 N764 C767 I768	T717-R721 WeakPolarHBondContact O-CB 3.27Å; T717-R721 PolarHBondContact O-N 3.31Å; C719-R721 PolarHBondContact O-N 2.83Å; R721-V723 PolarHBondContact O-N 3.29Å; R721-S724 PolarHBondContact O-N 3.11Å; R721-S724 PolarHBondContact O-OG 3.13Å; R721-E763 IonicContact CZ-OE1 3.18Å; R721-E763 IonicContact NH1-OE1 2.83Å; R721-E763 PolarHBondContact NH1-OE1 2.88Å; R721-E763 IonicContact NH2-OE1 3.47Å; R721-E763 PolarHBondContact NH2-OE1 2.9Å; R721-E763 VanDerWaalsContact NH2-OE1 3.17Å; R721-N764 VanDerWaalsContact CD-OD1 3.25Å; R721-N764 WeakPolarHBondContact CD-OD1 3.06Å; R721-N764 PolarHBondContact NH1-OD1 3.14Å; R721-C767 HydrophobicContact CG-CB 3.92Å; R721-C767 VanDerWaalsContact CZ-SG 3.55Å; R721-I768 HydrophobicContact CB-CG1 4.01Å
722	N	98.2	Very high	96.1	Very high	26 Å²	26	20.7 Å²	20.7	14%	0.139	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-47.1	-178.6	-71.8	-8.7	0	0	0	111.7	S666 K672 G718 C719 S724 S725	S666-N722 WeakPolarHBondContact O-CB 3.18Å; S666-N722 WeakPolarHBondContact OG-CB 3.29Å; S666-N722 PolarHBondContact OG-ND2 3.11Å; K672-N722 WeakPolarHBondContact CE-O 3.1Å; G718-N722 PolarHBondContact O-N 3.28Å; C719-N722 PolarHBondContact O-N 3.4Å; N722-S724 PolarHBondContact O-N 3.01Å; N722-S725 PolarHBondContact O-N 3.02Å; N722-S725 PolarHBondContact O-OG 3.46Å
723	V	98.4	Very high	96.1	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-72.8	-26.2	-177.9	-56.6	0	0	0	0	113.8	K672 I675 I676 C719 L720 R721 S725 A726 M734	K672-V723 HydrophobicContact CB-CB 4.24Å; K672-V723 HydrophobicContact CB-CG1 4.02Å; K672-V723 HydrophobicContact CG-CG1 4.2Å; I675-V723 HydrophobicContact CB-CG1 4.03Å; I675-V723 HydrophobicContact CG2-CG1 3.81Å; I676-V723 HydrophobicContact CD1-CB 3.97Å; I676-V723 HydrophobicContact CD1-CG2 3.54Å; I676-V723 HydrophobicContact CG1-CB 3.88Å; I676-V723 HydrophobicContact CG1-CG2 3.98Å; C719-V723 PolarHBondContact O-N 3.34Å; L720-V723 HydrophobicContact CD2-CG2 4.27Å; L720-V723 WeakPolarHBondContact O-CG2 3.38Å; L720-V723 PolarHBondContact O-N 3.33Å; R721-V723 PolarHBondContact O-N 3.29Å; V723-S725 PolarHBondContact O-N 3.39Å; V723-A726 VanDerWaalsContact O-CB 3.32Å; V723-A726 WeakPolarHBondContact O-CB 3.5Å; V723-A726 PolarHBondContact O-N 2.99Å; V723-M734 HydrophobicContact CG2-SD 4.15Å
724	S	97.7	Very high	96.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15	174.7	74.5	0	0	0	0	114.4	L720 R721 N722 N771	L720-S724 WeakPolarHBondContact O-CB 3.37Å; L720-S724 PolarHBondContact O-N 2.64Å; R721-S724 PolarHBondContact O-N 3.11Å; R721-S724 PolarHBondContact O-OG 3.13Å; N722-S724 PolarHBondContact O-N 3.01Å; S724-N771 WeakPolarHBondContact OG-CB 3.18Å; S724-N771 PolarHBondContact OG-ND2 3.09Å
725	S	95.6	Very high	96.1	Very high	21 Å²	21	20.5 Å²	20.5	15%	0.147	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.4	174.3	68.6	0	0	0	0	114.6	K672 N722 V723 G727	K672-S725 PolarHBondContact NZ-OG 2.9Å; N722-S725 PolarHBondContact O-N 3.02Å; N722-S725 PolarHBondContact O-OG 3.46Å; V723-S725 PolarHBondContact O-N 3.39Å; S725-G727 PolarHBondContact O-N 2.68Å
726	A	91.3	Very high	95.8	Very high	30 Å²	30	25.6 Å²	25.6	25%	0.248	13%	0.126	C	C	.	.	S	Bend	trans	-76.9	38.9	-168.3	0	0	0	0	0	115.6	K672 V723 A730	K672-A726 HydrophobicContact CB-CB 3.52Å; K672-A726 HydrophobicContact CD-CB 3.83Å; K672-A726 HydrophobicContact CG-CB 4.3Å; V723-A726 VanDerWaalsContact O-CB 3.32Å; V723-A726 WeakPolarHBondContact O-CB 3.5Å; V723-A726 PolarHBondContact O-N 2.99Å; A726-A730 HydrophobicContact CB-CB 3.86Å
727	G	91.6	Very high	95.6	Very high	27 Å²	27	26.4 Å²	26.4	28%	0.278	13%	0.131	S	C	.	.			trans	82.1	-171.9	179.6	0	0	0	0	0	114.8	S725 R731	S725-G727 PolarHBondContact O-N 2.68Å; G727-R731 VanDerWaalsContact C-CZ 3.48Å; G727-R731 PolarHBondContact O-N 2.72Å; G727-R731 PolarHBondContact O-NH1 3.23Å
728	E	92.1	Very high	95.4	Very high	42 Å²	42	33 Å²	33	20%	0.196	17%	0.167	C	C	.	.	H	α-helix	trans	-63.5	-43.4	-171.1	175.2	169.9	151.3	0	0	113	A730 R731 R732 R775 E779	E728-A730 VanDerWaalsContact C-N 3.33Å; E728-A730 PolarHBondContact O-N 3.48Å; E728-R731 PolarHBondContact O-N 3.25Å; E728-R732 WeakPolarHBondContact O-CB 3.4Å; E728-R732 PolarHBondContact O-N 3.33Å; E728-R732 IonicContact OE1-CZ 2.88Å; E728-R732 IonicContact OE1-NH2 3.83Å; E728-R732 PolarHBondContact OE1-NH2 2.95Å; E728-R775 IonicContact OE2-CZ 2.82Å; E728-R775 IonicContact OE2-NH1 2.71Å; E728-R775 PolarHBondContact OE2-NH1 2.74Å; E728-R775 IonicContact OE2-NH2 3.93Å; E728-E779 HydrophobicContact CG-CB 4.12Å; E728-E779 HydrophobicContact CG-CG 3.75Å
729	E	93.1	Very high	95.1	Very high	64 Å²	64	33.4 Å²	33.4	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-67.5	-31.3	-175	-179.9	69.1	170.8	0	0	112.9	M673 R732 R733	M673-E729 HydrophobicContact CE-CB 4.41Å; M673-E729 HydrophobicContact CE-CG 3.78Å; E729-R732 IonicContact OE2-CZ 2.67Å; E729-R732 IonicContact OE2-NE 2.84Å; E729-R732 IonicContact OE2-NH1 2.62Å; E729-R732 PolarHBondContact OE2-NH1 3.47Å; E729-R733 VanDerWaalsContact CD-NH1 3.27Å; E729-R733 VanDerWaalsContact CG-NH1 3.3Å; E729-R733 PolarHBondContact O-N 2.92Å; E729-R733 IonicContact OE1-CZ 2.75Å; E729-R733 IonicContact OE1-NH1 2.91Å; E729-R733 PolarHBondContact OE1-NH1 3.21Å; E729-R733 IonicContact OE1-NH2 3.31Å; E729-R733 PolarHBondContact OE1-NH2 3.35Å
730	A	95.8	Very high	95	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-69.1	-45.9	171.2	0	0	0	0	0	111.3	M673 I676 A726 E728 R732 M734	M673-A730 HydrophobicContact SD-CB 3.91Å; I676-A730 HydrophobicContact CD1-CB 4.22Å; I676-A730 HydrophobicContact CG1-CB 4.08Å; A726-A730 HydrophobicContact CB-CB 3.86Å; E728-A730 VanDerWaalsContact C-N 3.33Å; E728-A730 PolarHBondContact O-N 3.48Å; A730-R732 VanDerWaalsContact C-N 3.3Å; A730-R732 PolarHBondContact O-N 3.43Å; A730-M734 WeakPolarHBondContact O-CB 3.27Å; A730-M734 VanDerWaalsContact O-CG 3.32Å; A730-M734 WeakPolarHBondContact O-CG 3.47Å; A730-M734 PolarHBondContact O-N 2.76Å
731	R	96	Very high	94.8	Very high	22 Å²	22	33.4 Å²	33.4	8%	0.083	17%	0.171	C	C	.	.	H	α-helix	trans	-61.9	-37.8	175.2	-68.5	-174.7	-70.3	-86.8	8	112.1	G727 E728 M734 R735 N771 L772 E779	G727-R731 VanDerWaalsContact C-CZ 3.48Å; G727-R731 PolarHBondContact O-N 2.72Å; G727-R731 PolarHBondContact O-NH1 3.23Å; E728-R731 PolarHBondContact O-N 3.25Å; R731-M734 PolarHBondContact O-N 3.15Å; R731-R735 WeakPolarHBondContact O-CB 3.28Å; R731-R735 VanDerWaalsContact O-CG 3.26Å; R731-R735 WeakPolarHBondContact O-CG 3.46Å; R731-R735 PolarHBondContact O-N 3.26Å; R731-R735 PolarHBondContact O-NE 2.66Å; R731-N771 WeakPolarHBondContact CD-O 3.31Å; R731-L772 HydrophobicContact CB-CD2 4.31Å; R731-L772 HydrophobicContact CG-CD2 4.36Å; R731-E779 IonicContact CZ-OE1 2.71Å; R731-E779 IonicContact CZ-OE2 3.17Å; R731-E779 IonicContact NE-OE1 3.52Å; R731-E779 PolarHBondContact NE-OE1 2.96Å; R731-E779 IonicContact NE-OE2 3.94Å; R731-E779 PolarHBondContact NE-OE2 3.48Å; R731-E779 IonicContact NH2-OE1 3.24Å; R731-E779 PolarHBondContact NH2-OE1 3.36Å; R731-E779 IonicContact NH2-OE2 2.66Å
732	R	93.4	Very high	94.6	Very high	67 Å²	67	32.7 Å²	32.7	25%	0.253	17%	0.169	S	C	.	.	H	α-helix	trans	-57.4	-61.9	175.7	-172	-179.1	-63.6	155.9	-9.8	110.5	E728 E729 A730 M734 R735 E736	E728-R732 WeakPolarHBondContact O-CB 3.4Å; E728-R732 PolarHBondContact O-N 3.33Å; E728-R732 IonicContact OE1-CZ 2.88Å; E728-R732 IonicContact OE1-NH2 3.83Å; E728-R732 PolarHBondContact OE1-NH2 2.95Å; E729-R732 IonicContact OE2-CZ 2.67Å; E729-R732 IonicContact OE2-NE 2.84Å; E729-R732 IonicContact OE2-NH1 2.62Å; E729-R732 PolarHBondContact OE2-NH1 3.47Å; A730-R732 VanDerWaalsContact C-N 3.3Å; A730-R732 PolarHBondContact O-N 3.43Å; R732-M734 VanDerWaalsContact C-N 3.29Å; R732-M734 PolarHBondContact O-N 2.83Å; R732-R735 PolarHBondContact O-N 3.17Å; R732-E736 WeakPolarHBondContact CG-OE1 3.34Å; R732-E736 WeakPolarHBondContact O-CG 3.46Å; R732-E736 PolarHBondContact O-N 2.95Å
733	R	95.1	Very high	94.4	Very high	89 Å²	89	31.4 Å²	31.4	34%	0.336	16%	0.163	S	C	.	.	H	α-helix	trans	-58.3	-34.8	177.3	-73.8	-164.1	179.9	73.2	19.7	114.3	I676 L680 E729 E736 C737	I676-R733 HydrophobicContact CG2-CB 3.98Å; I676-R733 HydrophobicContact CG2-CG 4.4Å; L680-R733 HydrophobicContact CD2-CB 4.02Å; E729-R733 VanDerWaalsContact CD-NH1 3.27Å; E729-R733 VanDerWaalsContact CG-NH1 3.3Å; E729-R733 PolarHBondContact O-N 2.92Å; E729-R733 IonicContact OE1-CZ 2.75Å; E729-R733 IonicContact OE1-NH1 2.91Å; E729-R733 PolarHBondContact OE1-NH1 3.21Å; E729-R733 IonicContact OE1-NH2 3.31Å; E729-R733 PolarHBondContact OE1-NH2 3.35Å; R733-E736 PolarHBondContact O-N 2.9Å; R733-C737 WeakPolarHBondContact O-CB 3.48Å; R733-C737 PolarHBondContact O-N 2.99Å; R733-C737 VanDerWaalsContact O-N 3.08Å
734	M	96.9	Very high	94.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71.5	-32.3	176.3	-72.3	-175.8	73.4	0	0	113.4	I676 L680 L720 V723 A730 R731 R732 L740 I768 L772	I676-M734 HydrophobicContact CD1-CG 3.61Å; I676-M734 HydrophobicContact CD1-SD 3.79Å; L680-M734 HydrophobicContact CD1-CG 3.85Å; L680-M734 HydrophobicContact CD2-CG 3.93Å; L720-M734 HydrophobicContact CB-CE 3.98Å; L720-M734 HydrophobicContact CD2-CE 4.35Å; V723-M734 HydrophobicContact CG2-SD 4.15Å; A730-M734 WeakPolarHBondContact O-CB 3.27Å; A730-M734 VanDerWaalsContact O-CG 3.32Å; A730-M734 WeakPolarHBondContact O-CG 3.47Å; A730-M734 PolarHBondContact O-N 2.76Å; R731-M734 PolarHBondContact O-N 3.15Å; R732-M734 VanDerWaalsContact C-N 3.29Å; R732-M734 PolarHBondContact O-N 2.83Å; M734-L740 HydrophobicContact CB-CD2 4.33Å; M734-L740 HydrophobicContact CE-CD2 4.11Å; M734-I768 HydrophobicContact CE-CG2 3.77Å; M734-L772 HydrophobicContact CB-CD1 4.27Å; M734-L772 HydrophobicContact CB-CD2 3.53Å; M734-L772 HydrophobicContact CE-CD2 4.44Å; M734-L772 HydrophobicContact CG-CD2 4.46Å; M734-L772 HydrophobicContact SD-CD2 4.24Å
735	R	93.9	Very high	94.2	Very high	10 Å²	10	31.5 Å²	31.5	4%	0.038	16%	0.163	C	C	.	.	H	α-helix	trans	-73.7	-29.1	173.4	-75.9	180	-63.6	-130.3	0.9	112.5	R731 R732 L772 L776 E779 I839 L842	R731-R735 WeakPolarHBondContact O-CB 3.28Å; R731-R735 VanDerWaalsContact O-CG 3.26Å; R731-R735 WeakPolarHBondContact O-CG 3.46Å; R731-R735 PolarHBondContact O-N 3.26Å; R731-R735 PolarHBondContact O-NE 2.66Å; R732-R735 PolarHBondContact O-N 3.17Å; R735-L772 HydrophobicContact CG-CB 4.04Å; R735-L772 HydrophobicContact CG-CD1 4.3Å; R735-L772 HydrophobicContact CG-CD2 4.34Å; R735-L772 HydrophobicContact CG-CG 4.44Å; R735-L772 PolarHBondContact NH1-O 2.86Å; R735-L776 VanDerWaalsContact CD-CD1 3.5Å; R735-E779 IonicContact CZ-OE2 2.64Å; R735-E779 VanDerWaalsContact CZ-OE2 3.31Å; R735-E779 IonicContact NH1-OE2 3.38Å; R735-E779 PolarHBondContact NH1-OE2 3.1Å; R735-E779 IonicContact NH2-OE2 2.73Å; R735-E779 PolarHBondContact NH2-OE2 2.98Å; R735-I839 HydrophobicContact CB-CD1 3.79Å; R735-I839 HydrophobicContact CB-CG1 3.93Å; R735-I839 HydrophobicContact CG-CD1 4.42Å; R735-I839 HydrophobicContact CG-CG1 4.29Å; R735-L842 HydrophobicContact CG-CD1 3.83Å
736	E	91.7	Very high	94.1	Very high	108 Å²	108	33.3 Å²	33.3	51%	0.505	17%	0.167	S	C	.	.	S	Bend	trans	-87.1	-2.8	176.7	-68.9	153.2	-174.1	0	0	113.3	R732 R733 D738	R732-E736 WeakPolarHBondContact CG-OE1 3.34Å; R732-E736 WeakPolarHBondContact O-CG 3.46Å; R732-E736 PolarHBondContact O-N 2.95Å; R733-E736 PolarHBondContact O-N 2.9Å; E736-D738 PolarHBondContact O-N 3.48Å
737	C	95	Very high	94.3	Very high	16 Å²	16	31.9 Å²	31.9	11%	0.108	16%	0.155	C	C	.	.	S	Bend	trans	-82.2	108.1	177.2	-170.3	0	0	0	0	110.1	L680 T684 R733 L740	L680-C737 HydrophobicContact CD2-CB 4.28Å; L680-C737 HydrophobicContact CG-CB 4.3Å; T684-C737 PolarHBondContact OG1-SG 2.96Å; T684-C737 VanDerWaalsContact OG1-SG 3.41Å; R733-C737 WeakPolarHBondContact O-CB 3.48Å; R733-C737 PolarHBondContact O-N 2.99Å; R733-C737 VanDerWaalsContact O-N 3.08Å; C737-L740 HydrophobicContact CB-CB 4.14Å; C737-L740 HydrophobicContact CB-CD2 4.15Å; C737-L740 VanDerWaalsContact O-CB 3.32Å; C737-L740 WeakPolarHBondContact O-CB 3.46Å; C737-L740 PolarHBondContact O-N 3.05Å
738	D	92.8	Very high	94.5	Very high	139 Å²	139	30.6 Å²	30.6	74%	0.743	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	138.5	-179	-68	-50.7	0	0	0	113.2	E736 L740	E736-D738 PolarHBondContact O-N 3.48Å; D738-L740 PolarHBondContact O-N 2.86Å
739	G	92.4	Very high	94.5	Very high	9 Å²	9	32.9 Å²	32.9	9%	0.093	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	-11	179.8	0	0	0	0	0	116.3	A743	G739-A743 WeakPolarHBondContact O-CB 3.44Å; G739-A743 PolarHBondContact O-N 3.33Å
740	L	96.8	Very high	94.4	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-46.5	-177.4	-179.3	56.7	0	0	0	111.9	L680 T684 I688 L720 M734 C737 D738 L744	L680-L740 HydrophobicContact CD1-CD2 3.89Å; T684-L740 HydrophobicContact CG2-CB 3.77Å; T684-L740 HydrophobicContact CG2-CD1 4.17Å; T684-L740 HydrophobicContact CG2-CG 4.5Å; I688-L740 HydrophobicContact CB-CD1 4.45Å; I688-L740 HydrophobicContact CG1-CD1 4.23Å; I688-L740 HydrophobicContact CG2-CD1 4.14Å; L720-L740 HydrophobicContact CD1-CD1 3.78Å; L720-L740 HydrophobicContact CD1-CD2 4.44Å; M734-L740 HydrophobicContact CB-CD2 4.33Å; M734-L740 HydrophobicContact CE-CD2 4.11Å; C737-L740 HydrophobicContact CB-CB 4.14Å; C737-L740 HydrophobicContact CB-CD2 4.15Å; C737-L740 VanDerWaalsContact O-CB 3.32Å; C737-L740 WeakPolarHBondContact O-CB 3.46Å; C737-L740 PolarHBondContact O-N 3.05Å; D738-L740 PolarHBondContact O-N 2.86Å; L740-L744 HydrophobicContact CD1-CD1 3.77Å; L740-L744 HydrophobicContact CD1-CG 3.98Å; L740-L744 HydrophobicContact CG-CD1 3.92Å; L740-L744 WeakPolarHBondContact O-CB 3.23Å; L740-L744 WeakPolarHBondContact O-CD1 3.29Å; L740-L744 WeakPolarHBondContact O-CG 3.29Å; L740-L744 PolarHBondContact O-N 3.47Å; L740-L744 VanDerWaalsContact O-N 3.08Å
741	T	95.2	Very high	94.3	Very high	1 Å²	1	32 Å²	32	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-42.4	-178.2	-62.4	0	0	0	0	111.2	L745 L769 G838 M841 L842	T741-L745 HydrophobicContact CG2-CD1 4.01Å; T741-L745 WeakPolarHBondContact O-CB 3.42Å; T741-L745 WeakPolarHBondContact O-CG 3.48Å; T741-L745 PolarHBondContact O-N 2.87Å; T741-L769 HydrophobicContact CG2-CD2 4.18Å; T741-G838 VanDerWaalsContact CG2-O 3.27Å; T741-G838 WeakPolarHBondContact CG2-O 3.47Å; T741-M841 HydrophobicContact CG2-CB 4.31Å; T741-L842 HydrophobicContact CG2-CD2 3.77Å; T741-L842 HydrophobicContact CG2-CG 3.95Å
742	D	93.3	Very high	94.1	Very high	14 Å²	14	33.1 Å²	33.1	8%	0.075	16%	0.161	C	C	.	.	H	α-helix	trans	-64.3	-47.8	179.6	-46.5	-104.1	0	0	0	111.4	W694 L745 Y746 K837 G838	W694-D742 HydrophobicContact CD2-CB 4.02Å; W694-D742 HydrophobicContact CH2-CB 3.87Å; W694-D742 HydrophobicContact CZ2-CB 3.28Å; W694-D742 HydrophobicContact CZ3-CB 4.45Å; D742-L745 PolarHBondContact O-N 3Å; D742-Y746 WeakPolarHBondContact O-CB 3.32Å; D742-Y746 PolarHBondContact O-N 2.9Å; D742-K837 WeakPolarHBondContact OD1-CA 3.35Å; D742-G838 VanDerWaalsContact CG-N 3.29Å; D742-G838 PolarHBondContact OD1-N 3.36Å; D742-G838 WeakPolarHBondContact OD2-CA 3.15Å; D742-G838 PolarHBondContact OD2-N 2.95Å; D742-G838 VanDerWaalsContact OD2-N 3.1Å
743	A	95.6	Very high	93.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-38.9	179.2	0	0	0	0	0	112.5	I688 I689 W694 G739 L745 Y746 V747	I688-A743 HydrophobicContact CG2-CB 3.96Å; I689-A743 HydrophobicContact CG1-CB 4.04Å; W694-A743 HydrophobicContact CB-CB 4.35Å; W694-A743 HydrophobicContact CE3-CB 4.38Å; G739-A743 WeakPolarHBondContact O-CB 3.44Å; G739-A743 PolarHBondContact O-N 3.33Å; A743-L745 VanDerWaalsContact C-N 3.35Å; A743-Y746 PolarHBondContact O-N 2.9Å; A743-V747 WeakPolarHBondContact O-CG2 3.37Å; A743-V747 PolarHBondContact O-N 3.35Å
744	L	96.8	Very high	93.6	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-38.2	174	-69.7	171.6	0	0	0	112	I688 T717 L740 I748 C765 I768 L769	I688-L744 HydrophobicContact CG2-CD2 4.26Å; T717-L744 HydrophobicContact CG2-CD2 4.25Å; L740-L744 HydrophobicContact CD1-CD1 3.77Å; L740-L744 HydrophobicContact CD1-CG 3.98Å; L740-L744 HydrophobicContact CG-CD1 3.92Å; L740-L744 WeakPolarHBondContact O-CB 3.23Å; L740-L744 WeakPolarHBondContact O-CD1 3.29Å; L740-L744 WeakPolarHBondContact O-CG 3.29Å; L740-L744 PolarHBondContact O-N 3.47Å; L740-L744 VanDerWaalsContact O-N 3.08Å; L744-I748 WeakPolarHBondContact O-CG1 3.13Å; L744-I748 PolarHBondContact O-N 3.15Å; L744-C765 HydrophobicContact CD2-CB 4.09Å; L744-C765 WeakPolarHBondContact CD2-SG 3.5Å; L744-I768 HydrophobicContact CD1-CB 4.14Å; L744-I768 HydrophobicContact CD1-CD1 4.2Å; L744-I768 HydrophobicContact CD1-CG2 3.57Å; L744-I768 HydrophobicContact CD2-CD1 3.91Å; L744-L769 HydrophobicContact CB-CD1 4.37Å; L744-L769 HydrophobicContact CB-CD2 4.2Å; L744-L769 HydrophobicContact CB-CG 4.33Å; L744-L769 HydrophobicContact CD1-CD2 4.27Å
745	L	94.6	Very high	93.1	Very high	3 Å²	3	37 Å²	37	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-71.6	-36.7	175.1	-79.4	169.3	0	0	0	112.4	T741 D742 A743 I748 Q749 L769 M841 I847	T741-L745 HydrophobicContact CG2-CD1 4.01Å; T741-L745 WeakPolarHBondContact O-CB 3.42Å; T741-L745 WeakPolarHBondContact O-CG 3.48Å; T741-L745 PolarHBondContact O-N 2.87Å; D742-L745 PolarHBondContact O-N 3Å; A743-L745 VanDerWaalsContact C-N 3.35Å; L745-I748 PolarHBondContact O-N 3.22Å; L745-Q749 WeakPolarHBondContact O-CB 3.32Å; L745-Q749 VanDerWaalsContact O-CG 3.23Å; L745-Q749 WeakPolarHBondContact O-CG 3.28Å; L745-Q749 PolarHBondContact O-N 3.37Å; L745-L769 HydrophobicContact CD2-CD1 3.57Å; L745-L769 HydrophobicContact CG-CD1 3.78Å; L745-L769 HydrophobicContact CG-CD2 4.49Å; L745-M841 HydrophobicContact CD1-CB 3.51Å; L745-M841 HydrophobicContact CD1-CE 3.91Å; L745-M841 HydrophobicContact CD1-CG 4.23Å; L745-M841 HydrophobicContact CD1-SD 3.7Å; L745-I847 HydrophobicContact CD1-CD1 4.18Å; L745-I847 HydrophobicContact CD1-CG1 4.47Å; L745-I847 HydrophobicContact CD2-CD1 3.97Å; L745-I847 HydrophobicContact CD2-CG1 3.83Å
746	Y	94	Very high	92.7	Very high	58 Å²	58	38.6 Å²	38.6	23%	0.227	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-45.1	173.5	-171.9	-85.5	0	0	0	111	S692 W694 D742 A743 I748 Q749 S750	S692-Y746 WeakPolarHBondContact O-CD1 2.84Å; S692-Y746 VanDerWaalsContact O-CE1 3.26Å; S692-Y746 WeakPolarHBondContact O-CE1 3.28Å; W694-Y746 HydrophobicContact CB-CD1 4.23Å; W694-Y746 HydrophobicContact CB-CD2 4.34Å; W694-Y746 HydrophobicContact CB-CG 3.96Å; W694-Y746 AromaticContact CD1-CD2 3.86Å; W694-Y746 HydrophobicContact CG-CG 4.43Å; D742-Y746 WeakPolarHBondContact O-CB 3.32Å; D742-Y746 PolarHBondContact O-N 2.9Å; A743-Y746 PolarHBondContact O-N 2.9Å; Y746-I748 VanDerWaalsContact C-N 3.28Å; Y746-I748 PolarHBondContact O-N 2.97Å; Y746-Q749 PolarHBondContact O-N 3.3Å; Y746-Q749 VanDerWaalsContact O-N 3.13Å; Y746-S750 VanDerWaalsContact CE1-OG 3.29Å; Y746-S750 WeakPolarHBondContact CE1-OG 3.32Å; Y746-S750 WeakPolarHBondContact O-CB 3.13Å; Y746-S750 PolarHBondContact O-N 3.04Å; Y746-S750 PolarHBondContact O-OG 3Å; Y746-S750 VanDerWaalsContact O-OG 3.14Å
747	V	94.1	Very high	92.8	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-40.7	174.7	167.3	0	0	0	0	112.1	H708 L713 A743 T761	H708-V747 PolarHBondContact CE1-O 2.69Å; H708-V747 VanDerWaalsContact CE1-O 3.28Å; L713-V747 HydrophobicContact CD2-CG2 4.33Å; A743-V747 WeakPolarHBondContact O-CG2 3.37Å; A743-V747 PolarHBondContact O-N 3.35Å; V747-T761 HydrophobicContact CG1-CG2 4.09Å
748	I	95.3	Very high	92.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-48.3	175.5	-69.5	163.4	0	0	0	110.5	L744 L745 Y746 S750 A751 L752 C765 V766 L769 P850 L854	L744-I748 WeakPolarHBondContact O-CG1 3.13Å; L744-I748 PolarHBondContact O-N 3.15Å; L745-I748 PolarHBondContact O-N 3.22Å; Y746-I748 VanDerWaalsContact C-N 3.28Å; Y746-I748 PolarHBondContact O-N 2.97Å; I748-S750 PolarHBondContact O-N 3.34Å; I748-A751 PolarHBondContact O-N 3.49Å; I748-L752 HydrophobicContact CG2-CD2 4.39Å; I748-L752 WeakPolarHBondContact O-CG 3.27Å; I748-L752 PolarHBondContact O-N 3.24Å; I748-C765 HydrophobicContact CD1-CB 3.92Å; I748-C765 HydrophobicContact CG1-CB 3.87Å; I748-V766 HydrophobicContact CD1-CG2 3.62Å; I748-V766 HydrophobicContact CG1-CG2 3.97Å; I748-L769 HydrophobicContact CD1-CD1 3.5Å; I748-L769 VanDerWaalsContact CD1-CD1 3.5Å; I748-P850 HydrophobicContact CG2-CB 4.31Å; I748-L854 HydrophobicContact CG2-CD1 3.81Å; I748-L854 HydrophobicContact CG2-CG 4.36Å
749	Q	93.4	Very high	92.8	Very high	90 Å²	90	30.7 Å²	30.7	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-62.4	-38.3	-176.8	-73.8	170.1	21.1	0	0	113	L745 Y746 A751 L752 P850	L745-Q749 WeakPolarHBondContact O-CB 3.32Å; L745-Q749 VanDerWaalsContact O-CG 3.23Å; L745-Q749 WeakPolarHBondContact O-CG 3.28Å; L745-Q749 PolarHBondContact O-N 3.37Å; Y746-Q749 PolarHBondContact O-N 3.3Å; Y746-Q749 VanDerWaalsContact O-N 3.13Å; Q749-A751 VanDerWaalsContact C-N 3.27Å; Q749-A751 PolarHBondContact O-N 2.8Å; Q749-L752 PolarHBondContact O-N 3.16Å; Q749-P850 HydrophobicContact CG-CG 4.19Å
750	S	91.5	Very high	92.9	Very high	46 Å²	46	33.6 Å²	33.6	32%	0.322	20%	0.204	S	C	.	.	H	α-helix	trans	-69.9	-20.9	177.5	-62.4	0	0	0	0	113.9	H708 Y746 I748	H708-S750 WeakPolarHBondContact NE2-CB 3.3Å; Y746-S750 VanDerWaalsContact CE1-OG 3.29Å; Y746-S750 WeakPolarHBondContact CE1-OG 3.32Å; Y746-S750 WeakPolarHBondContact O-CB 3.13Å; Y746-S750 PolarHBondContact O-N 3.04Å; Y746-S750 PolarHBondContact O-OG 3Å; Y746-S750 VanDerWaalsContact O-OG 3.14Å; I748-S750 PolarHBondContact O-N 3.34Å
751	A	91.9	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-91.9	-7.3	176.7	0	0	0	0	0	114.1	I748 Q749 S754 I757 V762	I748-A751 PolarHBondContact O-N 3.49Å; Q749-A751 VanDerWaalsContact C-N 3.27Å; Q749-A751 PolarHBondContact O-N 2.8Å; A751-S754 PolarHBondContact O-N 3.29Å; A751-S754 PolarHBondContact O-OG 2.93Å; A751-I757 WeakPolarHBondContact O-CB 3.41Å; A751-V762 HydrophobicContact CB-CG2 3.49Å; A751-V762 VanDerWaalsContact CB-CG2 3.49Å
752	L	92.5	Very high	93	Very high	44 Å²	44	33.8 Å²	33.8	23%	0.23	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	131.3	176.8	-54.4	177.6	0	0	0	110.1	I748 Q749 S754 I757 P850 T853 L854	I748-L752 HydrophobicContact CG2-CD2 4.39Å; I748-L752 WeakPolarHBondContact O-CG 3.27Å; I748-L752 PolarHBondContact O-N 3.24Å; Q749-L752 PolarHBondContact O-N 3.16Å; L752-S754 PolarHBondContact O-N 3.46Å; L752-I757 HydrophobicContact CD2-CD1 4.37Å; L752-P850 HydrophobicContact CD1-CB 4.2Å; L752-T853 HydrophobicContact CB-CG2 4.06Å; L752-T853 HydrophobicContact CD1-CG2 4.12Å; L752-T853 HydrophobicContact CD2-CG2 3.8Å; L752-T853 HydrophobicContact CG-CG2 4.18Å; L752-L854 HydrophobicContact CD2-CD2 3.95Å; L752-L854 HydrophobicContact CD2-CG 3.98Å
753	G	88.4	Confident	93.2	Very high	72 Å²	72	33.2 Å²	33.2	74%	0.742	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	11.2	-171.6	0	0	0	0	0	115.3	E857	G753-E857 PolarHBondContact N-OE2 3.06Å
754	S	89	Confident	93.3	Very high	40 Å²	40	33.3 Å²	33.3	28%	0.28	20%	0.202	S	C	.	.	S	Bend	trans	-109.4	164.2	171	100.5	0	0	0	0	111.4	A751 L752 E756	A751-S754 PolarHBondContact O-N 3.29Å; A751-S754 PolarHBondContact O-OG 2.93Å; L752-S754 PolarHBondContact O-N 3.46Å; S754-E756 PolarHBondContact O-N 3.29Å; S754-E756 VanDerWaalsContact O-N 3.15Å; S754-E756 WeakPolarHBondContact OG-CB 3.43Å; S754-E756 PolarHBondContact OG-N 3.39Å
755	S	86.7	Confident	93.3	Very high	125 Å²	125	33.3 Å²	33.3	87%	0.874	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-5.4	173.8	49	0	0	0	0	113.9
756	E	86.6	Confident	93.5	Very high	45 Å²	45	33.1 Å²	33.1	21%	0.21	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	2.6	-176	-53.7	-176.1	114.2	0	0	113	H708 S754 D758 S759	H708-E756 HydrophobicContact CB-CB 4.47Å; H708-E756 WeakPolarHBondContact CB-OE1 3.48Å; H708-E756 WeakPolarHBondContact CB-OE2 3.47Å; H708-E756 IonicContact CD2-OE2 3.2Å; H708-E756 PolarHBondContact CD2-OE2 3.41Å; H708-E756 VanDerWaalsContact CD2-OE2 3.24Å; H708-E756 IonicContact CG-OE2 2.71Å; S754-E756 PolarHBondContact O-N 3.29Å; S754-E756 VanDerWaalsContact O-N 3.15Å; S754-E756 WeakPolarHBondContact OG-CB 3.43Å; S754-E756 PolarHBondContact OG-N 3.39Å; E756-D758 PolarHBondContact O-N 3.09Å; E756-S759 WeakPolarHBondContact O-CB 3.21Å; E756-S759 PolarHBondContact O-N 2.74Å; E756-S759 PolarHBondContact O-OG 2.71Å
757	I	92.9	Very high	93.7	Very high	13 Å²	13	31.1 Å²	31.1	7%	0.067	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.7	178.2	-163.1	172	0	0	0	113.3	A751 L752 S759 V762 L854 E857 C858	A751-I757 WeakPolarHBondContact O-CB 3.41Å; L752-I757 HydrophobicContact CD2-CD1 4.37Å; I757-S759 VanDerWaalsContact C-N 3.33Å; I757-V762 WeakPolarHBondContact O-CG1 3.25Å; I757-L854 HydrophobicContact CD1-CD2 4.15Å; I757-L854 HydrophobicContact CG1-CD2 3.71Å; I757-E857 HydrophobicContact CD1-CB 3.53Å; I757-C858 HydrophobicContact CG1-CB 4.41Å
758	D	93.4	Very high	93.9	Very high	53 Å²	53	31 Å²	31	28%	0.283	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-1.3	177.1	-77.9	-35.1	0	0	0	113.9	E756 C858 S859 N860	E756-D758 PolarHBondContact O-N 3.09Å; D758-C858 PolarHBondContact OD1-SG 3.12Å; D758-S859 VanDerWaalsContact CG-OG 3.24Å; D758-S859 PolarHBondContact OD1-N 3.11Å; D758-S859 PolarHBondContact OD1-OG 3.37Å; D758-S859 WeakPolarHBondContact OD2-CB 3.49Å; D758-S859 PolarHBondContact OD2-N 3.2Å; D758-S859 PolarHBondContact OD2-OG 3.2Å; D758-N860 HydrophobicContact CB-CB 4.28Å; D758-N860 PolarHBondContact O-ND2 3.46Å; D758-N860 WeakPolarHBondContact OD1-CB 3.43Å; D758-N860 PolarHBondContact OD1-N 3.02Å
759	S	94.6	Very high	94.1	Very high	30 Å²	30	31 Å²	31	21%	0.21	20%	0.195	C	C	.	.			trans	-62.3	147.1	-174.1	70.1	0	0	0	0	112.9	E756 I757 T761 V762 E763	E756-S759 WeakPolarHBondContact O-CB 3.21Å; E756-S759 PolarHBondContact O-N 2.74Å; E756-S759 PolarHBondContact O-OG 2.71Å; I757-S759 VanDerWaalsContact C-N 3.33Å; S759-T761 PolarHBondContact O-N 3.42Å; S759-T761 VanDerWaalsContact O-N 3.09Å; S759-V762 PolarHBondContact O-N 3.42Å; S759-V762 WeakPolarHBondContact OG-CG2 3.44Å; S759-V762 PolarHBondContact OG-N 3.18Å; S759-E763 PolarHBondContact O-N 3.42Å
760	K	95.1	Very high	94.3	Very high	71 Å²	71	29.8 Å²	29.8	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-61.4	-21.5	176.9	-158.1	55.6	159	-171.6	0	112.6	R714 E763 N764 D862	R714-K760 HydrophobicContact CG-CB 4.48Å; K760-E763 HydrophobicContact CD-CB 4.36Å; K760-E763 WeakPolarHBondContact CD-OE2 3.27Å; K760-E763 WeakPolarHBondContact CE-OE1 3.44Å; K760-E763 WeakPolarHBondContact CE-OE2 3.45Å; K760-E763 IonicContact NZ-OE1 3.57Å; K760-E763 PolarHBondContact NZ-OE1 3.24Å; K760-E763 IonicContact NZ-OE2 3.32Å; K760-E763 PolarHBondContact NZ-OE2 3.42Å; K760-N764 WeakPolarHBondContact O-CB 3.46Å; K760-N764 PolarHBondContact O-N 2.85Å; K760-N764 PolarHBondContact O-ND2 3.28Å; K760-D862 IonicContact NZ-OD2 3.64Å
761	T	95.8	Very high	94.5	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-69.6	-49.9	172.9	-50.6	0	0	0	0	110.9	H708 L713 V747 S759 N764 C765	H708-T761 PolarHBondContact O-OG1 3.38Å; L713-T761 HydrophobicContact CD2-CG2 3.86Å; L713-T761 HydrophobicContact CG-CG2 3.87Å; V747-T761 HydrophobicContact CG1-CG2 4.09Å; S759-T761 PolarHBondContact O-N 3.42Å; S759-T761 VanDerWaalsContact O-N 3.09Å; T761-N764 PolarHBondContact O-N 3.18Å; T761-C765 PolarHBondContact O-N 2.84Å; T761-C765 PolarHBondContact O-SG 2.84Å
762	V	96.9	Very high	94.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.2	-46.7	174.5	171.7	0	0	0	0	110.8	A751 I757 S759 N764 C765 V766 L854 T863	A751-V762 HydrophobicContact CB-CG2 3.49Å; A751-V762 VanDerWaalsContact CB-CG2 3.49Å; I757-V762 WeakPolarHBondContact O-CG1 3.25Å; S759-V762 PolarHBondContact O-N 3.42Å; S759-V762 WeakPolarHBondContact OG-CG2 3.44Å; S759-V762 PolarHBondContact OG-N 3.18Å; V762-N764 VanDerWaalsContact C-N 3.34Å; V762-N764 PolarHBondContact O-N 3.1Å; V762-C765 PolarHBondContact O-N 3.06Å; V762-C765 VanDerWaalsContact O-N 3.15Å; V762-V766 HydrophobicContact CG1-CG2 4.2Å; V762-V766 VanDerWaalsContact O-CG2 3.31Å; V762-V766 WeakPolarHBondContact O-CG2 3.36Å; V762-V766 PolarHBondContact O-N 3.39Å; V762-L854 HydrophobicContact CG1-CD2 3.92Å; V762-T863 HydrophobicContact CG1-CG2 4.32Å
763	E	97.6	Very high	94.8	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	17%	0.165	C	C	.	.	H	α-helix	trans	-54.7	-48.3	176.2	-168.6	-160	118.9	0	0	111.7	R721 S759 K760 C765 V766 C767 N860 D862 T863	R721-E763 IonicContact CZ-OE1 3.18Å; R721-E763 IonicContact NH1-OE1 2.83Å; R721-E763 PolarHBondContact NH1-OE1 2.88Å; R721-E763 IonicContact NH2-OE1 3.47Å; R721-E763 PolarHBondContact NH2-OE1 2.9Å; R721-E763 VanDerWaalsContact NH2-OE1 3.17Å; S759-E763 PolarHBondContact O-N 3.42Å; K760-E763 HydrophobicContact CD-CB 4.36Å; K760-E763 WeakPolarHBondContact CD-OE2 3.27Å; K760-E763 WeakPolarHBondContact CE-OE1 3.44Å; K760-E763 WeakPolarHBondContact CE-OE2 3.45Å; K760-E763 IonicContact NZ-OE1 3.57Å; K760-E763 PolarHBondContact NZ-OE1 3.24Å; K760-E763 IonicContact NZ-OE2 3.32Å; K760-E763 PolarHBondContact NZ-OE2 3.42Å; E763-C765 PolarHBondContact O-N 3.18Å; E763-V766 PolarHBondContact O-N 2.81Å; E763-C767 WeakPolarHBondContact O-CB 3.48Å; E763-C767 PolarHBondContact O-N 3.37Å; E763-C767 PolarHBondContact O-SG 3.26Å; E763-N860 PolarHBondContact OE2-ND2 2.84Å; E763-D862 HydrophobicContact CG-CB 3.72Å; E763-D862 WeakPolarHBondContact OE1-CB 3.16Å; E763-T863 WeakPolarHBondContact CA-OG1 3.24Å; E763-T863 VanDerWaalsContact CB-OG1 3.32Å; E763-T863 WeakPolarHBondContact CB-OG1 3.46Å; E763-T863 WeakPolarHBondContact CG-OG1 3.5Å
764	N	97.9	Very high	95	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.011	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-44.6	177	-73.9	-22.7	0	0	0	112.3	R714 T717 G718 R721 K760 T761 V762 C767 I768	R714-N764 PolarHBondContact O-ND2 2.85Å; T717-N764 PolarHBondContact OG1-ND2 3.25Å; G718-N764 WeakPolarHBondContact CA-ND2 3.49Å; G718-N764 PolarHBondContact N-ND2 3.18Å; G718-N764 VanDerWaalsContact N-ND2 3.18Å; R721-N764 VanDerWaalsContact CD-OD1 3.25Å; R721-N764 WeakPolarHBondContact CD-OD1 3.06Å; R721-N764 PolarHBondContact NH1-OD1 3.14Å; K760-N764 WeakPolarHBondContact O-CB 3.46Å; K760-N764 PolarHBondContact O-N 2.85Å; K760-N764 PolarHBondContact O-ND2 3.28Å; T761-N764 PolarHBondContact O-N 3.18Å; V762-N764 VanDerWaalsContact C-N 3.34Å; V762-N764 PolarHBondContact O-N 3.1Å; N764-C767 PolarHBondContact O-N 3.37Å; N764-I768 WeakPolarHBondContact O-CD1 3.44Å; N764-I768 VanDerWaalsContact O-CG1 3.27Å; N764-I768 WeakPolarHBondContact O-CG1 3.38Å; N764-I768 PolarHBondContact O-N 2.93Å
765	C	98.1	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-45.9	177.1	-66.9	0	0	0	0	111.8	L744 I748 T761 V762 E763 I768 L769	L744-C765 HydrophobicContact CD2-CB 4.09Å; L744-C765 WeakPolarHBondContact CD2-SG 3.5Å; I748-C765 HydrophobicContact CD1-CB 3.92Å; I748-C765 HydrophobicContact CG1-CB 3.87Å; T761-C765 PolarHBondContact O-N 2.84Å; T761-C765 PolarHBondContact O-SG 2.84Å; V762-C765 PolarHBondContact O-N 3.06Å; V762-C765 VanDerWaalsContact O-N 3.15Å; E763-C765 PolarHBondContact O-N 3.18Å; C765-I768 PolarHBondContact O-N 2.7Å; C765-L769 WeakPolarHBondContact O-CG 3.3Å; C765-L769 PolarHBondContact O-N 3.04Å
766	V	98.3	Very high	94.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.7	-43.2	177.9	174.9	0	0	0	0	110.8	I748 V762 E763 I768 L769 R770 L854 T863 G866 A867	I748-V766 HydrophobicContact CD1-CG2 3.62Å; I748-V766 HydrophobicContact CG1-CG2 3.97Å; V762-V766 HydrophobicContact CG1-CG2 4.2Å; V762-V766 VanDerWaalsContact O-CG2 3.31Å; V762-V766 WeakPolarHBondContact O-CG2 3.36Å; V762-V766 PolarHBondContact O-N 3.39Å; E763-V766 PolarHBondContact O-N 2.81Å; V766-I768 PolarHBondContact O-N 2.7Å; V766-L769 PolarHBondContact O-N 3.36Å; V766-R770 WeakPolarHBondContact O-CB 3.4Å; V766-R770 PolarHBondContact O-N 3.17Å; V766-L854 HydrophobicContact CG2-CD1 3.49Å; V766-L854 VanDerWaalsContact CG2-CD1 3.49Å; V766-T863 HydrophobicContact CG2-CG2 4.22Å; V766-G866 VanDerWaalsContact CG1-C 3.46Å; V766-A867 HydrophobicContact CG1-CB 4.13Å; V766-A867 VanDerWaalsContact CG1-N 3.34Å
767	C	98.1	Very high	94.1	Very high	15 Å²	15	25.1 Å²	25.1	10%	0.101	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-39.9	174.8	-69.2	0	0	0	0	113	R721 E763 N764 N771	R721-C767 HydrophobicContact CG-CB 3.92Å; R721-C767 VanDerWaalsContact CZ-SG 3.55Å; E763-C767 WeakPolarHBondContact O-CB 3.48Å; E763-C767 PolarHBondContact O-N 3.37Å; E763-C767 PolarHBondContact O-SG 3.26Å; N764-C767 PolarHBondContact O-N 3.37Å; C767-N771 WeakPolarHBondContact O-CB 3.31Å; C767-N771 VanDerWaalsContact O-CG 3.26Å; C767-N771 PolarHBondContact O-N 3.11Å; C767-N771 VanDerWaalsContact O-N 3.08Å; C767-N771 PolarHBondContact O-ND2 3Å
768	I	98.6	Very high	93.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-54.6	174.1	-66.6	158.3	0	0	0	109.6	L720 R721 M734 L744 N764 C765 V766 R770 N771 L772	L720-I768 HydrophobicContact CB-CD1 3.76Å; L720-I768 HydrophobicContact CB-CG1 4.39Å; R721-I768 HydrophobicContact CB-CG1 4.01Å; M734-I768 HydrophobicContact CE-CG2 3.77Å; L744-I768 HydrophobicContact CD1-CB 4.14Å; L744-I768 HydrophobicContact CD1-CD1 4.2Å; L744-I768 HydrophobicContact CD1-CG2 3.57Å; L744-I768 HydrophobicContact CD2-CD1 3.91Å; N764-I768 WeakPolarHBondContact O-CD1 3.44Å; N764-I768 VanDerWaalsContact O-CG1 3.27Å; N764-I768 WeakPolarHBondContact O-CG1 3.38Å; N764-I768 PolarHBondContact O-N 2.93Å; C765-I768 PolarHBondContact O-N 2.7Å; V766-I768 PolarHBondContact O-N 2.7Å; I768-R770 VanDerWaalsContact C-N 3.32Å; I768-R770 PolarHBondContact O-N 2.88Å; I768-N771 CarbonylContact O-C 3.56Å; I768-N771 WeakPolarHBondContact O-CA 3.47Å; I768-N771 WeakPolarHBondContact O-CB 3.39Å; I768-N771 PolarHBondContact O-N 2.91Å; I768-L772 HydrophobicContact CG2-CD1 3.99Å; I768-L772 HydrophobicContact CG2-CG 4.02Å; I768-L772 WeakPolarHBondContact O-CG 3.41Å; I768-L772 PolarHBondContact O-N 2.87Å
769	L	98.1	Very high	92.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-35.5	-176.4	-63.3	172.2	0	0	0	112.4	T741 L744 L745 I748 C765 V766 N771 L772 S773 L842 Y851	T741-L769 HydrophobicContact CG2-CD2 4.18Å; L744-L769 HydrophobicContact CB-CD1 4.37Å; L744-L769 HydrophobicContact CB-CD2 4.2Å; L744-L769 HydrophobicContact CB-CG 4.33Å; L744-L769 HydrophobicContact CD1-CD2 4.27Å; L745-L769 HydrophobicContact CD2-CD1 3.57Å; L745-L769 HydrophobicContact CG-CD1 3.78Å; L745-L769 HydrophobicContact CG-CD2 4.49Å; I748-L769 HydrophobicContact CD1-CD1 3.5Å; I748-L769 VanDerWaalsContact CD1-CD1 3.5Å; C765-L769 WeakPolarHBondContact O-CG 3.3Å; C765-L769 PolarHBondContact O-N 3.04Å; V766-L769 PolarHBondContact O-N 3.36Å; L769-N771 VanDerWaalsContact C-N 3.3Å; L769-N771 PolarHBondContact O-N 3.38Å; L769-L772 PolarHBondContact O-N 3.48Å; L769-S773 VanDerWaalsContact O-CB 3.24Å; L769-S773 WeakPolarHBondContact O-CB 3.19Å; L769-S773 PolarHBondContact O-N 3.19Å; L769-S773 PolarHBondContact O-OG 3.3Å; L769-L842 HydrophobicContact CD2-CD2 3.79Å; L769-Y851 VanDerWaalsContact CB-OH 3.29Å; L769-Y851 WeakPolarHBondContact CB-OH 3.39Å
770	R	97.5	Very high	91.1	Very high	64 Å²	64	23.7 Å²	23.7	24%	0.242	12%	0.115	C	C	.	.	H	α-helix	trans	-57.1	-42.3	169.8	175.9	-87.7	-152.6	170.8	9.4	111.9	V766 I768 Y774 E865 G866 A870 N873	V766-R770 WeakPolarHBondContact O-CB 3.4Å; V766-R770 PolarHBondContact O-N 3.17Å; I768-R770 VanDerWaalsContact C-N 3.32Å; I768-R770 PolarHBondContact O-N 2.88Å; R770-Y774 PolarHBondContact O-N 3.03Å; R770-E865 IonicContact NH2-OE1 3.59Å; R770-G866 WeakPolarHBondContact CB-O 3.5Å; R770-G866 WeakPolarHBondContact CG-O 3.34Å; R770-A870 HydrophobicContact CB-CB 4.08Å; R770-N873 PolarHBondContact O-ND2 3.23Å
771	N	97.4	Very high	89.1	Confident	16 Å²	16	22.1 Å²	22.1	9%	0.086	11%	0.113	C	C	.	.	H	α-helix	trans	-73.8	-43.2	177.1	-70.1	-12	0	0	0	112.1	S724 R731 C767 I768 L769 S773 Y774	S724-N771 WeakPolarHBondContact OG-CB 3.18Å; S724-N771 PolarHBondContact OG-ND2 3.09Å; R731-N771 WeakPolarHBondContact CD-O 3.31Å; C767-N771 WeakPolarHBondContact O-CB 3.31Å; C767-N771 VanDerWaalsContact O-CG 3.26Å; C767-N771 PolarHBondContact O-N 3.11Å; C767-N771 VanDerWaalsContact O-N 3.08Å; C767-N771 PolarHBondContact O-ND2 3Å; I768-N771 CarbonylContact O-C 3.56Å; I768-N771 WeakPolarHBondContact O-CA 3.47Å; I768-N771 WeakPolarHBondContact O-CB 3.39Å; I768-N771 PolarHBondContact O-N 2.91Å; L769-N771 VanDerWaalsContact C-N 3.3Å; L769-N771 PolarHBondContact O-N 3.38Å; N771-S773 PolarHBondContact O-N 2.85Å; N771-Y774 WeakPolarHBondContact O-CB 3.4Å; N771-Y774 PolarHBondContact O-N 2.75Å
772	L	96.2	Very high	86.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-30.8	175.8	-59.5	-170.4	0	0	0	112.3	R731 M734 R735 I768 L769 Y774 L842	R731-L772 HydrophobicContact CB-CD2 4.31Å; R731-L772 HydrophobicContact CG-CD2 4.36Å; M734-L772 HydrophobicContact CB-CD1 4.27Å; M734-L772 HydrophobicContact CB-CD2 3.53Å; M734-L772 HydrophobicContact CE-CD2 4.44Å; M734-L772 HydrophobicContact CG-CD2 4.46Å; M734-L772 HydrophobicContact SD-CD2 4.24Å; R735-L772 HydrophobicContact CG-CB 4.04Å; R735-L772 HydrophobicContact CG-CD1 4.3Å; R735-L772 HydrophobicContact CG-CD2 4.34Å; R735-L772 HydrophobicContact CG-CG 4.44Å; R735-L772 PolarHBondContact NH1-O 2.86Å; I768-L772 HydrophobicContact CG2-CD1 3.99Å; I768-L772 HydrophobicContact CG2-CG 4.02Å; I768-L772 WeakPolarHBondContact O-CG 3.41Å; I768-L772 PolarHBondContact O-N 2.87Å; L769-L772 PolarHBondContact O-N 3.48Å; L772-Y774 VanDerWaalsContact C-N 3.26Å; L772-Y774 PolarHBondContact O-N 2.77Å; L772-L842 HydrophobicContact CB-CD1 4.01Å
773	S	94	Very high	83.6	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.8	173.4	-59.1	0	0	0	0	114	L769 N771 R775 L776	L769-S773 VanDerWaalsContact O-CB 3.24Å; L769-S773 WeakPolarHBondContact O-CB 3.19Å; L769-S773 PolarHBondContact O-N 3.19Å; L769-S773 PolarHBondContact O-OG 3.3Å; N771-S773 PolarHBondContact O-N 2.85Å; S773-R775 PolarHBondContact O-N 3.4Å; S773-L776 WeakPolarHBondContact O-CB 3.4Å
774	Y	93.2	Very high	80.9	Confident	112 Å²	112	36.1 Å²	36.1	44%	0.439	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	131.9	-179.2	-177.5	-99.9	0	0	0	111.5	R770 N771 L772 L776	R770-Y774 PolarHBondContact O-N 3.03Å; N771-Y774 WeakPolarHBondContact O-CB 3.4Å; N771-Y774 PolarHBondContact O-N 2.75Å; L772-Y774 VanDerWaalsContact C-N 3.26Å; L772-Y774 PolarHBondContact O-N 2.77Å; Y774-L776 PolarHBondContact O-N 2.68Å
775	R	86.2	Confident	77.8	Confident	109 Å²	109	42.5 Å²	42.5	41%	0.411	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	14.9	-176.8	-73.3	178.1	69.8	-121.8	6.9	115.7	E728 S773 A777 A778 E779	E728-R775 IonicContact OE2-CZ 2.82Å; E728-R775 IonicContact OE2-NH1 2.71Å; E728-R775 PolarHBondContact OE2-NH1 2.74Å; E728-R775 IonicContact OE2-NH2 3.93Å; S773-R775 PolarHBondContact O-N 3.4Å; R775-A777 VanDerWaalsContact C-N 3.26Å; R775-A777 PolarHBondContact O-N 2.77Å; R775-A778 PolarHBondContact O-N 3.12Å; R775-E779 HydrophobicContact CB-CG 3.75Å; R775-E779 WeakPolarHBondContact CB-OE1 3.39Å; R775-E779 IonicContact CZ-OE1 3.27Å; R775-E779 IonicContact NH1-OE1 2.89Å; R775-E779 PolarHBondContact NH1-OE1 3.17Å; R775-E779 PolarHBondContact O-N 2.94Å
776	L	83.6	Confident	74.6	Confident	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-43.1	-46.8	-174.5	-173.6	63.3	0	0	0	113.9	R735 S773 Y774 A778 T780 L842 W843 L874 W879	R735-L776 VanDerWaalsContact CD-CD1 3.5Å; S773-L776 WeakPolarHBondContact O-CB 3.4Å; Y774-L776 PolarHBondContact O-N 2.68Å; L776-A778 PolarHBondContact O-N 3.29Å; L776-T780 WeakPolarHBondContact O-CB 3.32Å; L776-T780 PolarHBondContact O-N 3.33Å; L776-T780 VanDerWaalsContact O-N 3.07Å; L776-T780 PolarHBondContact O-OG1 3.29Å; L776-L842 HydrophobicContact CD1-CD1 4.14Å; L776-L842 HydrophobicContact CD2-CB 3.75Å; L776-W843 HydrophobicContact CD1-CE3 4.13Å; L776-W843 HydrophobicContact CD1-CZ3 4.21Å; L776-W843 HydrophobicContact CD2-CB 4.24Å; L776-W843 HydrophobicContact CD2-CE3 3.87Å; L776-W843 HydrophobicContact CG-CE3 3.97Å; L776-W843 HydrophobicContact CG-CZ3 4.46Å; L776-L874 HydrophobicContact CD2-CD2 3.84Å; L776-W879 HydrophobicContact CD2-CH2 4.02Å; L776-W879 HydrophobicContact CD2-CZ2 4.31Å; L776-W879 HydrophobicContact CG-CH2 3.98Å; L776-W879 HydrophobicContact CG-CZ2 4.43Å
777	A	72.9	Confident	71.4	Confident	32 Å²	32	54.6 Å²	54.6	26%	0.264	29%	0.292	S	S	.	.	H	α-helix	trans	-61.6	-22.4	179.3	0	0	0	0	0	115.9	R775 S781 W879	R775-A777 VanDerWaalsContact C-N 3.26Å; R775-A777 PolarHBondContact O-N 2.77Å; A777-S781 PolarHBondContact O-OG 3.26Å; A777-W879 HydrophobicContact CB-CD2 3.57Å; A777-W879 VanDerWaalsContact CB-CE2 3.46Å; A777-W879 HydrophobicContact CB-CE3 4.12Å; A777-W879 HydrophobicContact CB-CG 3.83Å; A777-W879 HydrophobicContact CB-CH2 4.41Å; A777-W879 HydrophobicContact CB-CZ2 3.91Å
778	A	73.4	Confident	68.1	Low	43 Å²	43	59 Å²	59	36%	0.355	32%	0.318	S	S	.	.	H	α-helix	trans	-105.5	-36.6	-178.5	0	0	0	0	0	112.1	R775 L776 S781	R775-A778 PolarHBondContact O-N 3.12Å; L776-A778 PolarHBondContact O-N 3.29Å; A778-S781 WeakPolarHBondContact CA-OG 3.31Å; A778-S781 PolarHBondContact O-OG 2.96Å
779	E	77.9	Confident	64.8	Low	2 Å²	2	66.7 Å²	66.7	1%	0.009	36%	0.359	C	S	.	.	H	α-helix	trans	-73.8	-38.8	-179.6	-58.5	-175.4	169	0	0	111.5	E728 R731 R735 R775	E728-E779 HydrophobicContact CG-CB 4.12Å; E728-E779 HydrophobicContact CG-CG 3.75Å; R731-E779 IonicContact CZ-OE1 2.71Å; R731-E779 IonicContact CZ-OE2 3.17Å; R731-E779 IonicContact NE-OE1 3.52Å; R731-E779 PolarHBondContact NE-OE1 2.96Å; R731-E779 IonicContact NE-OE2 3.94Å; R731-E779 PolarHBondContact NE-OE2 3.48Å; R731-E779 IonicContact NH2-OE1 3.24Å; R731-E779 PolarHBondContact NH2-OE1 3.36Å; R731-E779 IonicContact NH2-OE2 2.66Å; R735-E779 IonicContact CZ-OE2 2.64Å; R735-E779 VanDerWaalsContact CZ-OE2 3.31Å; R735-E779 IonicContact NH1-OE2 3.38Å; R735-E779 PolarHBondContact NH1-OE2 3.1Å; R735-E779 IonicContact NH2-OE2 2.73Å; R735-E779 PolarHBondContact NH2-OE2 2.98Å; R775-E779 HydrophobicContact CB-CG 3.75Å; R775-E779 WeakPolarHBondContact CB-OE1 3.39Å; R775-E779 IonicContact CZ-OE1 3.27Å; R775-E779 IonicContact NH1-OE1 2.89Å; R775-E779 PolarHBondContact NH1-OE1 3.17Å; R775-E779 PolarHBondContact O-N 2.94Å
780	T	66.4	Low	61.6	Low	21 Å²	21	76 Å²	76	13%	0.129	40%	0.403	C	S	.	.	H	α-helix	trans	-73.9	-28.6	178.9	-58.3	0	0	0	0	112.7	L776 Q782 I839 W843 W882	L776-T780 WeakPolarHBondContact O-CB 3.32Å; L776-T780 PolarHBondContact O-N 3.33Å; L776-T780 VanDerWaalsContact O-N 3.07Å; L776-T780 PolarHBondContact O-OG1 3.29Å; T780-Q782 VanDerWaalsContact C-N 3.31Å; T780-Q782 PolarHBondContact O-N 2.98Å; T780-I839 HydrophobicContact CG2-CD1 4.29Å; T780-W843 HydrophobicContact CG2-CH2 4.24Å; T780-W843 HydrophobicContact CG2-CZ3 4.13Å; T780-W882 HydrophobicContact CG2-CZ2 4Å
781	S	53.3	Low	58.5	Low	38 Å²	38	81 Å²	81	27%	0.266	43%	0.433	S	S	.	.	H	α-helix	trans	-71.8	-19.6	178.7	46	0	0	0	0	114.6	A777 A778	A777-S781 PolarHBondContact O-OG 3.26Å; A778-S781 WeakPolarHBondContact CA-OG 3.31Å; A778-S781 PolarHBondContact O-OG 2.96Å
782	Q	40.7	Very low	55.2	Low	132 Å²	132	88.1 Å²	88.1	62%	0.617	47%	0.472	S	S	*	.	H	α-helix	trans	-94.5	-14.5	178.5	-66.6	-170.7	-41.6	0	0	113.4	T780 Q784	T780-Q782 VanDerWaalsContact C-N 3.31Å; T780-Q782 PolarHBondContact O-N 2.98Å; Q782-Q784 PolarHBondContact O-N 3.14Å
783	G	37.2	Very low	52	Low	25 Å²	25	91.4 Å²	91.4	26%	0.258	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-10	-174	0	0	0	0	0	116.2
784	Q	39.6	Very low	49	Very low	143 Å²	143	99.3 Å²	99.3	67%	0.668	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-11.6	-174.2	-68.2	-67.8	-83.9	0	0	114.6	Q782 M786	Q782-Q784 PolarHBondContact O-N 3.14Å; Q784-M786 PolarHBondContact O-N 2.99Å
785	H	33.5	Very low	46	Very low	135 Å²	135	102.5 Å²	102.5	63%	0.625	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	20.3	177.2	-109.2	86	0	0	0	113.7	D885	H785-D885 IonicContact CE1-OD1 3.89Å; H785-D885 IonicContact CE1-OD2 3.9Å; H785-D885 PolarHBondContact CE1-OD2 3.33Å; H785-D885 IonicContact ND1-OD2 3Å; H785-D885 PolarHBondContact ND1-OD2 3.49Å; H785-D885 VanDerWaalsContact ND1-OD2 3.12Å
786	M	31.2	Very low	43.3	Very low	184 Å²	184	103.9 Å²	103.9	91%	0.906	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	24	-174.5	-83.6	-77.4	-176.2	0	0	112.4	Q784	Q784-M786 PolarHBondContact O-N 2.99Å
787	G	30.5	Very low	40.6	Very low	70 Å²	70	107.4 Å²	107.4	72%	0.722	63%	0.633	S	S	*	*	S	Bend	trans	-157	22.3	-173.4	0	0	0	0	0	116.6
788	T	28.7	Very low	38.3	Very low	107 Å²	107	115.8 Å²	115.8	66%	0.656	67%	0.666	S	S	*	*			trans	-109.9	4.3	-171.9	49.5	0	0	0	0	115.6
789	D	29.3	Very low	36.5	Very low	162 Å²	162	118.2 Å²	118.2	87%	0.866	69%	0.687	S	S	*	*	S	Bend	trans	-90.6	-6.9	-176.2	-85.6	3.9	0	0	0	115
790	E	31.1	Very low	34	Very low	196 Å²	196	126.4 Å²	126.4	92%	0.916	73%	0.73	S	S	*	*	S	Bend	trans	-106.4	8	-177.4	-68.8	-161.8	135	0	0	115.2
791	L	31.7	Very low	32.3	Very low	168 Å²	168	128.1 Å²	128.1	88%	0.88	75%	0.753	S	S	*	*	S	Bend	trans	-124.6	32.6	-174.8	-154.9	68.1	0	0	0	115.6
792	D	28.2	Very low	31.2	Very low	167 Å²	167	135.5 Å²	135.5	89%	0.893	78%	0.78	S	S	*	*	S	Bend	trans	-109.3	20.8	174.9	-157.5	33.7	0	0	0	113.5
793	G	29.1	Very low	30.8	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	79%	0.789	S	S	*	*	S	Bend	trans	-110.2	-11.1	-164.8	0	0	0	0	0	118.8
794	L	31.4	Very low	30.4	Very low	166 Å²	166	140.3 Å²	140.3	87%	0.869	82%	0.819	S	S	*	*	S	Bend	trans	-140.5	17.8	-154.3	-91.3	175.9	0	0	0	119.3
795	L	29.3	Very low	30.1	Very low	180 Å²	180	142.4 Å²	142.4	94%	0.942	83%	0.829	S	S	*	*			trans	-133.9	74	173.6	-73.2	177.3	0	0	0	114.1
796	C	31.2	Very low	30.1	Very low	137 Å²	137	140.7 Å²	140.7	93%	0.926	83%	0.831	S	S	*	*			trans	-145.2	123.7	162.5	-90.2	0	0	0	0	110.9
797	G	25.1	Very low	30.2	Very low	78 Å²	78	137.3 Å²	137.3	80%	0.804	83%	0.826	S	S	*	*			trans	99.8	131.8	-174.9	0	0	0	0	0	112.6
798	E	25.4	Very low	30.2	Very low	208 Å²	208	137.3 Å²	137.3	97%	0.972	83%	0.826	S	S	*	*			cis	-133.9	173.4	-1.3	-69.6	-161.3	124.5	0	0	111.7
799	A	35.2	Very low	30.9	Very low	95 Å²	95	138.2 Å²	138.2	79%	0.785	84%	0.835	S	S	*	*			trans	-118.9	128.5	-175.7	0	0	0	0	0	113.5
800	N	25.7	Very low	30.9	Very low	173 Å²	173	143.2 Å²	143.2	93%	0.925	84%	0.842	S	S	*	*			trans	-168	140.1	158.3	-116.6	-32.7	0	0	0	108.7
801	G	30.4	Very low	30.9	Very low	58 Å²	58	137.5 Å²	137.5	60%	0.598	84%	0.836	S	S	*	*			cis	143.5	90.2	-6.5	0	0	0	0	0	112.8
802	K	30.5	Very low	31.2	Very low	193 Å²	193	139.3 Å²	139.3	84%	0.839	84%	0.837	S	S	*	*			trans	169.5	98.7	149.7	-95.8	156.5	-173	174.9	0	114.3
803	D	33.2	Very low	31.3	Very low	152 Å²	152	141.2 Å²	141.2	81%	0.813	84%	0.837	S	S	*	*				36.2	123	120.6	-38.9	-42.1	0	0	0	121.2
804	A	27.7	Very low	32	Very low	106 Å²	106	148.7 Å²	148.7	88%	0.876	85%	0.85	S	S	*	*			trans	-149.4	118.2	141.7	0	0	0	0	0	110.1
805	E	32.8	Very low	31.9	Very low	187 Å²	187	150.5 Å²	150.5	87%	0.874	85%	0.851	S	S	*	*			trans	-84.9	176.6	177.4	-39.3	176.7	111.9	0	0	110.7
806	S	33.6	Very low	32.3	Very low	98 Å²	98	151.7 Å²	151.7	69%	0.685	85%	0.849	S	S	*	*			cis	-160	-177.4	3.1	-153.4	0	0	0	0	111.8
807	S	34.8	Very low	32.1	Very low	114 Å²	114	154.4 Å²	154.4	80%	0.797	85%	0.845	S	S	*	*			trans	-5.9	155.7	160.2	66.6	0	0	0	0	121.6
808	G	29.3	Very low	32.3	Very low	70 Å²	70	159 Å²	159	72%	0.722	84%	0.843	S	S	*	*			cis	169.6	-171.1	9	0	0	0	0	0	113.7
809	C	44.1	Very low	32.9	Very low	126 Å²	126	154.5 Å²	154.5	85%	0.851	83%	0.834	S	S	*	*			trans	-93.2	128.5	-163.3	-50.3	0	0	0	0	116.5
810	W	30.1	Very low	32.9	Very low	266 Å²	266	157 Å²	157	100%	1.008	83%	0.83	S	S	*	*			trans	-149.1	155.2	158.7	-81.6	86.3	0	0	0	112.2
811	G	29.6	Very low	33.3	Very low	77 Å²	77	156.1 Å²	156.1	79%	0.794	83%	0.825	S	S	*	*			trans	108.7	87.7	157.8	0	0	0	0	0	118.9
812	K	37.9	Very low	33.7	Very low	206 Å²	206	162 Å²	162	90%	0.896	84%	0.836	S	S	*	*			trans	-70	139.2	175.1	-61.1	166.1	-177.7	167.6	0	113.4
813	K	30.3	Very low	34.1	Very low	207 Å²	207	162.9 Å²	162.9	90%	0.9	84%	0.835	S	S	*	*			trans	-159.7	112.3	140.4	-112.6	159.9	-171.1	169.6	0	113.1	K815	K813-K815 PolarHBondContact O-N 2.98Å
814	K	43.8	Very low	35.2	Very low	225 Å²	225	157.3 Å²	157.3	98%	0.978	81%	0.805	S	S	*	*			trans	-67.5	96.1	174.9	-82.8	-176.2	172.2	178.6	0	111.1
815	K	30.3	Very low	36.4	Very low	204 Å²	204	154.8 Å²	154.8	89%	0.887	79%	0.789	S	S	*	*			trans	-89.6	114.3	160.6	-165.1	174	-176.2	179.9	0	108	K813 K817	K813-K815 PolarHBondContact O-N 2.98Å; K815-K817 VanDerWaalsContact C-N 3.32Å; K815-K817 PolarHBondContact O-N 3.01Å
816	K	37	Very low	37.6	Very low	205 Å²	205	146.6 Å²	146.6	89%	0.891	75%	0.752	S	S	*	*			trans	-69.5	84.2	-178.7	-174.4	176.9	179	176.8	0	110.2	K818	K816-K818 PolarHBondContact O-N 2.85Å
817	K	27.6	Very low	38.8	Very low	194 Å²	194	142.9 Å²	142.9	84%	0.843	73%	0.729	S	S	*	*			trans	-55.9	125.7	165.9	-173.1	176.6	-179.9	-177.7	0	106.8	K815 S819	K815-K817 VanDerWaalsContact C-N 3.32Å; K815-K817 PolarHBondContact O-N 3.01Å; K817-S819 VanDerWaalsContact C-N 3.3Å; K817-S819 PolarHBondContact O-N 3.26Å
818	K	28	Very low	40	Very low	175 Å²	175	142.6 Å²	142.6	76%	0.761	73%	0.725	S	S	*	*			trans	-74.8	87.7	179.3	-168.6	-175	178.7	-165.9	0	107.6	K816 Q820	K816-K818 PolarHBondContact O-N 2.85Å; K818-Q820 PolarHBondContact O-N 3.41Å; K818-Q820 VanDerWaalsContact O-N 3.1Å
819	S	38.9	Very low	41.5	Very low	113 Å²	113	142 Å²	142	79%	0.79	71%	0.705	S	S	*	*			trans	-67.2	105	171.6	177.9	0	0	0	0	108.1	K817	K817-S819 VanDerWaalsContact C-N 3.3Å; K817-S819 PolarHBondContact O-N 3.26Å
820	Q	34.2	Very low	42.3	Very low	149 Å²	149	139 Å²	139	70%	0.696	68%	0.683	S	S	*	*			trans	-154.1	38.5	167.7	-154.5	176.9	-8.5	0	0	111.8	K818	K818-Q820 PolarHBondContact O-N 3.41Å; K818-Q820 VanDerWaalsContact O-N 3.1Å
821	D	35.5	Very low	43.3	Very low	153 Å²	153	134 Å²	134	82%	0.818	68%	0.676	S	S	*	*	S	Bend	trans	-78.1	116.6	139.1	-68	-58.8	0	0	0	105.3	W823	D821-W823 PolarHBondContact O-N 2.93Å; D821-W823 VanDerWaalsContact O-N 3.14Å
822	Q	38	Very low	44.5	Very low	181 Å²	181	134.7 Å²	134.7	85%	0.846	67%	0.668	S	S	*	*			trans	-70.8	110	-177.5	-175.7	176.3	24.7	0	0	108.3	D824	Q822-D824 PolarHBondContact O-N 3.39Å
823	W	39.6	Very low	45.2	Very low	212 Å²	212	130.1 Å²	130.1	80%	0.803	67%	0.669	S	S	*	*			trans	-48.9	110.1	-175.7	-140	80	0	0	0	110.3	D821 G825	D821-W823 PolarHBondContact O-N 2.93Å; D821-W823 VanDerWaalsContact O-N 3.14Å; W823-G825 PolarHBondContact O-N 3.23Å
824	D	55.9	Low	46.8	Very low	36 Å²	36	125.9 Å²	125.9	19%	0.193	65%	0.652	C	S	.	*			trans	-88.3	28.9	-160.7	87.1	-42.8	0	0	0	113.2	Q822 V826 K916 R950	Q822-D824 PolarHBondContact O-N 3.39Å; D824-V826 WeakPolarHBondContact O-CG2 3.34Å; D824-V826 PolarHBondContact O-N 3.05Å; D824-K916 IonicContact OD1-NZ 2.75Å; D824-K916 WeakPolarHBondContact OD2-CE 3.04Å; D824-K916 IonicContact OD2-NZ 3.36Å; D824-K916 PolarHBondContact OD2-NZ 2.85Å; D824-R950 VanDerWaalsContact CA-NH1 3.31Å; D824-R950 PolarHBondContact O-NH1 3.14Å; D824-R950 PolarHBondContact O-NH2 3.38Å
825	G	52.4	Low	48.2	Very low	52 Å²	52	119.5 Å²	119.5	54%	0.536	63%	0.633	S	S	.	*	S	Bend	trans	63.9	3.8	175.5	0	0	0	0	0	114.7	W823	W823-G825 PolarHBondContact O-N 3.23Å
826	V	58.7	Low	50.6	Low	15 Å²	15	111 Å²	111	9%	0.091	60%	0.599	C	S	.	*	S	Bend	trans	-125.8	156.1	171	-138.6	0	0	0	0	107.3	D824 V908 Y909 A912	D824-V826 WeakPolarHBondContact O-CG2 3.34Å; D824-V826 PolarHBondContact O-N 3.05Å; V826-V908 HydrophobicContact CG1-CG1 3.93Å; V826-V908 HydrophobicContact CG2-CG1 4.03Å; V826-Y909 HydrophobicContact CB-CD1 4.42Å; V826-Y909 HydrophobicContact CB-CE1 4.16Å; V826-Y909 HydrophobicContact CG1-CD1 3.59Å; V826-Y909 HydrophobicContact CG1-CD2 4Å; V826-Y909 HydrophobicContact CG1-CE1 3.36Å; V826-Y909 HydrophobicContact CG1-CE2 3.81Å; V826-Y909 HydrophobicContact CG1-CG 3.9Å; V826-Y909 VanDerWaalsContact CG1-CZ 3.48Å; V826-A912 HydrophobicContact CG2-CB 3.78Å
827	G	59.6	Low	52.8	Low	20 Å²	20	106.4 Å²	106.4	21%	0.206	58%	0.579	C	S	.	*			trans	-69.1	176.3	170.7	0	0	0	0	0	111.5
828	P	59.2	Low	55.6	Low	109 Å²	109	98 Å²	98	71%	0.708	55%	0.548	S	S	*	.	S	Bend	trans	-49.7	146.6	147.4	28.4	-34.6	0	0	0	108.4	Y909	P828-Y909 PolarHBondContact O-OH 3.3Å
829	L	61.5	Low	58.3	Low	58 Å²	58	91.8 Å²	91.8	30%	0.304	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-55.9	141	171.6	-165.7	65.8	0	0	0	108.2	D831 H844 P845 W906 Y909	L829-D831 PolarHBondContact O-N 3.15Å; L829-H844 WeakPolarHBondContact CD2-NE2 3.47Å; L829-P845 HydrophobicContact CD1-CG 3.9Å; L829-W906 HydrophobicContact CD1-CZ3 3.96Å; L829-Y909 HydrophobicContact CB-CE1 4.48Å; L829-Y909 HydrophobicContact CD1-CD1 3.57Å; L829-Y909 HydrophobicContact CD1-CE1 3.78Å; L829-Y909 HydrophobicContact CD1-CG 4.02Å
830	P	61.1	Low	60.4	Low	61 Å²	61	90.8 Å²	90.8	40%	0.396	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-56.5	118.9	176.4	-23.6	33.8	0	0	0	109.4	C832 P904	P830-C832 VanDerWaalsContact C-N 3.31Å; P830-C832 PolarHBondContact O-N 3.44Å; P830-P904 HydrophobicContact CG-CB 3.95Å; P830-P904 HydrophobicContact CG-CG 4.16Å
831	D	51	Low	63	Low	162 Å²	162	85 Å²	85	87%	0.866	48%	0.479	S	S	*	.			trans	-67.6	88.9	-178.1	-72.5	-48.2	0	0	0	109.6	L829	L829-D831 PolarHBondContact O-N 3.15Å
832	C	55	Low	65.5	Low	92 Å²	92	77.8 Å²	77.8	62%	0.622	44%	0.44	S	S	*	.			trans	-76.8	130.3	170.9	-163.9	0	0	0	0	108.8	P830 E834	P830-C832 VanDerWaalsContact C-N 3.31Å; P830-C832 PolarHBondContact O-N 3.44Å; C832-E834 PolarHBondContact O-N 3.34Å; C832-E834 PolarHBondContact SG-O 2.93Å
833	A	52	Low	67.7	Low	110 Å²	110	70 Å²	70	91%	0.909	40%	0.403	S	S	*	.	S	Bend	trans	-68	-17.2	-179.1	0	0	0	0	0	113.4
834	E	63.2	Low	70	Confident	118 Å²	118	61.8 Å²	61.8	55%	0.551	37%	0.373	S	S	*	.	S	Bend	trans	-116.8	148.7	173.4	-73.3	-161.4	-152.3	0	0	111.9	C832 K837	C832-E834 PolarHBondContact O-N 3.34Å; C832-E834 PolarHBondContact SG-O 2.93Å; E834-K837 IonicContact OE2-NZ 3.59Å; E834-K837 PolarHBondContact OE2-NZ 2.58Å
835	P	74	Confident	71.6	Confident	90 Å²	90	61.1 Å²	61.1	58%	0.584	37%	0.371	S	S	*	.			trans	-64.1	150	170	29.6	-35.4	0	0	0	110.9
836	P	81.3	Confident	73.3	Confident	25 Å²	25	61.5 Å²	61.5	16%	0.162	37%	0.365	C	S	.	.			trans	-63.9	136.3	178.4	30.7	-39.2	0	0	0	111.2	Q840 M841 H844	P836-Q840 HydrophobicContact CB-CB 4.14Å; P836-M841 HydrophobicContact CB-CG 4.34Å; P836-M841 WeakPolarHBondContact O-CG 3.45Å; P836-H844 HydrophobicContact CB-CB 3.97Å; P836-H844 HydrophobicContact CG-CB 4.06Å
837	K	82.7	Confident	75	Confident	109 Å²	109	61 Å²	61	47%	0.474	36%	0.362	S	S	.	.			trans	-132.9	158.9	178.3	-59.2	168.6	-165.3	163.4	0	110	D742 E834 I839 Q840	D742-K837 WeakPolarHBondContact OD1-CA 3.35Å; E834-K837 IonicContact OE2-NZ 3.59Å; E834-K837 PolarHBondContact OE2-NZ 2.58Å; K837-I839 PolarHBondContact O-N 3.1Å; K837-Q840 WeakPolarHBondContact O-CB 3.39Å; K837-Q840 PolarHBondContact O-N 3.28Å; K837-Q840 VanDerWaalsContact O-N 3.14Å
838	G	85	Confident	76.7	Confident	18 Å²	18	60 Å²	60	19%	0.186	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	-137.1	176.1	0	0	0	0	0	112.7	T741 D742 Q840 M841	T741-G838 VanDerWaalsContact CG2-O 3.27Å; T741-G838 WeakPolarHBondContact CG2-O 3.47Å; D742-G838 VanDerWaalsContact CG-N 3.29Å; D742-G838 PolarHBondContact OD1-N 3.36Å; D742-G838 WeakPolarHBondContact OD2-CA 3.15Å; D742-G838 PolarHBondContact OD2-N 2.95Å; D742-G838 VanDerWaalsContact OD2-N 3.1Å; G838-Q840 PolarHBondContact O-N 3.08Å; G838-M841 WeakPolarHBondContact O-CB 3.45Å; G838-M841 PolarHBondContact O-N 3.03Å
839	I	85.1	Confident	78.4	Confident	45 Å²	45	60.7 Å²	60.7	23%	0.231	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-31.6	177.7	-164.6	-179	0	0	0	113.8	R735 T780 K837 M841 L842 W843	R735-I839 HydrophobicContact CB-CD1 3.79Å; R735-I839 HydrophobicContact CB-CG1 3.93Å; R735-I839 HydrophobicContact CG-CD1 4.42Å; R735-I839 HydrophobicContact CG-CG1 4.29Å; T780-I839 HydrophobicContact CG2-CD1 4.29Å; K837-I839 PolarHBondContact O-N 3.1Å; I839-M841 PolarHBondContact O-N 3.36Å; I839-L842 HydrophobicContact CG1-CD1 4.28Å; I839-L842 WeakPolarHBondContact O-CB 3.32Å; I839-L842 PolarHBondContact O-N 2.64Å; I839-L842 VanDerWaalsContact O-N 3.14Å; I839-W843 HydrophobicContact CB-CH2 4.46Å; I839-W843 HydrophobicContact CD1-CH2 4.05Å; I839-W843 HydrophobicContact CD1-CZ3 3.87Å; I839-W843 HydrophobicContact CG1-CH2 3.93Å; I839-W843 HydrophobicContact CG1-CZ3 3.66Å; I839-W843 HydrophobicContact CG2-CH2 3.98Å
840	Q	84.3	Confident	80.1	Confident	91 Å²	91	58.5 Å²	58.5	43%	0.425	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-29.2	-177.9	-53.3	-173.9	15.6	0	0	112.6	P836 K837 G838 L842 W843 H844	P836-Q840 HydrophobicContact CB-CB 4.14Å; K837-Q840 WeakPolarHBondContact O-CB 3.39Å; K837-Q840 PolarHBondContact O-N 3.28Å; K837-Q840 VanDerWaalsContact O-N 3.14Å; G838-Q840 PolarHBondContact O-N 3.08Å; Q840-L842 PolarHBondContact O-N 3.49Å; Q840-W843 HydrophobicContact CB-CZ2 4.23Å; Q840-W843 HydrophobicContact CG-CZ2 4.08Å; Q840-W843 PolarHBondContact O-N 3.35Å; Q840-H844 WeakPolarHBondContact O-CB 3.5Å; Q840-H844 PolarHBondContact O-N 2.82Å
841	M	87.6	Confident	81.9	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.143	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-30	178	-59.7	-166.8	81.8	0	0	112.1	T741 L745 P836 G838 I839 W843 H844 I847	T741-M841 HydrophobicContact CG2-CB 4.31Å; L745-M841 HydrophobicContact CD1-CB 3.51Å; L745-M841 HydrophobicContact CD1-CE 3.91Å; L745-M841 HydrophobicContact CD1-CG 4.23Å; L745-M841 HydrophobicContact CD1-SD 3.7Å; P836-M841 HydrophobicContact CB-CG 4.34Å; P836-M841 WeakPolarHBondContact O-CG 3.45Å; G838-M841 WeakPolarHBondContact O-CB 3.45Å; G838-M841 PolarHBondContact O-N 3.03Å; I839-M841 PolarHBondContact O-N 3.36Å; M841-W843 VanDerWaalsContact C-N 3.3Å; M841-W843 PolarHBondContact O-N 2.94Å; M841-H844 PolarHBondContact O-N 3.35Å; M841-I847 WeakPolarHBondContact O-CB 3.38Å; M841-I847 WeakPolarHBondContact O-CD1 3.37Å
842	L	88.6	Confident	84.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-37	-177.8	-62.7	178.2	0	0	0	112.7	R735 T741 L769 L772 L776 I839 Q840 I847 L874	R735-L842 HydrophobicContact CG-CD1 3.83Å; T741-L842 HydrophobicContact CG2-CD2 3.77Å; T741-L842 HydrophobicContact CG2-CG 3.95Å; L769-L842 HydrophobicContact CD2-CD2 3.79Å; L772-L842 HydrophobicContact CB-CD1 4.01Å; L776-L842 HydrophobicContact CD1-CD1 4.14Å; L776-L842 HydrophobicContact CD2-CB 3.75Å; I839-L842 HydrophobicContact CG1-CD1 4.28Å; I839-L842 WeakPolarHBondContact O-CB 3.32Å; I839-L842 PolarHBondContact O-N 2.64Å; I839-L842 VanDerWaalsContact O-N 3.14Å; Q840-L842 PolarHBondContact O-N 3.49Å; L842-I847 HydrophobicContact CD2-CD1 4.44Å; L842-L874 WeakPolarHBondContact O-CD1 3.02Å; L842-L874 WeakPolarHBondContact O-CD2 3.43Å
843	W	84.6	Confident	86.2	Confident	19 Å²	19	45.1 Å²	45.1	7%	0.072	25%	0.253	C	S	.	.	H	α-helix	trans	-104.5	-7.9	-179.3	58.7	68.1	0	0	0	114.2	L776 T780 I839 Q840 M841 W879 W906	L776-W843 HydrophobicContact CD1-CE3 4.13Å; L776-W843 HydrophobicContact CD1-CZ3 4.21Å; L776-W843 HydrophobicContact CD2-CB 4.24Å; L776-W843 HydrophobicContact CD2-CE3 3.87Å; L776-W843 HydrophobicContact CG-CE3 3.97Å; L776-W843 HydrophobicContact CG-CZ3 4.46Å; T780-W843 HydrophobicContact CG2-CH2 4.24Å; T780-W843 HydrophobicContact CG2-CZ3 4.13Å; I839-W843 HydrophobicContact CB-CH2 4.46Å; I839-W843 HydrophobicContact CD1-CH2 4.05Å; I839-W843 HydrophobicContact CD1-CZ3 3.87Å; I839-W843 HydrophobicContact CG1-CH2 3.93Å; I839-W843 HydrophobicContact CG1-CZ3 3.66Å; I839-W843 HydrophobicContact CG2-CH2 3.98Å; Q840-W843 HydrophobicContact CB-CZ2 4.23Å; Q840-W843 HydrophobicContact CG-CZ2 4.08Å; Q840-W843 PolarHBondContact O-N 3.35Å; M841-W843 VanDerWaalsContact C-N 3.3Å; M841-W843 PolarHBondContact O-N 2.94Å; W843-W879 HydrophobicContact CB-CH2 3.47Å; W843-W879 VanDerWaalsContact CB-CH2 3.47Å; W843-W879 HydrophobicContact CB-CZ2 3.99Å; W843-W879 HydrophobicContact CB-CZ3 4.19Å; W843-W879 HydrophobicContact CD2-CH2 4.04Å; W843-W879 HydrophobicContact CD2-CZ3 4.19Å; W843-W879 AromaticContact CE3-CH2 3.89Å; W843-W879 HydrophobicContact CE3-CH2 3.89Å; W843-W879 HydrophobicContact CE3-CZ3 4.18Å; W843-W879 AromaticContact CG-CH2 3.91Å; W843-W879 HydrophobicContact CG-CH2 3.91Å; W843-W879 HydrophobicContact CG-CZ3 4.21Å; W843-W906 HydrophobicContact CB-CB 4.12Å; W843-W906 HydrophobicContact CB-CG 4.22Å; W843-W906 AromaticContact CD1-CD2 3.55Å; W843-W906 AromaticContact CD1-CE2 3.62Å; W843-W906 AromaticContact CD1-CE3 3.91Å; W843-W906 AromaticContact CD1-CG 3.88Å; W843-W906 AromaticContact CD1-NE1 3.91Å; W843-W906 HydrophobicContact CG-CD2 4.33Å; W843-W906 HydrophobicContact CG-CG 4.23Å; W843-W906 AromaticContact NE1-CE2 3.92Å
844	H	87.3	Confident	88.4	Confident	38 Å²	38	39.9 Å²	39.9	18%	0.176	21%	0.21	C	C	.	.	S	Bend	trans	-75.9	135.4	-179.3	-173.1	-92.7	0	0	0	112	L829 P836 Q840 M841 S846 I847	L829-H844 WeakPolarHBondContact CD2-NE2 3.47Å; P836-H844 HydrophobicContact CB-CB 3.97Å; P836-H844 HydrophobicContact CG-CB 4.06Å; Q840-H844 WeakPolarHBondContact O-CB 3.5Å; Q840-H844 PolarHBondContact O-N 2.82Å; M841-H844 PolarHBondContact O-N 3.35Å; H844-S846 PolarHBondContact ND1-N 2.91Å; H844-S846 PolarHBondContact ND1-OG 3.15Å; H844-S846 PolarHBondContact O-N 3.49Å; H844-I847 VanDerWaalsContact O-CG2 3.28Å; H844-I847 WeakPolarHBondContact O-CG2 3.39Å; H844-I847 PolarHBondContact O-N 2.88Å
845	P	88.9	Confident	90	Very high	23 Å²	23	34.5 Å²	34.5	15%	0.149	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-56.1	-22.1	-174.4	-31.8	39.2	0	0	0	117.2	L829 I847 V848 A913	L829-P845 HydrophobicContact CD1-CG 3.9Å; P845-I847 PolarHBondContact O-N 3.43Å; P845-V848 WeakPolarHBondContact O-CB 3.08Å; P845-V848 WeakPolarHBondContact O-CG2 2.94Å; P845-V848 PolarHBondContact O-N 2.79Å; P845-V848 VanDerWaalsContact O-N 3.16Å; P845-A913 HydrophobicContact CB-CB 4.04Å
846	S	89.5	Confident	91.1	Very high	59 Å²	59	33.5 Å²	33.5	41%	0.413	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-60.7	-25.9	175.6	57.6	0	0	0	0	113.6	H844 V848 K849 P850	H844-S846 PolarHBondContact ND1-N 2.91Å; H844-S846 PolarHBondContact ND1-OG 3.15Å; H844-S846 PolarHBondContact O-N 3.49Å; S846-V848 PolarHBondContact O-N 3.29Å; S846-K849 PolarHBondContact O-N 3.3Å; S846-P850 WeakPolarHBondContact O-CD 3.43Å
847	I	92.9	Very high	91.8	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-66.2	-20.1	177.7	-154.2	175.4	0	0	0	112.9	L745 M841 L842 H844 P845 K849 P850 Y851 L874 I910	L745-I847 HydrophobicContact CD1-CD1 4.18Å; L745-I847 HydrophobicContact CD1-CG1 4.47Å; L745-I847 HydrophobicContact CD2-CD1 3.97Å; L745-I847 HydrophobicContact CD2-CG1 3.83Å; M841-I847 WeakPolarHBondContact O-CB 3.38Å; M841-I847 WeakPolarHBondContact O-CD1 3.37Å; L842-I847 HydrophobicContact CD2-CD1 4.44Å; H844-I847 VanDerWaalsContact O-CG2 3.28Å; H844-I847 WeakPolarHBondContact O-CG2 3.39Å; H844-I847 PolarHBondContact O-N 2.88Å; P845-I847 PolarHBondContact O-N 3.43Å; I847-K849 PolarHBondContact O-N 3.39Å; I847-P850 WeakPolarHBondContact O-CD 3.34Å; I847-Y851 HydrophobicContact CB-CE2 4.45Å; I847-Y851 HydrophobicContact CD1-CE2 3.73Å; I847-Y851 HydrophobicContact CG1-CD2 4.2Å; I847-Y851 HydrophobicContact CG1-CE2 3.58Å; I847-Y851 HydrophobicContact CG2-CE2 4.24Å; I847-Y851 WeakPolarHBondContact O-CD2 3.15Å; I847-L874 HydrophobicContact CG2-CD1 3.81Å; I847-I910 HydrophobicContact CG2-CD1 4.24Å
848	V	95.8	Very high	92.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.4	-39.6	179.7	172.4	0	0	0	0	111.7	P845 S846 Y851 L852 L871 I910 A913 V914	P845-V848 WeakPolarHBondContact O-CB 3.08Å; P845-V848 WeakPolarHBondContact O-CG2 2.94Å; P845-V848 PolarHBondContact O-N 2.79Å; P845-V848 VanDerWaalsContact O-N 3.16Å; S846-V848 PolarHBondContact O-N 3.29Å; V848-Y851 PolarHBondContact O-N 2.91Å; V848-L852 HydrophobicContact CG1-CD1 3.65Å; V848-L852 HydrophobicContact CG1-CG 4.02Å; V848-L852 WeakPolarHBondContact O-CG 3.44Å; V848-L852 PolarHBondContact O-N 2.83Å; V848-L871 HydrophobicContact CG1-CD2 4.36Å; V848-L871 HydrophobicContact CG2-CD2 4.19Å; V848-I910 HydrophobicContact CG2-CD1 3.66Å; V848-I910 HydrophobicContact CG2-CG2 4.14Å; V848-A913 HydrophobicContact CB-CB 4.33Å; V848-A913 HydrophobicContact CG1-CB 4.41Å; V848-A913 HydrophobicContact CG2-CB 4.08Å; V848-V914 HydrophobicContact CG1-CB 4.33Å; V848-V914 HydrophobicContact CG1-CG2 3.5Å; V848-V914 HydrophobicContact CG2-CG2 4.21Å
849	K	95.8	Very high	92.9	Very high	124 Å²	124	36 Å²	36	54%	0.539	20%	0.198	S	C	.	.	H	α-helix	trans	-64.7	-50.5	-175.1	178.9	174.6	178.1	-179.6	0	112.5	S846 I847 Y851 L852 T853	S846-K849 PolarHBondContact O-N 3.3Å; I847-K849 PolarHBondContact O-N 3.39Å; K849-Y851 VanDerWaalsContact C-N 3.33Å; K849-Y851 PolarHBondContact O-N 2.95Å; K849-L852 PolarHBondContact O-N 3.18Å; K849-L852 VanDerWaalsContact O-N 3.1Å; K849-T853 PolarHBondContact O-N 2.88Å; K849-T853 PolarHBondContact O-OG1 2.86Å
850	P	96.8	Very high	93.4	Very high	11 Å²	11	35.1 Å²	35.1	7%	0.071	19%	0.193	C	C	.	.	H	α-helix	trans	-53.3	-43.7	172.8	-29.4	36.2	0	0	0	114.1	I748 Q749 L752 S846 I847 L852 T853 L854	I748-P850 HydrophobicContact CG2-CB 4.31Å; Q749-P850 HydrophobicContact CG-CG 4.19Å; L752-P850 HydrophobicContact CD1-CB 4.2Å; S846-P850 WeakPolarHBondContact O-CD 3.43Å; I847-P850 WeakPolarHBondContact O-CD 3.34Å; P850-L852 PolarHBondContact O-N 3.36Å; P850-T853 PolarHBondContact O-N 3.45Å; P850-L854 WeakPolarHBondContact O-CG 3.25Å; P850-L854 PolarHBondContact O-N 3.05Å
851	Y	98.5	Very high	94	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-65.3	-37.5	176.6	-67.4	-48.3	0	0	0	112.9	L769 I847 V848 K849 L854 L855 A867 A870 L871 L874	L769-Y851 VanDerWaalsContact CB-OH 3.29Å; L769-Y851 WeakPolarHBondContact CB-OH 3.39Å; I847-Y851 HydrophobicContact CB-CE2 4.45Å; I847-Y851 HydrophobicContact CD1-CE2 3.73Å; I847-Y851 HydrophobicContact CG1-CD2 4.2Å; I847-Y851 HydrophobicContact CG1-CE2 3.58Å; I847-Y851 HydrophobicContact CG2-CE2 4.24Å; I847-Y851 WeakPolarHBondContact O-CD2 3.15Å; V848-Y851 PolarHBondContact O-N 2.91Å; K849-Y851 VanDerWaalsContact C-N 3.33Å; K849-Y851 PolarHBondContact O-N 2.95Å; Y851-L854 HydrophobicContact CD1-CD1 4.38Å; Y851-L855 WeakPolarHBondContact O-CB 3.43Å; Y851-L855 WeakPolarHBondContact O-CD1 3.37Å; Y851-L855 WeakPolarHBondContact O-CG 3.49Å; Y851-L855 PolarHBondContact O-N 3.47Å; Y851-A867 HydrophobicContact CD1-CB 4.02Å; Y851-A870 HydrophobicContact CD1-CB 4.21Å; Y851-A870 HydrophobicContact CD2-CB 4.23Å; Y851-A870 HydrophobicContact CE1-CB 3.71Å; Y851-A870 HydrophobicContact CE2-CB 3.71Å; Y851-A870 HydrophobicContact CG-CB 4.46Å; Y851-A870 VanDerWaalsContact CZ-CB 3.44Å; Y851-L871 HydrophobicContact CD2-CD2 3.9Å; Y851-L871 HydrophobicContact CD2-CG 4.28Å; Y851-L871 HydrophobicContact CG-CD2 4.41Å; Y851-L871 HydrophobicContact CG-CG 4.42Å; Y851-L874 HydrophobicContact CE2-CD1 4.15Å
852	L	98.1	Very high	94.5	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-70.1	-37.8	176.8	-70.6	179.3	0	0	0	112.6	V848 K849 P850 L855 S856 L871 E917 I922	V848-L852 HydrophobicContact CG1-CD1 3.65Å; V848-L852 HydrophobicContact CG1-CG 4.02Å; V848-L852 WeakPolarHBondContact O-CG 3.44Å; V848-L852 PolarHBondContact O-N 2.83Å; K849-L852 PolarHBondContact O-N 3.18Å; K849-L852 VanDerWaalsContact O-N 3.1Å; P850-L852 PolarHBondContact O-N 3.36Å; L852-L855 HydrophobicContact CD2-CD1 4.32Å; L852-L855 PolarHBondContact O-N 3.01Å; L852-S856 PolarHBondContact O-N 3.02Å; L852-S856 VanDerWaalsContact O-N 3.11Å; L852-S856 PolarHBondContact O-OG 2.81Å; L852-L871 HydrophobicContact CD2-CD1 3.82Å; L852-L871 HydrophobicContact CG-CD1 4.41Å; L852-E917 HydrophobicContact CD1-CB 3.54Å; L852-I922 HydrophobicContact CB-CD1 4.28Å
853	T	97.7	Very high	94.9	Very high	26 Å²	26	33.8 Å²	33.8	16%	0.16	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-47.1	173	-62.9	0	0	0	0	111.2	L752 K849 P850 L855 S856 E857	L752-T853 HydrophobicContact CB-CG2 4.06Å; L752-T853 HydrophobicContact CD1-CG2 4.12Å; L752-T853 HydrophobicContact CD2-CG2 3.8Å; L752-T853 HydrophobicContact CG-CG2 4.18Å; K849-T853 PolarHBondContact O-N 2.88Å; K849-T853 PolarHBondContact O-OG1 2.86Å; P850-T853 PolarHBondContact O-N 3.45Å; T853-L855 VanDerWaalsContact C-N 3.3Å; T853-L855 PolarHBondContact O-N 3.04Å; T853-S856 PolarHBondContact O-N 3.34Å; T853-S856 VanDerWaalsContact O-N 3.12Å; T853-S856 PolarHBondContact O-OG 3.03Å; T853-E857 VanDerWaalsContact CG2-CD 3.47Å; T853-E857 HydrophobicContact CG2-CG 4.39Å; T853-E857 WeakPolarHBondContact CG2-OE1 3.45Å; T853-E857 WeakPolarHBondContact CG2-OE2 3.47Å; T853-E857 WeakPolarHBondContact O-CB 3.49Å; T853-E857 PolarHBondContact O-N 3.27Å
854	L	98.1	Very high	95.6	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-55.3	-45.5	171.2	-71.6	169.6	0	0	0	111.5	I748 L752 I757 V762 V766 P850 Y851 S856 E857 C858 T863 A867	I748-L854 HydrophobicContact CG2-CD1 3.81Å; I748-L854 HydrophobicContact CG2-CG 4.36Å; L752-L854 HydrophobicContact CD2-CD2 3.95Å; L752-L854 HydrophobicContact CD2-CG 3.98Å; I757-L854 HydrophobicContact CD1-CD2 4.15Å; I757-L854 HydrophobicContact CG1-CD2 3.71Å; V762-L854 HydrophobicContact CG1-CD2 3.92Å; V766-L854 HydrophobicContact CG2-CD1 3.49Å; V766-L854 VanDerWaalsContact CG2-CD1 3.49Å; P850-L854 WeakPolarHBondContact O-CG 3.25Å; P850-L854 PolarHBondContact O-N 3.05Å; Y851-L854 HydrophobicContact CD1-CD1 4.38Å; L854-S856 PolarHBondContact O-N 3.32Å; L854-E857 PolarHBondContact O-N 3.18Å; L854-C858 WeakPolarHBondContact O-CB 3.47Å; L854-C858 PolarHBondContact O-N 3.29Å; L854-T863 HydrophobicContact CD2-CG2 4.13Å; L854-A867 HydrophobicContact CB-CB 4.29Å; L854-A867 HydrophobicContact CD1-CB 4.41Å
855	L	98.1	Very high	96.1	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-67.9	-12.6	-179.6	-71.3	164.9	0	0	0	114.5	Y851 L852 T853 L864 A867 A868 L871 I922 L923 L926	Y851-L855 WeakPolarHBondContact O-CB 3.43Å; Y851-L855 WeakPolarHBondContact O-CD1 3.37Å; Y851-L855 WeakPolarHBondContact O-CG 3.49Å; Y851-L855 PolarHBondContact O-N 3.47Å; L852-L855 HydrophobicContact CD2-CD1 4.32Å; L852-L855 PolarHBondContact O-N 3.01Å; T853-L855 VanDerWaalsContact C-N 3.3Å; T853-L855 PolarHBondContact O-N 3.04Å; L855-L864 HydrophobicContact CD2-CD2 4.14Å; L855-L864 WeakPolarHBondContact CD2-O 3.49Å; L855-A867 HydrophobicContact CD1-CB 4.25Å; L855-A867 HydrophobicContact CD2-CB 3.98Å; L855-A867 HydrophobicContact CG-CB 3.83Å; L855-A868 HydrophobicContact CD2-CB 4.03Å; L855-L871 HydrophobicContact CD1-CD1 3.62Å; L855-I922 HydrophobicContact CB-CG2 3.79Å; L855-I922 VanDerWaalsContact O-CG2 3.3Å; L855-I922 WeakPolarHBondContact O-CG2 3Å; L855-L923 HydrophobicContact CD1-CD2 4.16Å; L855-L926 HydrophobicContact CB-CD1 3.88Å; L855-L926 HydrophobicContact CD2-CD1 3.4Å; L855-L926 HydrophobicContact CG-CD1 4.19Å
856	S	97	Very high	96.5	Very high	70 Å²	70	32.2 Å²	32.2	49%	0.49	19%	0.185	S	C	.	.	H	α-helix	trans	-107.4	-24.4	174.9	53.7	0	0	0	0	115.1	L852 T853 L854	L852-S856 PolarHBondContact O-N 3.02Å; L852-S856 VanDerWaalsContact O-N 3.11Å; L852-S856 PolarHBondContact O-OG 2.81Å; T853-S856 PolarHBondContact O-N 3.34Å; T853-S856 VanDerWaalsContact O-N 3.12Å; T853-S856 PolarHBondContact O-OG 3.03Å; L854-S856 PolarHBondContact O-N 3.32Å
857	E	95.9	Very high	96.9	Very high	101 Å²	101	29.4 Å²	29.4	47%	0.472	17%	0.165	S	C	.	.	H	α-helix	trans	-112.8	-20.4	-171.5	-67	173.1	-163.7	0	0	113.9	G753 I757 T853 L854	G753-E857 PolarHBondContact N-OE2 3.06Å; I757-E857 HydrophobicContact CD1-CB 3.53Å; T853-E857 VanDerWaalsContact CG2-CD 3.47Å; T853-E857 HydrophobicContact CG2-CG 4.39Å; T853-E857 WeakPolarHBondContact CG2-OE1 3.45Å; T853-E857 WeakPolarHBondContact CG2-OE2 3.47Å; T853-E857 WeakPolarHBondContact O-CB 3.49Å; T853-E857 PolarHBondContact O-N 3.27Å; L854-E857 PolarHBondContact O-N 3.18Å
858	C	95.8	Very high	97.2	Very high	13 Å²	13	29.2 Å²	29.2	9%	0.088	16%	0.164	C	C	.	.			trans	-84.2	137.7	-176.6	-173.3	0	0	0	0	112.1	I757 D758 L854 T863 L864	I757-C858 HydrophobicContact CG1-CB 4.41Å; D758-C858 PolarHBondContact OD1-SG 3.12Å; L854-C858 WeakPolarHBondContact O-CB 3.47Å; L854-C858 PolarHBondContact O-N 3.29Å; C858-T863 HydrophobicContact CB-CG2 4.49Å; C858-T863 WeakPolarHBondContact SG-CB 3.37Å; C858-T863 VanDerWaalsContact SG-CG2 3.5Å; C858-L864 HydrophobicContact CB-CD2 4.07Å; C858-L864 HydrophobicContact CB-CG 4.49Å
859	S	94.9	Very high	97.3	Very high	91 Å²	91	29.4 Å²	29.4	64%	0.636	17%	0.166	S	C	*	.			trans	-96.9	-22.5	172.7	79.1	0	0	0	0	113.3	D758 P861	D758-S859 VanDerWaalsContact CG-OG 3.24Å; D758-S859 PolarHBondContact OD1-N 3.11Å; D758-S859 PolarHBondContact OD1-OG 3.37Å; D758-S859 WeakPolarHBondContact OD2-CB 3.49Å; D758-S859 PolarHBondContact OD2-N 3.2Å; D758-S859 PolarHBondContact OD2-OG 3.2Å; S859-P861 WeakPolarHBondContact O-CD 3.41Å
860	N	95.9	Very high	97.4	Very high	26 Å²	26	23.5 Å²	23.5	14%	0.139	14%	0.14	C	C	.	.			trans	-67.9	115.2	-179.2	-179.5	-13.7	0	0	0	111.5	D758 E763 D862 T863 L864	D758-N860 HydrophobicContact CB-CB 4.28Å; D758-N860 PolarHBondContact O-ND2 3.46Å; D758-N860 WeakPolarHBondContact OD1-CB 3.43Å; D758-N860 PolarHBondContact OD1-N 3.02Å; E763-N860 PolarHBondContact OE2-ND2 2.84Å; N860-D862 VanDerWaalsContact C-N 3.34Å; N860-D862 PolarHBondContact O-N 3.44Å; N860-D862 PolarHBondContact OD1-N 2.78Å; N860-T863 PolarHBondContact ND2-OG1 3.33Å; N860-T863 WeakPolarHBondContact O-CB 2.96Å; N860-T863 PolarHBondContact O-N 2.96Å; N860-L864 WeakPolarHBondContact O-CG 3.34Å; N860-L864 PolarHBondContact O-N 3.08Å
861	P	96.6	Very high	97.4	Very high	48 Å²	48	23 Å²	23	31%	0.312	14%	0.137	S	C	.	.	H	α-helix	trans	-67.8	-28.4	-175.5	27.7	-35.2	0	0	0	114	S859 T863 L864 E865 N931 V934	S859-P861 WeakPolarHBondContact O-CD 3.41Å; P861-T863 VanDerWaalsContact C-N 3.33Å; P861-L864 PolarHBondContact O-N 2.61Å; P861-E865 WeakPolarHBondContact O-CB 3.38Å; P861-E865 PolarHBondContact O-N 3.45Å; P861-N931 WeakPolarHBondContact CB-ND2 3.35Å; P861-V934 HydrophobicContact CB-CG2 4.03Å; P861-V934 VanDerWaalsContact O-CG2 3.31Å; P861-V934 WeakPolarHBondContact O-CG2 3.48Å
862	D	97	Very high	97.3	Very high	43 Å²	43	25.1 Å²	25.1	23%	0.23	15%	0.147	C	C	.	.	H	α-helix	trans	-69.2	-35.7	176.6	-72.5	-27.4	0	0	0	110.2	K760 E763 N860 G866 R933	K760-D862 IonicContact NZ-OD2 3.64Å; E763-D862 HydrophobicContact CG-CB 3.72Å; E763-D862 WeakPolarHBondContact OE1-CB 3.16Å; N860-D862 VanDerWaalsContact C-N 3.34Å; N860-D862 PolarHBondContact O-N 3.44Å; N860-D862 PolarHBondContact OD1-N 2.78Å; D862-G866 PolarHBondContact O-N 3.1Å; D862-R933 IonicContact OD1-NH1 4Å
863	T	98	Very high	97.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.5	-42.9	173.6	-56.7	0	0	0	0	111.4	V762 E763 V766 L854 C858 N860 P861 G866 A867	V762-T863 HydrophobicContact CG1-CG2 4.32Å; E763-T863 WeakPolarHBondContact CA-OG1 3.24Å; E763-T863 VanDerWaalsContact CB-OG1 3.32Å; E763-T863 WeakPolarHBondContact CB-OG1 3.46Å; E763-T863 WeakPolarHBondContact CG-OG1 3.5Å; V766-T863 HydrophobicContact CG2-CG2 4.22Å; L854-T863 HydrophobicContact CD2-CG2 4.13Å; C858-T863 HydrophobicContact CB-CG2 4.49Å; C858-T863 WeakPolarHBondContact SG-CB 3.37Å; C858-T863 VanDerWaalsContact SG-CG2 3.5Å; N860-T863 PolarHBondContact ND2-OG1 3.33Å; N860-T863 WeakPolarHBondContact O-CB 2.96Å; N860-T863 PolarHBondContact O-N 2.96Å; P861-T863 VanDerWaalsContact C-N 3.33Å; T863-G866 PolarHBondContact O-N 3.03Å; T863-A867 WeakPolarHBondContact O-CB 3.39Å; T863-A867 PolarHBondContact O-N 3.2Å
864	L	98.4	Very high	96.8	Very high	9 Å²	9	25 Å²	25	5%	0.047	15%	0.145	C	C	.	.	H	α-helix	trans	-62.4	-44.2	175.5	-67.9	174.2	0	0	0	111.9	L855 C858 N860 P861 G866 A868 L926 I929 V934	L855-L864 HydrophobicContact CD2-CD2 4.14Å; L855-L864 WeakPolarHBondContact CD2-O 3.49Å; C858-L864 HydrophobicContact CB-CD2 4.07Å; C858-L864 HydrophobicContact CB-CG 4.49Å; N860-L864 WeakPolarHBondContact O-CG 3.34Å; N860-L864 PolarHBondContact O-N 3.08Å; P861-L864 PolarHBondContact O-N 2.61Å; L864-G866 VanDerWaalsContact C-N 3.34Å; L864-A868 VanDerWaalsContact O-CB 3.31Å; L864-A868 WeakPolarHBondContact O-CB 3.23Å; L864-A868 PolarHBondContact O-N 2.94Å; L864-L926 HydrophobicContact CD1-CD2 4.27Å; L864-L926 HydrophobicContact CD2-CD2 4.35Å; L864-I929 HydrophobicContact CD1-CD1 4.17Å; L864-V934 HydrophobicContact CB-CG1 3.97Å; L864-V934 HydrophobicContact CB-CG2 4.01Å
865	E	98.2	Very high	96.5	Very high	36 Å²	36	25 Å²	25	17%	0.168	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-43.7	173.4	-166.3	-155.1	132.6	0	0	110.9	R770 P861 G869 R933 V934 A937	R770-E865 IonicContact NH2-OE1 3.59Å; P861-E865 WeakPolarHBondContact O-CB 3.38Å; P861-E865 PolarHBondContact O-N 3.45Å; E865-G869 PolarHBondContact O-N 3.41Å; E865-R933 HydrophobicContact CG-CB 4.35Å; E865-R933 WeakPolarHBondContact OE2-CB 3.4Å; E865-R933 WeakPolarHBondContact OE2-CD 3.14Å; E865-V934 HydrophobicContact CB-CG2 4.25Å; E865-A937 HydrophobicContact CG-CB 3.87Å
866	G	97.9	Very high	95.8	Very high	3 Å²	3	26.4 Å²	26.4	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-59.2	-49	177.2	0	0	0	0	0	113.1	V766 R770 D862 T863 L864 G869 A870	V766-G866 VanDerWaalsContact CG1-C 3.46Å; R770-G866 WeakPolarHBondContact CB-O 3.5Å; R770-G866 WeakPolarHBondContact CG-O 3.34Å; D862-G866 PolarHBondContact O-N 3.1Å; T863-G866 PolarHBondContact O-N 3.03Å; L864-G866 VanDerWaalsContact C-N 3.34Å; G866-G869 PolarHBondContact O-N 3.07Å; G866-A870 WeakPolarHBondContact O-CB 3.31Å; G866-A870 PolarHBondContact O-N 2.91Å
867	A	98.6	Very high	94.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.8	-41.5	-179.4	0	0	0	0	0	112.1	V766 Y851 L854 L855 T863 G869 A870 L871	V766-A867 HydrophobicContact CG1-CB 4.13Å; V766-A867 VanDerWaalsContact CG1-N 3.34Å; Y851-A867 HydrophobicContact CD1-CB 4.02Å; L854-A867 HydrophobicContact CB-CB 4.29Å; L854-A867 HydrophobicContact CD1-CB 4.41Å; L855-A867 HydrophobicContact CD1-CB 4.25Å; L855-A867 HydrophobicContact CD2-CB 3.98Å; L855-A867 HydrophobicContact CG-CB 3.83Å; T863-A867 WeakPolarHBondContact O-CB 3.39Å; T863-A867 PolarHBondContact O-N 3.2Å; A867-G869 VanDerWaalsContact C-N 3.35Å; A867-A870 PolarHBondContact O-N 3.03Å; A867-L871 PolarHBondContact O-N 3.07Å; A867-L871 VanDerWaalsContact O-N 3.09Å
868	A	98.4	Very high	92.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-41.6	173.3	0	0	0	0	0	111.4	L855 L864 L871 Q872 A937 V938	L855-A868 HydrophobicContact CD2-CB 4.03Å; L864-A868 VanDerWaalsContact O-CB 3.31Å; L864-A868 WeakPolarHBondContact O-CB 3.23Å; L864-A868 PolarHBondContact O-N 2.94Å; A868-L871 PolarHBondContact O-N 3.05Å; A868-Q872 WeakPolarHBondContact O-CB 3.39Å; A868-Q872 PolarHBondContact O-N 2.9Å; A868-A937 HydrophobicContact CB-CB 4.01Å; A868-V938 HydrophobicContact CB-CG2 3.7Å
869	G	97.6	Very high	90.6	Very high	4 Å²	4	23.6 Å²	23.6	4%	0.041	15%	0.154	C	C	.	.	H	α-helix	trans	-65.5	-34.2	175.5	0	0	0	0	0	113.7	E865 G866 A867 Q872 N873	E865-G869 PolarHBondContact O-N 3.41Å; G866-G869 PolarHBondContact O-N 3.07Å; A867-G869 VanDerWaalsContact C-N 3.35Å; G869-Q872 WeakPolarHBondContact O-CB 3.2Å; G869-N873 WeakPolarHBondContact O-CB 3.23Å; G869-N873 VanDerWaalsContact O-CG 3.26Å; G869-N873 PolarHBondContact O-N 3.32Å; G869-N873 PolarHBondContact O-ND2 3.42Å
870	A	97.6	Very high	88.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-49.8	172.5	0	0	0	0	0	110.9	R770 Y851 G866 A867 Q872 N873 L874	R770-A870 HydrophobicContact CB-CB 4.08Å; Y851-A870 HydrophobicContact CD1-CB 4.21Å; Y851-A870 HydrophobicContact CD2-CB 4.23Å; Y851-A870 HydrophobicContact CE1-CB 3.71Å; Y851-A870 HydrophobicContact CE2-CB 3.71Å; Y851-A870 HydrophobicContact CG-CB 4.46Å; Y851-A870 VanDerWaalsContact CZ-CB 3.44Å; G866-A870 WeakPolarHBondContact O-CB 3.31Å; G866-A870 PolarHBondContact O-N 2.91Å; A867-A870 PolarHBondContact O-N 3.03Å; A870-Q872 VanDerWaalsContact C-N 3.31Å; A870-Q872 PolarHBondContact O-N 3.4Å; A870-N873 PolarHBondContact O-N 3Å; A870-N873 VanDerWaalsContact O-N 3.15Å; A870-L874 WeakPolarHBondContact O-CG 3.26Å; A870-L874 PolarHBondContact O-N 3.42Å
871	L	97	Very high	85.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-37.2	175.6	-68.7	-179.4	0	0	0	112.5	V848 Y851 L852 L855 A867 A868 A875 V914 M945	V848-L871 HydrophobicContact CG1-CD2 4.36Å; V848-L871 HydrophobicContact CG2-CD2 4.19Å; Y851-L871 HydrophobicContact CD2-CD2 3.9Å; Y851-L871 HydrophobicContact CD2-CG 4.28Å; Y851-L871 HydrophobicContact CG-CD2 4.41Å; Y851-L871 HydrophobicContact CG-CG 4.42Å; L852-L871 HydrophobicContact CD2-CD1 3.82Å; L852-L871 HydrophobicContact CG-CD1 4.41Å; L855-L871 HydrophobicContact CD1-CD1 3.62Å; A867-L871 PolarHBondContact O-N 3.07Å; A867-L871 VanDerWaalsContact O-N 3.09Å; A868-L871 PolarHBondContact O-N 3.05Å; L871-A875 WeakPolarHBondContact O-CB 3.4Å; L871-A875 PolarHBondContact O-N 2.59Å; L871-V914 HydrophobicContact CD2-CG2 4.15Å; L871-M945 HydrophobicContact CB-CE 4.01Å
872	Q	95.9	Very high	82.8	Confident	46 Å²	46	30.4 Å²	30.4	22%	0.215	18%	0.176	C	C	.	.	H	α-helix	trans	-57.3	-50.4	171.2	172.9	-170.4	-40.5	0	0	111.3	A868 G869 A870 A876 T940 A941 N944	A868-Q872 WeakPolarHBondContact O-CB 3.39Å; A868-Q872 PolarHBondContact O-N 2.9Å; G869-Q872 WeakPolarHBondContact O-CB 3.2Å; A870-Q872 VanDerWaalsContact C-N 3.31Å; A870-Q872 PolarHBondContact O-N 3.4Å; Q872-A876 PolarHBondContact O-N 2.67Å; Q872-T940 VanDerWaalsContact CD-CG2 3.43Å; Q872-T940 HydrophobicContact CG-CG2 3.95Å; Q872-A941 HydrophobicContact CB-CB 4.04Å; Q872-N944 PolarHBondContact O-ND2 3.12Å
873	N	94.7	Very high	80.1	Confident	27 Å²	27	31 Å²	31	14%	0.144	19%	0.188	C	C	.	.	H	α-helix	trans	-64.7	-44.4	-178.3	-75.8	-16	0	0	0	111.7	R770 G869 A870 A876	R770-N873 PolarHBondContact O-ND2 3.23Å; G869-N873 WeakPolarHBondContact O-CB 3.23Å; G869-N873 VanDerWaalsContact O-CG 3.26Å; G869-N873 PolarHBondContact O-N 3.32Å; G869-N873 PolarHBondContact O-ND2 3.42Å; A870-N873 PolarHBondContact O-N 3Å; A870-N873 VanDerWaalsContact O-N 3.15Å; N873-A876 VanDerWaalsContact O-CB 3.27Å; N873-A876 WeakPolarHBondContact O-CB 3.49Å; N873-A876 PolarHBondContact O-N 2.07Å
874	L	91.8	Very high	77.3	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-72.2	-30.7	-179.3	-63.4	177	0	0	0	113.4	L776 L842 I847 Y851 A870 A876 S907 I910	L776-L874 HydrophobicContact CD2-CD2 3.84Å; L842-L874 WeakPolarHBondContact O-CD1 3.02Å; L842-L874 WeakPolarHBondContact O-CD2 3.43Å; I847-L874 HydrophobicContact CG2-CD1 3.81Å; Y851-L874 HydrophobicContact CE2-CD1 4.15Å; A870-L874 WeakPolarHBondContact O-CG 3.26Å; A870-L874 PolarHBondContact O-N 3.42Å; L874-A876 PolarHBondContact O-N 3.46Å; L874-S907 WeakPolarHBondContact O-CA 3.25Å; L874-S907 VanDerWaalsContact O-CB 3.27Å; L874-S907 WeakPolarHBondContact O-CB 3.47Å; L874-I910 HydrophobicContact CB-CD1 4.47Å; L874-I910 HydrophobicContact CB-CG1 4.28Å; L874-I910 HydrophobicContact CB-CG2 4.04Å; L874-I910 HydrophobicContact CD1-CD1 4.49Å
875	A	90.9	Very high	74.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-5.8	173.4	0	0	0	0	0	113.9	L871 I910 R911 N944 M945	L871-A875 WeakPolarHBondContact O-CB 3.4Å; L871-A875 PolarHBondContact O-N 2.59Å; A875-I910 HydrophobicContact CB-CG2 4.46Å; A875-R911 HydrophobicContact CB-CG 3.79Å; A875-R911 PolarHBondContact O-NH1 2.67Å; A875-N944 HydrophobicContact CB-CB 3.86Å; A875-M945 HydrophobicContact CB-CE 3.57Å; A875-M945 HydrophobicContact CB-SD 3.9Å
876	A	84.3	Confident	72	Confident	35 Å²	35	43.6 Å²	43.6	29%	0.289	25%	0.253	S	S	.	.			trans	-75.4	152.1	-177.8	0	0	0	0	0	113.3	Q872 N873 L874 S907	Q872-A876 PolarHBondContact O-N 2.67Å; N873-A876 VanDerWaalsContact O-CB 3.27Å; N873-A876 WeakPolarHBondContact O-CB 3.49Å; N873-A876 PolarHBondContact O-N 2.07Å; L874-A876 PolarHBondContact O-N 3.46Å; A876-S907 VanDerWaalsContact O-CB 3.32Å; A876-S907 WeakPolarHBondContact O-CB 3.4Å
877	G	65.8	Low	69.3	Low	49 Å²	49	46.1 Å²	46.1	51%	0.505	27%	0.274	S	S	.	.	S	Bend	trans	66.8	-179.1	170.4	0	0	0	0	0	116.2	S907 R911	G877-S907 PolarHBondContact O-OG 2.95Å; G877-R911 PolarHBondContact O-NH1 2.91Å
878	S	58.3	Low	66.5	Low	57 Å²	57	49.5 Å²	49.5	40%	0.399	31%	0.308	S	S	.	.			trans	-122.8	113.7	169.7	172.3	0	0	0	0	106.7	K880 Q905	S878-K880 PolarHBondContact O-N 3.1Å; S878-K880 VanDerWaalsContact OG-CE 3.3Å; S878-K880 WeakPolarHBondContact OG-CE 3.09Å; S878-Q905 PolarHBondContact OG-OE1 2.63Å
879	W	55.5	Low	63.7	Low	18 Å²	18	55.9 Å²	55.9	7%	0.068	34%	0.339	C	S	.	.			trans	-75.3	88	-174.2	-67.9	48.6	0	0	0	109.4	L776 A777 W843 W906	L776-W879 HydrophobicContact CD2-CH2 4.02Å; L776-W879 HydrophobicContact CD2-CZ2 4.31Å; L776-W879 HydrophobicContact CG-CH2 3.98Å; L776-W879 HydrophobicContact CG-CZ2 4.43Å; A777-W879 HydrophobicContact CB-CD2 3.57Å; A777-W879 VanDerWaalsContact CB-CE2 3.46Å; A777-W879 HydrophobicContact CB-CE3 4.12Å; A777-W879 HydrophobicContact CB-CG 3.83Å; A777-W879 HydrophobicContact CB-CH2 4.41Å; A777-W879 HydrophobicContact CB-CZ2 3.91Å; W843-W879 HydrophobicContact CB-CH2 3.47Å; W843-W879 VanDerWaalsContact CB-CH2 3.47Å; W843-W879 HydrophobicContact CB-CZ2 3.99Å; W843-W879 HydrophobicContact CB-CZ3 4.19Å; W843-W879 HydrophobicContact CD2-CH2 4.04Å; W843-W879 HydrophobicContact CD2-CZ3 4.19Å; W843-W879 AromaticContact CE3-CH2 3.89Å; W843-W879 HydrophobicContact CE3-CH2 3.89Å; W843-W879 HydrophobicContact CE3-CZ3 4.18Å; W843-W879 AromaticContact CG-CH2 3.91Å; W843-W879 HydrophobicContact CG-CH2 3.91Å; W843-W879 HydrophobicContact CG-CZ3 4.21Å; W879-W906 HydrophobicContact CD2-CB 4.06Å; W879-W906 HydrophobicContact CE3-CB 4.2Å; W879-W906 AromaticContact CE3-CD1 3.63Å; W879-W906 HydrophobicContact CE3-CG 4.3Å; W879-W906 HydrophobicContact CH2-CB 4.42Å; W879-W906 HydrophobicContact CZ2-CB 4.26Å; W879-W906 HydrophobicContact CZ3-CB 4.38Å; W879-W906 AromaticContact CZ3-CD1 3.8Å; W879-W906 HydrophobicContact CZ3-CG 4.37Å
880	K	43	Very low	61	Low	156 Å²	156	58.1 Å²	58.1	68%	0.678	36%	0.358	S	S	*	.			trans	-104	-20.2	-177.4	-66.2	-171.5	176.8	-173.2	0	115	S878 W882 A883	S878-K880 PolarHBondContact O-N 3.1Å; S878-K880 VanDerWaalsContact OG-CE 3.3Å; S878-K880 WeakPolarHBondContact OG-CE 3.09Å; K880-W882 VanDerWaalsContact C-N 3.35Å; K880-W882 PolarHBondContact O-N 3.47Å; K880-A883 WeakPolarHBondContact O-CB 3.31Å; K880-A883 PolarHBondContact O-N 3.18Å
881	G	39.3	Very low	58.3	Low	45 Å²	45	66.7 Å²	66.7	46%	0.464	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-66.6	-28.4	-171.3	0	0	0	0	0	115.3	A883	G881-A883 PolarHBondContact O-N 2.83Å
882	W	40	Very low	55.7	Low	108 Å²	108	70.4 Å²	70.4	41%	0.409	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-65.9	5.5	178.7	-75.8	76.3	0	0	0	114.8	T780 K880 V886	T780-W882 HydrophobicContact CG2-CZ2 4Å; K880-W882 VanDerWaalsContact C-N 3.35Å; K880-W882 PolarHBondContact O-N 3.47Å; W882-V886 WeakPolarHBondContact O-CG2 3.44Å
883	A	41.6	Very low	53	Low	56 Å²	56	73 Å²	73	46%	0.463	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-96	-21.3	-175.2	0	0	0	0	0	114.9	K880 G881 L903	K880-A883 WeakPolarHBondContact O-CB 3.31Å; K880-A883 PolarHBondContact O-N 3.18Å; G881-A883 PolarHBondContact O-N 2.83Å; A883-L903 HydrophobicContact CB-CD1 3.72Å
884	E	38.1	Very low	50.4	Low	152 Å²	152	81.4 Å²	81.4	71%	0.71	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-40.9	-172.6	-60.7	-170.9	137.3	0	0	111.5	V886	E884-V886 PolarHBondContact O-N 3.4Å
885	D	39.8	Very low	47.9	Very low	96 Å²	96	86.8 Å²	86.8	51%	0.513	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.9	179.1	-69	6.8	0	0	0	114	H785 A887	H785-D885 IonicContact CE1-OD1 3.89Å; H785-D885 IonicContact CE1-OD2 3.9Å; H785-D885 PolarHBondContact CE1-OD2 3.33Å; H785-D885 IonicContact ND1-OD2 3Å; H785-D885 PolarHBondContact ND1-OD2 3.49Å; H785-D885 VanDerWaalsContact ND1-OD2 3.12Å; D885-A887 PolarHBondContact O-N 3.44Å; D885-A887 VanDerWaalsContact O-N 3.12Å
886	V	45.5	Very low	45.4	Very low	61 Å²	61	91.9 Å²	91.9	37%	0.37	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	27.5	-179.1	-165.6	0	0	0	0	111.9	W882 E884 G888 M889 A890	W882-V886 WeakPolarHBondContact O-CG2 3.44Å; E884-V886 PolarHBondContact O-N 3.4Å; V886-G888 PolarHBondContact O-N 3.47Å; V886-M889 HydrophobicContact CG1-CB 3.82Å; V886-M889 PolarHBondContact O-N 2.8Å; V886-M889 VanDerWaalsContact O-N 3.16Å; V886-A890 PolarHBondContact O-N 3.23Å
887	A	41.8	Very low	43.1	Very low	56 Å²	56	95.1 Å²	95.1	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-58.7	-28.7	179.1	0	0	0	0	0	113.4	D885 M889 A890	D885-A887 PolarHBondContact O-N 3.44Å; D885-A887 VanDerWaalsContact O-N 3.12Å; A887-M889 PolarHBondContact O-N 2.87Å; A887-A890 WeakPolarHBondContact O-CB 3.42Å; A887-A890 PolarHBondContact O-N 3.23Å
888	G	39.2	Very low	41.5	Very low	70 Å²	70	102.7 Å²	102.7	72%	0.722	57%	0.571	S	S	*	*	H	α-helix	trans	-60.6	-40.9	175	0	0	0	0	0	113.5	V886	V886-G888 PolarHBondContact O-N 3.47Å
889	M	41	Very low	40.6	Very low	134 Å²	134	103.7 Å²	103.7	66%	0.66	59%	0.59	S	S	*	*	H	α-helix	trans	-80.2	-22.9	177.4	-155.4	72.6	78.8	0	0	112.3	V886 A887 Y891 A892	V886-M889 HydrophobicContact CG1-CB 3.82Å; V886-M889 PolarHBondContact O-N 2.8Å; V886-M889 VanDerWaalsContact O-N 3.16Å; A887-M889 PolarHBondContact O-N 2.87Å; M889-Y891 PolarHBondContact O-N 3.3Å; M889-A892 PolarHBondContact O-N 2.98Å; M889-A892 VanDerWaalsContact O-N 3.12Å
890	A	39.1	Very low	39.6	Very low	52 Å²	52	105.5 Å²	105.5	43%	0.43	61%	0.61	S	S	.	*	H	α-helix	trans	-62.7	-25.2	-178.3	0	0	0	0	0	113.5	V886 A887 A892 L893 R894	V886-A890 PolarHBondContact O-N 3.23Å; A887-A890 WeakPolarHBondContact O-CB 3.42Å; A887-A890 PolarHBondContact O-N 3.23Å; A890-A892 VanDerWaalsContact C-N 3.26Å; A890-A892 PolarHBondContact O-N 3.24Å; A890-L893 PolarHBondContact O-N 2.89Å; A890-L893 VanDerWaalsContact O-N 3.07Å; A890-R894 PolarHBondContact O-N 3.46Å
891	Y	42.7	Very low	39.4	Very low	180 Å²	180	103.4 Å²	103.4	71%	0.706	61%	0.612	S	S	*	*	H	α-helix	trans	-60.5	-32	174.2	-91.2	-84.4	0	0	0	113.4	M889 L893	M889-Y891 PolarHBondContact O-N 3.3Å; Y891-L893 VanDerWaalsContact C-N 3.34Å
892	A	41.1	Very low	39.5	Very low	77 Å²	77	105.8 Å²	105.8	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-74.2	-24	175.2	0	0	0	0	0	113.2	M889 A890	M889-A892 PolarHBondContact O-N 2.98Å; M889-A892 VanDerWaalsContact O-N 3.12Å; A890-A892 VanDerWaalsContact C-N 3.26Å; A890-A892 PolarHBondContact O-N 3.24Å
893	L	40.3	Very low	39.6	Very low	100 Å²	100	104.8 Å²	104.8	52%	0.524	62%	0.623	S	S	.	*	H	α-helix	trans	-91	-9	-175	-63.9	175.2	0	0	0	114	A890 Y891 S895 L896	A890-L893 PolarHBondContact O-N 2.89Å; A890-L893 VanDerWaalsContact O-N 3.07Å; Y891-L893 VanDerWaalsContact C-N 3.34Å; L893-S895 PolarHBondContact O-N 2.93Å; L893-L896 HydrophobicContact CD2-CD1 4.01Å; L893-L896 PolarHBondContact O-N 3.33Å; L893-L896 VanDerWaalsContact O-N 3.16Å
894	R	38.7	Very low	40.1	Very low	205 Å²	205	104 Å²	104	77%	0.774	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-8.6	178	-175.1	169.1	167.7	-177.4	-5.8	114.4	A890	A890-R894 PolarHBondContact O-N 3.46Å
895	S	40.6	Very low	41.6	Very low	115 Å²	115	99 Å²	99	80%	0.804	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	0.1	177.4	-58	0	0	0	0	114.7	L893	L893-S895 PolarHBondContact O-N 2.93Å
896	L	38.7	Very low	43.5	Very low	107 Å²	107	96.4 Å²	96.4	56%	0.56	57%	0.572	S	S	*	*	S	Bend	trans	-89	143.1	176.5	-76	167.5	0	0	0	112	L893 A900	L893-L896 HydrophobicContact CD2-CD1 4.01Å; L893-L896 PolarHBondContact O-N 3.33Å; L893-L896 VanDerWaalsContact O-N 3.16Å; L896-A900 HydrophobicContact CB-CB 4.18Å; L896-A900 HydrophobicContact CD1-CB 4.34Å
897	P	34.6	Very low	45.4	Very low	103 Å²	103	93.5 Å²	93.5	67%	0.669	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-71.9	160.2	-179.7	30.8	-36	0	0	0	112.7	G899 A900	P897-G899 PolarHBondContact O-N 3.17Å; P897-G899 VanDerWaalsContact O-N 3.14Å; P897-A900 PolarHBondContact O-N 3.05Å
898	E	31.9	Very low	47.5	Very low	208 Å²	208	92.2 Å²	92.2	97%	0.972	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	117.8	175.6	-63.6	-176.9	120.9	0	0	111.2
899	G	40.5	Very low	49.7	Very low	78 Å²	78	90.3 Å²	90.3	80%	0.804	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.6	-0.4	-173.7	0	0	0	0	0	115.4	P897	P897-G899 PolarHBondContact O-N 3.17Å; P897-G899 VanDerWaalsContact O-N 3.14Å
900	A	34.9	Very low	52.1	Low	57 Å²	57	84 Å²	84	47%	0.471	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-55.4	140.5	169.7	0	0	0	0	0	111.9	L896 P897	L896-A900 HydrophobicContact CB-CB 4.18Å; L896-A900 HydrophobicContact CD1-CB 4.34Å; P897-A900 PolarHBondContact O-N 3.05Å
901	P	38.9	Very low	54.7	Low	111 Å²	111	82.2 Å²	82.2	72%	0.721	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-69.3	144.7	-175.2	28.3	-34.8	0	0	0	112.1
902	C	40	Very low	57	Low	95 Å²	95	73.8 Å²	73.8	64%	0.642	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-63.6	149.4	173	60.5	0	0	0	0	111.9
903	L	43.3	Very low	59.5	Low	88 Å²	88	70.7 Å²	70.7	46%	0.461	41%	0.405	S	S	.	.	S	Bend	trans	-46.9	150.5	177.6	-74.6	164.7	0	0	0	113.4	A883 Q905	A883-L903 HydrophobicContact CB-CD1 3.72Å; L903-Q905 PolarHBondContact O-N 3.01Å
904	P	52.2	Low	62.1	Low	38 Å²	38	65.9 Å²	65.9	25%	0.247	38%	0.38	C	S	.	.			trans	-63.9	102.3	-165.9	24.5	-34.8	0	0	0	112.7	P830 W906 Y909	P830-P904 HydrophobicContact CG-CB 3.95Å; P830-P904 HydrophobicContact CG-CG 4.16Å; P904-W906 VanDerWaalsContact C-N 3.3Å; P904-W906 HydrophobicContact CB-CZ2 4.36Å; P904-W906 HydrophobicContact CG-CZ2 4.31Å; P904-W906 VanDerWaalsContact O-CD1 3.31Å; P904-W906 PolarHBondContact O-N 2.69Å; P904-Y909 HydrophobicContact CB-CD2 4.49Å; P904-Y909 HydrophobicContact CB-CE2 3.86Å
905	Q	69.8	Low	64.8	Low	48 Å²	48	58.2 Å²	58.2	22%	0.224	35%	0.351	C	S	.	.			trans	-73.1	86.4	168	-68.9	179.8	64.7	0	0	108.7	S878 L903 S907 V908 Y909	S878-Q905 PolarHBondContact OG-OE1 2.63Å; L903-Q905 PolarHBondContact O-N 3.01Å; Q905-S907 PolarHBondContact O-N 3.01Å; Q905-S907 VanDerWaalsContact O-N 3.12Å; Q905-V908 HydrophobicContact CB-CB 4.16Å; Q905-V908 HydrophobicContact CB-CG2 3.58Å; Q905-V908 WeakPolarHBondContact O-CA 3.47Å; Q905-V908 VanDerWaalsContact O-CB 3.27Å; Q905-V908 WeakPolarHBondContact O-CB 3.39Å; Q905-V908 PolarHBondContact O-N 3.03Å; Q905-Y909 PolarHBondContact O-N 2.98Å
906	W	78.8	Confident	67.2	Low	42 Å²	42	58.8 Å²	58.8	16%	0.159	34%	0.339	C	S	.	.	H	α-helix	trans	-52.9	-37.1	-173.3	-66.9	102.1	0	0	0	113.4	L829 W843 W879 P904 V908 Y909 I910	L829-W906 HydrophobicContact CD1-CZ3 3.96Å; W843-W906 HydrophobicContact CB-CB 4.12Å; W843-W906 HydrophobicContact CB-CG 4.22Å; W843-W906 AromaticContact CD1-CD2 3.55Å; W843-W906 AromaticContact CD1-CE2 3.62Å; W843-W906 AromaticContact CD1-CE3 3.91Å; W843-W906 AromaticContact CD1-CG 3.88Å; W843-W906 AromaticContact CD1-NE1 3.91Å; W843-W906 HydrophobicContact CG-CD2 4.33Å; W843-W906 HydrophobicContact CG-CG 4.23Å; W843-W906 AromaticContact NE1-CE2 3.92Å; W879-W906 HydrophobicContact CD2-CB 4.06Å; W879-W906 HydrophobicContact CE3-CB 4.2Å; W879-W906 AromaticContact CE3-CD1 3.63Å; W879-W906 HydrophobicContact CE3-CG 4.3Å; W879-W906 HydrophobicContact CH2-CB 4.42Å; W879-W906 HydrophobicContact CZ2-CB 4.26Å; W879-W906 HydrophobicContact CZ3-CB 4.38Å; W879-W906 AromaticContact CZ3-CD1 3.8Å; W879-W906 HydrophobicContact CZ3-CG 4.37Å; P904-W906 VanDerWaalsContact C-N 3.3Å; P904-W906 HydrophobicContact CB-CZ2 4.36Å; P904-W906 HydrophobicContact CG-CZ2 4.31Å; P904-W906 VanDerWaalsContact O-CD1 3.31Å; P904-W906 PolarHBondContact O-N 2.69Å; W906-V908 VanDerWaalsContact C-N 3.26Å; W906-V908 PolarHBondContact O-N 3.26Å; W906-Y909 PolarHBondContact O-N 2.68Å; W906-I910 WeakPolarHBondContact O-CG1 3.44Å; W906-I910 PolarHBondContact O-N 3.09Å
907	S	85	Confident	69.8	Low	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-26.8	173.5	67.8	0	0	0	0	114.5	L874 A876 G877 Q905 R911	L874-S907 WeakPolarHBondContact O-CA 3.25Å; L874-S907 VanDerWaalsContact O-CB 3.27Å; L874-S907 WeakPolarHBondContact O-CB 3.47Å; A876-S907 VanDerWaalsContact O-CB 3.32Å; A876-S907 WeakPolarHBondContact O-CB 3.4Å; G877-S907 PolarHBondContact O-OG 2.95Å; Q905-S907 PolarHBondContact O-N 3.01Å; Q905-S907 VanDerWaalsContact O-N 3.12Å; S907-R911 WeakPolarHBondContact O-CB 3.34Å; S907-R911 VanDerWaalsContact O-CG 3.24Å; S907-R911 WeakPolarHBondContact O-CG 3.45Å; S907-R911 PolarHBondContact O-N 3.25Å; S907-R911 PolarHBondContact O-NE 3.35Å; S907-R911 PolarHBondContact O-NH1 3.23Å; S907-R911 PolarHBondContact OG-NH1 2.86Å
908	V	85.7	Confident	72.7	Confident	28 Å²	28	60.9 Å²	60.9	17%	0.17	33%	0.334	C	S	.	.	H	α-helix	trans	-69.9	-45.8	170.6	-178.3	0	0	0	0	110.3	V826 Q905 W906 I910 R911 A912	V826-V908 HydrophobicContact CG1-CG1 3.93Å; V826-V908 HydrophobicContact CG2-CG1 4.03Å; Q905-V908 HydrophobicContact CB-CB 4.16Å; Q905-V908 HydrophobicContact CB-CG2 3.58Å; Q905-V908 WeakPolarHBondContact O-CA 3.47Å; Q905-V908 VanDerWaalsContact O-CB 3.27Å; Q905-V908 WeakPolarHBondContact O-CB 3.39Å; Q905-V908 PolarHBondContact O-N 3.03Å; W906-V908 VanDerWaalsContact C-N 3.26Å; W906-V908 PolarHBondContact O-N 3.26Å; V908-I910 PolarHBondContact O-N 2.91Å; V908-R911 VanDerWaalsContact CG2-NH2 3.29Å; V908-R911 PolarHBondContact O-N 2.88Å; V908-A912 WeakPolarHBondContact O-CB 3.34Å; V908-A912 PolarHBondContact O-N 2.73Å
909	Y	86.4	Confident	75.8	Confident	30 Å²	30	51 Å²	51	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-41.8	176.2	-72.4	-84.4	0	0	0	111.7	V826 P828 L829 P904 Q905 W906 A912 A913	V826-Y909 HydrophobicContact CB-CD1 4.42Å; V826-Y909 HydrophobicContact CB-CE1 4.16Å; V826-Y909 HydrophobicContact CG1-CD1 3.59Å; V826-Y909 HydrophobicContact CG1-CD2 4Å; V826-Y909 HydrophobicContact CG1-CE1 3.36Å; V826-Y909 HydrophobicContact CG1-CE2 3.81Å; V826-Y909 HydrophobicContact CG1-CG 3.9Å; V826-Y909 VanDerWaalsContact CG1-CZ 3.48Å; P828-Y909 PolarHBondContact O-OH 3.3Å; L829-Y909 HydrophobicContact CB-CE1 4.48Å; L829-Y909 HydrophobicContact CD1-CD1 3.57Å; L829-Y909 HydrophobicContact CD1-CE1 3.78Å; L829-Y909 HydrophobicContact CD1-CG 4.02Å; P904-Y909 HydrophobicContact CB-CD2 4.49Å; P904-Y909 HydrophobicContact CB-CE2 3.86Å; Q905-Y909 PolarHBondContact O-N 2.98Å; W906-Y909 PolarHBondContact O-N 2.68Å; Y909-A912 PolarHBondContact O-N 3.32Å; Y909-A913 VanDerWaalsContact O-CB 3.3Å; Y909-A913 WeakPolarHBondContact O-CB 3.3Å; Y909-A913 PolarHBondContact O-N 3.43Å
910	I	91.1	Very high	78.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-59.8	-50.5	173.8	-66.2	-71.5	0	0	0	111.1	I847 V848 L874 A875 W906 V908 A912 A913 V914	I847-I910 HydrophobicContact CG2-CD1 4.24Å; V848-I910 HydrophobicContact CG2-CD1 3.66Å; V848-I910 HydrophobicContact CG2-CG2 4.14Å; L874-I910 HydrophobicContact CB-CD1 4.47Å; L874-I910 HydrophobicContact CB-CG1 4.28Å; L874-I910 HydrophobicContact CB-CG2 4.04Å; L874-I910 HydrophobicContact CD1-CD1 4.49Å; A875-I910 HydrophobicContact CB-CG2 4.46Å; W906-I910 WeakPolarHBondContact O-CG1 3.44Å; W906-I910 PolarHBondContact O-N 3.09Å; V908-I910 PolarHBondContact O-N 2.91Å; I910-A912 PolarHBondContact O-N 2.92Å; I910-A913 PolarHBondContact O-N 2.67Å; I910-V914 WeakPolarHBondContact O-CG2 3.44Å; I910-V914 PolarHBondContact O-N 3.21Å
911	R	93	Very high	81.5	Confident	16 Å²	16	49.1 Å²	49.1	6%	0.06	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-30.8	177.7	-72	-175.4	-55.8	-98.9	-2.1	113	A875 G877 S907 V908 N944 M945 D948 N951	A875-R911 HydrophobicContact CB-CG 3.79Å; A875-R911 PolarHBondContact O-NH1 2.67Å; G877-R911 PolarHBondContact O-NH1 2.91Å; S907-R911 WeakPolarHBondContact O-CB 3.34Å; S907-R911 VanDerWaalsContact O-CG 3.24Å; S907-R911 WeakPolarHBondContact O-CG 3.45Å; S907-R911 PolarHBondContact O-N 3.25Å; S907-R911 PolarHBondContact O-NE 3.35Å; S907-R911 PolarHBondContact O-NH1 3.23Å; S907-R911 PolarHBondContact OG-NH1 2.86Å; V908-R911 VanDerWaalsContact CG2-NH2 3.29Å; V908-R911 PolarHBondContact O-N 2.88Å; R911-N944 WeakPolarHBondContact CD-O 3.5Å; R911-M945 HydrophobicContact CB-SD 4.4Å; R911-M945 HydrophobicContact CG-SD 3.9Å; R911-D948 HydrophobicContact CB-CB 4.32Å; R911-N951 PolarHBondContact O-ND2 3.41Å
912	A	91.7	Very high	84.3	Confident	2 Å²	2	45.4 Å²	45.4	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-76.9	-38.5	174.2	0	0	0	0	0	112.6	V826 V908 Y909 I910 R915 K916	V826-A912 HydrophobicContact CG2-CB 3.78Å; V908-A912 WeakPolarHBondContact O-CB 3.34Å; V908-A912 PolarHBondContact O-N 2.73Å; Y909-A912 PolarHBondContact O-N 3.32Å; I910-A912 PolarHBondContact O-N 2.92Å; A912-R915 PolarHBondContact O-N 3Å; A912-K916 WeakPolarHBondContact O-CG 3.42Å; A912-K916 PolarHBondContact O-N 3.32Å
913	A	92.9	Very high	87.1	Confident	12 Å²	12	40.9 Å²	40.9	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-45.1	176.5	0	0	0	0	0	111.8	P845 V848 Y909 I910 R915 K916 E917	P845-A913 HydrophobicContact CB-CB 4.04Å; V848-A913 HydrophobicContact CB-CB 4.33Å; V848-A913 HydrophobicContact CG1-CB 4.41Å; V848-A913 HydrophobicContact CG2-CB 4.08Å; Y909-A913 VanDerWaalsContact O-CB 3.3Å; Y909-A913 WeakPolarHBondContact O-CB 3.3Å; Y909-A913 PolarHBondContact O-N 3.43Å; I910-A913 PolarHBondContact O-N 2.67Å; A913-R915 PolarHBondContact O-N 3.35Å; A913-R915 VanDerWaalsContact O-N 3.12Å; A913-K916 PolarHBondContact O-N 2.81Å; A913-E917 WeakPolarHBondContact O-CG 3.19Å; A913-E917 PolarHBondContact O-N 2.99Å
914	V	95.9	Very high	89.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56	-31.9	174.9	170.4	0	0	0	0	112.1	V848 L871 I910 G919 L920 L923 M945	V848-V914 HydrophobicContact CG1-CB 4.33Å; V848-V914 HydrophobicContact CG1-CG2 3.5Å; V848-V914 HydrophobicContact CG2-CG2 4.21Å; L871-V914 HydrophobicContact CD2-CG2 4.15Å; I910-V914 WeakPolarHBondContact O-CG2 3.44Å; I910-V914 PolarHBondContact O-N 3.21Å; V914-G919 WeakPolarHBondContact O-CA 2.98Å; V914-G919 PolarHBondContact O-N 3.33Å; V914-L920 HydrophobicContact CG1-CD2 4.25Å; V914-L923 HydrophobicContact CG1-CD1 4.29Å; V914-M945 HydrophobicContact CB-CE 4.33Å; V914-M945 HydrophobicContact CB-SD 3.96Å; V914-M945 HydrophobicContact CG1-CE 4.2Å; V914-M945 HydrophobicContact CG1-CG 4.37Å; V914-M945 HydrophobicContact CG1-SD 3.91Å; V914-M945 HydrophobicContact CG2-CE 3.77Å; V914-M945 HydrophobicContact CG2-SD 4.01Å
915	R	94.4	Very high	91.8	Very high	43 Å²	43	41.3 Å²	41.3	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-78.1	-40.2	173.3	-179.1	-176.8	54.6	-115.6	-6.8	112.9	A912 A913 K918 L920 D948 N951 L954	A912-R915 PolarHBondContact O-N 3Å; A913-R915 PolarHBondContact O-N 3.35Å; A913-R915 VanDerWaalsContact O-N 3.12Å; R915-K918 PolarHBondContact O-N 3.16Å; R915-L920 HydrophobicContact CB-CD1 4.35Å; R915-L920 HydrophobicContact CG-CD1 4.33Å; R915-D948 IonicContact CZ-OD2 3.65Å; R915-D948 IonicContact NH1-OD1 2.64Å; R915-D948 PolarHBondContact NH1-OD1 2.8Å; R915-D948 IonicContact NH1-OD2 3.92Å; R915-D948 PolarHBondContact NH1-OD2 2.95Å; R915-D948 IonicContact NH2-OD2 3.63Å; R915-D948 PolarHBondContact NH2-OD2 2.72Å; R915-N951 WeakPolarHBondContact CB-OD1 3.25Å; R915-N951 WeakPolarHBondContact CD-OD1 3.34Å; R915-N951 PolarHBondContact NH1-OD1 3.05Å; R915-L954 HydrophobicContact CG-CD1 3.94Å
916	K	91.9	Very high	93.1	Very high	127 Å²	127	39.7 Å²	39.7	55%	0.552	19%	0.19	S	C	*	.	H	α-helix	trans	-64	-45.7	178.2	-74.9	173.5	179.1	171.7	0	111.6	D824 A912 A913 K918	D824-K916 IonicContact OD1-NZ 2.75Å; D824-K916 WeakPolarHBondContact OD2-CE 3.04Å; D824-K916 IonicContact OD2-NZ 3.36Å; D824-K916 PolarHBondContact OD2-NZ 2.85Å; A912-K916 WeakPolarHBondContact O-CG 3.42Å; A912-K916 PolarHBondContact O-N 3.32Å; A913-K916 PolarHBondContact O-N 2.81Å; K916-K918 PolarHBondContact O-N 2.99Å; K916-K918 VanDerWaalsContact O-N 3.1Å
917	E	93.9	Very high	93.9	Very high	93 Å²	93	37.8 Å²	37.8	44%	0.435	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	15.9	176.6	-58.8	-56.8	124.4	0	0	113.5	L852 A913 G919	L852-E917 HydrophobicContact CD1-CB 3.54Å; A913-E917 WeakPolarHBondContact O-CG 3.19Å; A913-E917 PolarHBondContact O-N 2.99Å; E917-G919 PolarHBondContact O-N 3.28Å; E917-G919 VanDerWaalsContact O-N 3.08Å
918	K	95.1	Very high	94.4	Very high	161 Å²	161	43.7 Å²	43.7	70%	0.7	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	23.5	179.6	-53.5	176.4	-176.4	172	0	115.4	R915 K916 L920 P921	R915-K918 PolarHBondContact O-N 3.16Å; K916-K918 PolarHBondContact O-N 2.99Å; K916-K918 VanDerWaalsContact O-N 3.1Å; K918-L920 VanDerWaalsContact C-N 3.32Å; K918-L920 PolarHBondContact O-N 3.48Å; K918-P921 WeakPolarHBondContact O-CD 3.5Å
919	G	96.8	Very high	94.7	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70	-18.3	-177.4	0	0	0	0	0	116	V914 E917 I922 L923	V914-G919 WeakPolarHBondContact O-CA 2.98Å; V914-G919 PolarHBondContact O-N 3.33Å; E917-G919 PolarHBondContact O-N 3.28Å; E917-G919 VanDerWaalsContact O-N 3.08Å; G919-I922 PolarHBondContact O-N 2.96Å; G919-L923 WeakPolarHBondContact O-CG 3.42Å; G919-L923 PolarHBondContact O-N 3.39Å
920	L	97.3	Very high	95	Very high	12 Å²	12	49.7 Å²	49.7	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-49.7	176.2	-66.4	179.9	0	0	0	112.4	V914 R915 K918 I922 L923 V924 L942 M945 N951 L954 I955	V914-L920 HydrophobicContact CG1-CD2 4.25Å; R915-L920 HydrophobicContact CB-CD1 4.35Å; R915-L920 HydrophobicContact CG-CD1 4.33Å; K918-L920 VanDerWaalsContact C-N 3.32Å; K918-L920 PolarHBondContact O-N 3.48Å; L920-I922 PolarHBondContact O-N 3.44Å; L920-L923 PolarHBondContact O-N 2.96Å; L920-V924 WeakPolarHBondContact O-CG2 3.42Å; L920-V924 PolarHBondContact O-N 3.04Å; L920-L942 HydrophobicContact CD2-CD2 4.26Å; L920-M945 HydrophobicContact CD2-CB 4.16Å; L920-M945 HydrophobicContact CD2-CG 4.31Å; L920-N951 HydrophobicContact CD1-CB 4.38Å; L920-L954 HydrophobicContact CD1-CB 4.07Å; L920-L954 HydrophobicContact CD1-CD1 4.04Å; L920-I955 HydrophobicContact CD1-CG1 4.49Å; L920-I955 HydrophobicContact CD2-CD1 4.08Å; L920-I955 HydrophobicContact CD2-CG1 4.12Å
921	P	97.4	Very high	95.1	Very high	84 Å²	84	51.8 Å²	51.8	55%	0.545	25%	0.248	S	C	.	.	H	α-helix	trans	-45.8	-50.7	165.7	-33.4	32.2	0	0	0	115.1	K918 L923 V924 E925	K918-P921 WeakPolarHBondContact O-CD 3.5Å; P921-L923 PolarHBondContact O-N 2.78Å; P921-V924 CarbonylContact O-C 3.57Å; P921-V924 PolarHBondContact O-N 3Å; P921-E925 PolarHBondContact O-N 3.18Å
922	I	97.9	Very high	95.2	Very high	33 Å²	33	53 Å²	53	17%	0.169	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-47.4	-177.8	-56.4	173.3	0	0	0	110.5	L852 L855 G919 L920 V924 E925 L926	L852-I922 HydrophobicContact CB-CD1 4.28Å; L855-I922 HydrophobicContact CB-CG2 3.79Å; L855-I922 VanDerWaalsContact O-CG2 3.3Å; L855-I922 WeakPolarHBondContact O-CG2 3Å; G919-I922 PolarHBondContact O-N 2.96Å; L920-I922 PolarHBondContact O-N 3.44Å; I922-V924 VanDerWaalsContact C-N 3.31Å; I922-V924 PolarHBondContact O-N 3.38Å; I922-E925 PolarHBondContact O-N 3.46Å; I922-L926 WeakPolarHBondContact O-CG 3.48Å; I922-L926 PolarHBondContact O-N 3.12Å
923	L	98.1	Very high	95.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-34.2	175.2	-68.2	171.8	0	0	0	112.6	L855 V914 G919 L920 P921 L927 V938 L942 M945	L855-L923 HydrophobicContact CD1-CD2 4.16Å; V914-L923 HydrophobicContact CG1-CD1 4.29Å; G919-L923 WeakPolarHBondContact O-CG 3.42Å; G919-L923 PolarHBondContact O-N 3.39Å; L920-L923 PolarHBondContact O-N 2.96Å; P921-L923 PolarHBondContact O-N 2.78Å; L923-L927 PolarHBondContact O-N 3.37Å; L923-V938 HydrophobicContact CB-CG1 4.23Å; L923-V938 HydrophobicContact CD2-CG1 4.22Å; L923-V938 HydrophobicContact CD2-CG2 4.3Å; L923-V938 WeakPolarHBondContact O-CG1 3.41Å; L923-L942 HydrophobicContact CB-CD1 4.26Å; L923-L942 HydrophobicContact CB-CD2 3.86Å; L923-L942 HydrophobicContact CB-CG 4.03Å; L923-L942 HydrophobicContact CD1-CD2 4.16Å; L923-L942 HydrophobicContact CD1-CG 4.45Å; L923-M945 HydrophobicContact CD1-CG 4.41Å
924	V	97.5	Very high	95.6	Very high	12 Å²	12	57.5 Å²	57.5	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-73.9	-30.2	176.4	172.9	0	0	0	0	112.2	L920 P921 I922 L927 L942 A959	L920-V924 WeakPolarHBondContact O-CG2 3.42Å; L920-V924 PolarHBondContact O-N 3.04Å; P921-V924 CarbonylContact O-C 3.57Å; P921-V924 PolarHBondContact O-N 3Å; I922-V924 VanDerWaalsContact C-N 3.31Å; I922-V924 PolarHBondContact O-N 3.38Å; V924-L927 WeakPolarHBondContact O-CB 3.3Å; V924-L927 PolarHBondContact O-N 3.36Å; V924-L942 HydrophobicContact CG2-CD1 4.5Å; V924-L942 HydrophobicContact CG2-CD2 4.49Å; V924-A959 HydrophobicContact CG1-CB 4.27Å; V924-A959 HydrophobicContact CG2-CB 3.43Å; V924-A959 VanDerWaalsContact CG2-CB 3.43Å
925	E	96.8	Very high	95.7	Very high	124 Å²	124	57.5 Å²	57.5	58%	0.579	27%	0.27	S	S	*	.	H	α-helix	trans	-71.3	-41.2	173.7	-176.3	147.2	-142	0	0	111.8	P921 I922 L927 R928	P921-E925 PolarHBondContact O-N 3.18Å; I922-E925 PolarHBondContact O-N 3.46Å; E925-L927 PolarHBondContact O-N 3.42Å; E925-R928 VanDerWaalsContact O-CB 3.23Å; E925-R928 WeakPolarHBondContact O-CB 3.06Å; E925-R928 PolarHBondContact O-N 3.21Å
926	L	97.1	Very high	95.8	Very high	14 Å²	14	56.9 Å²	56.9	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-18.3	173.8	-69.3	175.2	0	0	0	113.9	L855 L864 I922 R928 I929 V938	L855-L926 HydrophobicContact CB-CD1 3.88Å; L855-L926 HydrophobicContact CD2-CD1 3.4Å; L855-L926 HydrophobicContact CG-CD1 4.19Å; L864-L926 HydrophobicContact CD1-CD2 4.27Å; L864-L926 HydrophobicContact CD2-CD2 4.35Å; I922-L926 WeakPolarHBondContact O-CG 3.48Å; I922-L926 PolarHBondContact O-N 3.12Å; L926-R928 PolarHBondContact O-N 2.97Å; L926-R928 VanDerWaalsContact O-N 3.12Å; L926-I929 HydrophobicContact CD2-CD1 4.29Å; L926-I929 HydrophobicContact CD2-CG2 4.26Å; L926-V938 HydrophobicContact CB-CG1 4.17Å; L926-V938 HydrophobicContact CB-CG2 3.9Å; L926-V938 HydrophobicContact CD1-CG2 4.08Å
927	L	96.5	Very high	96.1	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-6.8	165.9	-67.1	176.9	0	0	0	113.2	L923 V924 E925 V935 V938 A939 L942 D962 L963 R966	L923-L927 PolarHBondContact O-N 3.37Å; V924-L927 WeakPolarHBondContact O-CB 3.3Å; V924-L927 PolarHBondContact O-N 3.36Å; E925-L927 PolarHBondContact O-N 3.42Å; L927-V935 HydrophobicContact CD2-CG1 4.28Å; L927-V938 HydrophobicContact CD2-CB 4.48Å; L927-V938 HydrophobicContact CD2-CG1 3.84Å; L927-V938 HydrophobicContact CG-CG1 4.02Å; L927-A939 HydrophobicContact CD2-CB 4.3Å; L927-L942 HydrophobicContact CD1-CD1 3.72Å; L927-L942 HydrophobicContact CD2-CD1 4.36Å; L927-L942 HydrophobicContact CG-CD1 4.07Å; L927-D962 HydrophobicContact CB-CB 4.5Å; L927-L963 HydrophobicContact CD1-CD2 3.62Å; L927-L963 HydrophobicContact CD1-CG 3.8Å; L927-L963 HydrophobicContact CD2-CD2 4.28Å; L927-R966 VanDerWaalsContact O-CZ 3.26Å; L927-R966 PolarHBondContact O-NE 3.27Å; L927-R966 PolarHBondContact O-NH2 2.87Å
928	R	94.1	Very high	96.3	Very high	125 Å²	125	46.9 Å²	46.9	47%	0.472	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-13.6	-178.2	-57.2	-176.6	179.6	133.8	10.9	114.9	E925 L926 D962 R966	E925-R928 VanDerWaalsContact O-CB 3.23Å; E925-R928 WeakPolarHBondContact O-CB 3.06Å; E925-R928 PolarHBondContact O-N 3.21Å; L926-R928 PolarHBondContact O-N 2.97Å; L926-R928 VanDerWaalsContact O-N 3.12Å; R928-D962 IonicContact CZ-OD1 3.75Å; R928-D962 IonicContact CZ-OD2 2.78Å; R928-D962 IonicContact NE-OD1 3.16Å; R928-D962 PolarHBondContact NE-OD1 3.25Å; R928-D962 IonicContact NE-OD2 2.89Å; R928-D962 VanDerWaalsContact NH2-CG 3.29Å; R928-D962 IonicContact NH2-OD1 2.71Å; R928-D962 PolarHBondContact NH2-OD1 3.39Å; R928-D962 VanDerWaalsContact NH2-OD1 3.16Å; R928-D962 IonicContact NH2-OD2 3.4Å; R928-D962 PolarHBondContact NH2-OD2 2.89Å; R928-R966 PolarHBondContact O-NH2 3.17Å
929	I	93.2	Very high	96.5	Very high	55 Å²	55	39.2 Å²	39.2	28%	0.282	20%	0.196	S	C	.	.	S	Bend	trans	-74.1	151.4	180	77.6	174.6	0	0	0	112.1	L864 L926 N931 V934 R966	L864-I929 HydrophobicContact CD1-CD1 4.17Å; L926-I929 HydrophobicContact CD2-CD1 4.29Å; L926-I929 HydrophobicContact CD2-CG2 4.26Å; I929-N931 HydrophobicContact CD1-CB 4.14Å; I929-N931 HydrophobicContact CG1-CB 4.21Å; I929-N931 PolarHBondContact O-N 2.87Å; I929-V934 HydrophobicContact CD1-CB 3.91Å; I929-V934 HydrophobicContact CD1-CG1 3.75Å; I929-V934 HydrophobicContact CD1-CG2 4.23Å; I929-R966 PolarHBondContact O-NH2 2.71Å
930	D	91.6	Very high	96.5	Very high	129 Å²	129	40.6 Å²	40.6	69%	0.69	20%	0.204	S	C	*	.	S	Bend	trans	-86.4	56.1	-179.8	-157.6	30.4	0	0	0	112.9
931	N	94.6	Very high	96.6	Very high	45 Å²	45	40 Å²	40	24%	0.241	20%	0.201	C	C	.	.			trans	-132.1	109	173.6	-169.4	-59.3	0	0	0	111.4	P861 I929 R933 V934 V935	P861-N931 WeakPolarHBondContact CB-ND2 3.35Å; I929-N931 HydrophobicContact CD1-CB 4.14Å; I929-N931 HydrophobicContact CG1-CB 4.21Å; I929-N931 PolarHBondContact O-N 2.87Å; N931-R933 VanDerWaalsContact C-N 3.32Å; N931-R933 PolarHBondContact O-N 3.43Å; N931-R933 PolarHBondContact OD1-N 3.34Å; N931-V934 HydrophobicContact CB-CB 4.24Å; N931-V934 HydrophobicContact CB-CG2 4.12Å; N931-V934 PolarHBondContact O-N 2.92Å; N931-V934 PolarHBondContact OD1-N 3.23Å; N931-V935 VanDerWaalsContact O-CG2 3.31Å; N931-V935 WeakPolarHBondContact O-CG2 3.24Å; N931-V935 PolarHBondContact O-N 3.47Å
932	D	94.8	Very high	96.6	Very high	40 Å²	40	36 Å²	36	21%	0.214	18%	0.175	C	C	.	.	H	α-helix	trans	-56.4	-39.9	-177.4	-171.7	58.6	0	0	0	113.4	C936 M981 S982 T985	D932-C936 WeakPolarHBondContact O-CB 3.43Å; D932-C936 PolarHBondContact O-N 3.26Å; D932-M981 WeakPolarHBondContact OD1-CA 3.48Å; D932-M981 VanDerWaalsContact OD1-CB 3.32Å; D932-M981 WeakPolarHBondContact OD1-CB 3.13Å; D932-S982 PolarHBondContact OD1-N 3.21Å; D932-S982 WeakPolarHBondContact OD2-CB 3.44Å; D932-S982 PolarHBondContact OD2-N 2.89Å; D932-S982 PolarHBondContact OD2-OG 2.84Å; D932-T985 PolarHBondContact O-OG1 3.49Å; D932-T985 VanDerWaalsContact OD1-CB 3.26Å; D932-T985 WeakPolarHBondContact OD1-CB 3.14Å; D932-T985 PolarHBondContact OD1-OG1 2.95Å; D932-T985 PolarHBondContact OD2-OG1 3.29Å
933	R	96	Very high	96.6	Very high	110 Å²	110	39.1 Å²	39.1	42%	0.415	18%	0.184	S	C	.	.	H	α-helix	trans	-68.5	-49	-179.7	-63.3	-170.5	178.5	174.2	-11.3	111.8	D862 E865 N931 V935 C936 A937 W1250	D862-R933 IonicContact OD1-NH1 4Å; E865-R933 HydrophobicContact CG-CB 4.35Å; E865-R933 WeakPolarHBondContact OE2-CB 3.4Å; E865-R933 WeakPolarHBondContact OE2-CD 3.14Å; N931-R933 VanDerWaalsContact C-N 3.32Å; N931-R933 PolarHBondContact O-N 3.43Å; N931-R933 PolarHBondContact OD1-N 3.34Å; R933-V935 VanDerWaalsContact C-N 3.34Å; R933-V935 PolarHBondContact O-N 3.48Å; R933-C936 WeakPolarHBondContact O-CB 3.49Å; R933-C936 PolarHBondContact O-N 2.89Å; R933-C936 VanDerWaalsContact O-N 3.16Å; R933-A937 PolarHBondContact O-N 3.23Å; R933-W1250 HydrophobicContact CG-CZ3 4.29Å
934	V	97.4	Very high	96.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-44.2	178.6	-177.9	0	0	0	0	110.1	P861 L864 E865 I929 N931 C936 A937 V938	P861-V934 HydrophobicContact CB-CG2 4.03Å; P861-V934 VanDerWaalsContact O-CG2 3.31Å; P861-V934 WeakPolarHBondContact O-CG2 3.48Å; L864-V934 HydrophobicContact CB-CG1 3.97Å; L864-V934 HydrophobicContact CB-CG2 4.01Å; E865-V934 HydrophobicContact CB-CG2 4.25Å; I929-V934 HydrophobicContact CD1-CB 3.91Å; I929-V934 HydrophobicContact CD1-CG1 3.75Å; I929-V934 HydrophobicContact CD1-CG2 4.23Å; N931-V934 HydrophobicContact CB-CB 4.24Å; N931-V934 HydrophobicContact CB-CG2 4.12Å; N931-V934 PolarHBondContact O-N 2.92Å; N931-V934 PolarHBondContact OD1-N 3.23Å; V934-C936 VanDerWaalsContact C-N 3.29Å; V934-C936 PolarHBondContact O-N 2.88Å; V934-A937 PolarHBondContact O-N 3.35Å; V934-V938 HydrophobicContact CG1-CG2 3.95Å; V934-V938 VanDerWaalsContact O-CB 3.23Å; V934-V938 WeakPolarHBondContact O-CB 3.14Å; V934-V938 WeakPolarHBondContact O-CG2 3.42Å; V934-V938 PolarHBondContact O-N 3.41Å
935	V	97.4	Very high	96.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-38.1	176	173.2	0	0	0	0	111.6	L927 N931 R933 A939 R966 M981 T985	L927-V935 HydrophobicContact CD2-CG1 4.28Å; N931-V935 VanDerWaalsContact O-CG2 3.31Å; N931-V935 WeakPolarHBondContact O-CG2 3.24Å; N931-V935 PolarHBondContact O-N 3.47Å; R933-V935 VanDerWaalsContact C-N 3.34Å; R933-V935 PolarHBondContact O-N 3.48Å; V935-A939 WeakPolarHBondContact O-CB 3.26Å; V935-A939 PolarHBondContact O-N 2.99Å; V935-R966 HydrophobicContact CG1-CG 4.28Å; V935-M981 HydrophobicContact CG1-SD 4.35Å; V935-T985 HydrophobicContact CB-CG2 4.19Å; V935-T985 HydrophobicContact CG1-CG2 3.72Å
936	C	97.4	Very high	96.3	Very high	30 Å²	30	33.9 Å²	33.9	20%	0.203	16%	0.16	C	C	.	.	H	α-helix	trans	-66.1	-47	175.9	-169.8	0	0	0	0	112.8	D932 R933 V934 T940 T985	D932-C936 WeakPolarHBondContact O-CB 3.43Å; D932-C936 PolarHBondContact O-N 3.26Å; R933-C936 WeakPolarHBondContact O-CB 3.49Å; R933-C936 PolarHBondContact O-N 2.89Å; R933-C936 VanDerWaalsContact O-N 3.16Å; V934-C936 VanDerWaalsContact C-N 3.29Å; V934-C936 PolarHBondContact O-N 2.88Å; C936-T940 WeakPolarHBondContact O-CB 3.48Å; C936-T940 PolarHBondContact O-N 3.45Å; C936-T940 PolarHBondContact O-OG1 3.26Å; C936-T985 HydrophobicContact CB-CG2 4.11Å
937	A	97.9	Very high	96	Very high	10 Å²	10	36.9 Å²	36.9	8%	0.083	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-45.2	176.4	0	0	0	0	0	111.6	E865 A868 R933 V934 T940 A941	E865-A937 HydrophobicContact CG-CB 3.87Å; A868-A937 HydrophobicContact CB-CB 4.01Å; R933-A937 PolarHBondContact O-N 3.23Å; V934-A937 PolarHBondContact O-N 3.35Å; A937-T940 PolarHBondContact O-N 2.94Å; A937-A941 WeakPolarHBondContact O-CB 3.22Å; A937-A941 PolarHBondContact O-N 3.39Å
938	V	98.4	Very high	95.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-41.9	179.4	167.7	0	0	0	0	112.1	A868 L923 L926 L927 V934 A941 L942	A868-V938 HydrophobicContact CB-CG2 3.7Å; L923-V938 HydrophobicContact CB-CG1 4.23Å; L923-V938 HydrophobicContact CD2-CG1 4.22Å; L923-V938 HydrophobicContact CD2-CG2 4.3Å; L923-V938 WeakPolarHBondContact O-CG1 3.41Å; L926-V938 HydrophobicContact CB-CG1 4.17Å; L926-V938 HydrophobicContact CB-CG2 3.9Å; L926-V938 HydrophobicContact CD1-CG2 4.08Å; L927-V938 HydrophobicContact CD2-CB 4.48Å; L927-V938 HydrophobicContact CD2-CG1 3.84Å; L927-V938 HydrophobicContact CG-CG1 4.02Å; V934-V938 HydrophobicContact CG1-CG2 3.95Å; V934-V938 VanDerWaalsContact O-CB 3.23Å; V934-V938 WeakPolarHBondContact O-CB 3.14Å; V934-V938 WeakPolarHBondContact O-CG2 3.42Å; V934-V938 PolarHBondContact O-N 3.41Å; V938-A941 PolarHBondContact O-N 3.27Å; V938-L942 HydrophobicContact CG1-CD1 4.14Å; V938-L942 WeakPolarHBondContact O-CB 3.45Å; V938-L942 WeakPolarHBondContact O-CG 3.33Å; V938-L942 PolarHBondContact O-N 2.95Å
939	A	98.3	Very high	95.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.9	-47.1	172.4	0	0	0	0	0	110.8	L927 V935 A941 L942 R943 A988 V989 T992	L927-A939 HydrophobicContact CD2-CB 4.3Å; V935-A939 WeakPolarHBondContact O-CB 3.26Å; V935-A939 PolarHBondContact O-N 2.99Å; A939-A941 VanDerWaalsContact C-N 3.34Å; A939-A941 PolarHBondContact O-N 3.24Å; A939-L942 WeakPolarHBondContact O-CB 3.39Å; A939-L942 PolarHBondContact O-N 3.17Å; A939-L942 VanDerWaalsContact O-N 3.15Å; A939-R943 PolarHBondContact O-N 3.04Å; A939-A988 HydrophobicContact CB-CB 4.25Å; A939-V989 HydrophobicContact CB-CG2 4.11Å; A939-T992 PolarHBondContact O-OG1 2.86Å
940	T	97.6	Very high	95.3	Very high	28 Å²	28	36.7 Å²	36.7	17%	0.172	18%	0.183	C	C	.	.	H	α-helix	trans	-68	-32.9	-179.7	-50.4	0	0	0	0	112.4	Q872 C936 A937 R943 N944	Q872-T940 VanDerWaalsContact CD-CG2 3.43Å; Q872-T940 HydrophobicContact CG-CG2 3.95Å; C936-T940 WeakPolarHBondContact O-CB 3.48Å; C936-T940 PolarHBondContact O-N 3.45Å; C936-T940 PolarHBondContact O-OG1 3.26Å; A937-T940 PolarHBondContact O-N 2.94Å; T940-R943 WeakPolarHBondContact O-CB 3.37Å; T940-R943 PolarHBondContact O-N 3.25Å; T940-N944 PolarHBondContact O-N 2.9Å
941	A	98.1	Very high	95.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-49.9	168.1	0	0	0	0	0	111.1	Q872 A937 V938 A939 R943 N944 M945	Q872-A941 HydrophobicContact CB-CB 4.04Å; A937-A941 WeakPolarHBondContact O-CB 3.22Å; A937-A941 PolarHBondContact O-N 3.39Å; V938-A941 PolarHBondContact O-N 3.27Å; A939-A941 VanDerWaalsContact C-N 3.34Å; A939-A941 PolarHBondContact O-N 3.24Å; A941-R943 VanDerWaalsContact C-N 3.3Å; A941-R943 PolarHBondContact O-N 3.28Å; A941-N944 CarbonylContact O-C 3.53Å; A941-N944 PolarHBondContact O-N 2.89Å; A941-M945 WeakPolarHBondContact O-CG 3.39Å; A941-M945 PolarHBondContact O-N 2.77Å
942	L	98.3	Very high	95.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-37.2	177.5	-75.3	164.7	0	0	0	112.7	L920 L923 V924 L927 V938 A939 M945 A946 I955 T992	L920-L942 HydrophobicContact CD2-CD2 4.26Å; L923-L942 HydrophobicContact CB-CD1 4.26Å; L923-L942 HydrophobicContact CB-CD2 3.86Å; L923-L942 HydrophobicContact CB-CG 4.03Å; L923-L942 HydrophobicContact CD1-CD2 4.16Å; L923-L942 HydrophobicContact CD1-CG 4.45Å; V924-L942 HydrophobicContact CG2-CD1 4.5Å; V924-L942 HydrophobicContact CG2-CD2 4.49Å; L927-L942 HydrophobicContact CD1-CD1 3.72Å; L927-L942 HydrophobicContact CD2-CD1 4.36Å; L927-L942 HydrophobicContact CG-CD1 4.07Å; V938-L942 HydrophobicContact CG1-CD1 4.14Å; V938-L942 WeakPolarHBondContact O-CB 3.45Å; V938-L942 WeakPolarHBondContact O-CG 3.33Å; V938-L942 PolarHBondContact O-N 2.95Å; A939-L942 WeakPolarHBondContact O-CB 3.39Å; A939-L942 PolarHBondContact O-N 3.17Å; A939-L942 VanDerWaalsContact O-N 3.15Å; L942-M945 PolarHBondContact O-N 2.86Å; L942-A946 WeakPolarHBondContact O-CB 3.39Å; L942-A946 PolarHBondContact O-N 3.24Å; L942-I955 HydrophobicContact CD2-CD1 3.97Å; L942-I955 HydrophobicContact CD2-CG1 4.02Å; L942-T992 HydrophobicContact CB-CG2 4.1Å
943	R	97.1	Very high	95.5	Very high	98 Å²	98	32 Å²	32	37%	0.37	15%	0.154	S	C	.	.	H	α-helix	trans	-57.3	-47.6	171.2	-176.4	-173.7	173.7	-160.4	-4.4	111.4	A939 T940 A941 A946 T992 E995	A939-R943 PolarHBondContact O-N 3.04Å; T940-R943 WeakPolarHBondContact O-CB 3.37Å; T940-R943 PolarHBondContact O-N 3.25Å; A941-R943 VanDerWaalsContact C-N 3.3Å; A941-R943 PolarHBondContact O-N 3.28Å; R943-A946 PolarHBondContact O-N 2.74Å; R943-T992 HydrophobicContact CB-CG2 4.27Å; R943-E995 HydrophobicContact CG-CB 3.98Å; R943-E995 HydrophobicContact CG-CG 4.39Å
944	N	95.4	Very high	95.5	Very high	27 Å²	27	29.7 Å²	29.7	14%	0.144	15%	0.149	C	C	.	.	H	α-helix	trans	-69.1	-36.9	177.7	-71.8	-2.1	0	0	0	111.6	Q872 A875 R911 T940 A941 A946 L947	Q872-N944 PolarHBondContact O-ND2 3.12Å; A875-N944 HydrophobicContact CB-CB 3.86Å; R911-N944 WeakPolarHBondContact CD-O 3.5Å; T940-N944 PolarHBondContact O-N 2.9Å; A941-N944 CarbonylContact O-C 3.53Å; A941-N944 PolarHBondContact O-N 2.89Å; N944-A946 VanDerWaalsContact C-N 3.29Å; N944-A946 PolarHBondContact O-N 2.74Å; N944-L947 VanDerWaalsContact O-CB 3.31Å; N944-L947 WeakPolarHBondContact O-CB 3.26Å; N944-L947 VanDerWaalsContact O-CG 3.32Å; N944-L947 WeakPolarHBondContact O-CG 3.32Å; N944-L947 PolarHBondContact O-N 2.69Å
945	M	95.6	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-37.8	173.8	-64	-53.3	157.4	0	0	112.1	L871 A875 R911 V914 L920 L923 A941 L942 L947 D948 N951 I955	L871-M945 HydrophobicContact CB-CE 4.01Å; A875-M945 HydrophobicContact CB-CE 3.57Å; A875-M945 HydrophobicContact CB-SD 3.9Å; R911-M945 HydrophobicContact CB-SD 4.4Å; R911-M945 HydrophobicContact CG-SD 3.9Å; V914-M945 HydrophobicContact CB-CE 4.33Å; V914-M945 HydrophobicContact CB-SD 3.96Å; V914-M945 HydrophobicContact CG1-CE 4.2Å; V914-M945 HydrophobicContact CG1-CG 4.37Å; V914-M945 HydrophobicContact CG1-SD 3.91Å; V914-M945 HydrophobicContact CG2-CE 3.77Å; V914-M945 HydrophobicContact CG2-SD 4.01Å; L920-M945 HydrophobicContact CD2-CB 4.16Å; L920-M945 HydrophobicContact CD2-CG 4.31Å; L923-M945 HydrophobicContact CD1-CG 4.41Å; A941-M945 WeakPolarHBondContact O-CG 3.39Å; A941-M945 PolarHBondContact O-N 2.77Å; L942-M945 PolarHBondContact O-N 2.86Å; M945-L947 PolarHBondContact O-N 2.77Å; M945-L947 VanDerWaalsContact O-N 3.1Å; M945-D948 PolarHBondContact O-N 3.33Å; M945-D948 VanDerWaalsContact O-N 3.17Å; M945-N951 WeakPolarHBondContact O-CB 3.12Å; M945-N951 PolarHBondContact O-ND2 3.34Å; M945-N951 VanDerWaalsContact O-ND2 3.11Å; M945-I955 HydrophobicContact CB-CD1 3.96Å
946	A	95.2	Very high	95.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.8	177.9	0	0	0	0	0	114.7	L942 R943 N944 D948 K952 I955 E995 V996	L942-A946 WeakPolarHBondContact O-CB 3.39Å; L942-A946 PolarHBondContact O-N 3.24Å; R943-A946 PolarHBondContact O-N 2.74Å; N944-A946 VanDerWaalsContact C-N 3.29Å; N944-A946 PolarHBondContact O-N 2.74Å; A946-D948 VanDerWaalsContact C-N 3.25Å; A946-D948 PolarHBondContact O-N 3.47Å; A946-K952 HydrophobicContact CB-CB 4.35Å; A946-K952 HydrophobicContact CB-CG 4.47Å; A946-K952 WeakPolarHBondContact O-CE 3.49Å; A946-I955 HydrophobicContact CB-CD1 4.08Å; A946-E995 HydrophobicContact CB-CG 4.11Å; A946-V996 HydrophobicContact CB-CG2 3.97Å
947	L	90.9	Very high	95.2	Very high	77 Å²	77	35.4 Å²	35.4	40%	0.403	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.7	168.4	-60.5	174.3	0	0	0	112.9	N944 M945 E995	N944-L947 VanDerWaalsContact O-CB 3.31Å; N944-L947 WeakPolarHBondContact O-CB 3.26Å; N944-L947 VanDerWaalsContact O-CG 3.32Å; N944-L947 WeakPolarHBondContact O-CG 3.32Å; N944-L947 PolarHBondContact O-N 2.69Å; M945-L947 PolarHBondContact O-N 2.77Å; M945-L947 VanDerWaalsContact O-N 3.1Å; L947-E995 HydrophobicContact CD2-CG 4.44Å
948	D	88.5	Confident	95.1	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.08	19%	0.193	C	C	.	.	S	Bend	trans	-85.1	125.4	160.9	179.6	-35.9	0	0	0	109	R911 R915 M945 A946 R950 N951 K952	R911-D948 HydrophobicContact CB-CB 4.32Å; R915-D948 IonicContact CZ-OD2 3.65Å; R915-D948 IonicContact NH1-OD1 2.64Å; R915-D948 PolarHBondContact NH1-OD1 2.8Å; R915-D948 IonicContact NH1-OD2 3.92Å; R915-D948 PolarHBondContact NH1-OD2 2.95Å; R915-D948 IonicContact NH2-OD2 3.63Å; R915-D948 PolarHBondContact NH2-OD2 2.72Å; M945-D948 PolarHBondContact O-N 3.33Å; M945-D948 VanDerWaalsContact O-N 3.17Å; A946-D948 VanDerWaalsContact C-N 3.25Å; A946-D948 PolarHBondContact O-N 3.47Å; D948-R950 PolarHBondContact O-N 3.02Å; D948-R950 IonicContact OD1-CZ 3.4Å; D948-R950 PolarHBondContact OD1-N 3.49Å; D948-R950 IonicContact OD1-NE 2.58Å; D948-R950 PolarHBondContact OD1-NE 3.45Å; D948-R950 IonicContact OD1-NH2 2.77Å; D948-R950 IonicContact OD2-CZ 3.58Å; D948-R950 IonicContact OD2-NE 2.75Å; D948-R950 IonicContact OD2-NH2 2.68Å; D948-R950 PolarHBondContact OD2-NH2 2.93Å; D948-N951 HydrophobicContact CB-CB 4.08Å; D948-N951 CarbonylContact O-C 3.56Å; D948-N951 WeakPolarHBondContact O-CA 3.35Å; D948-N951 WeakPolarHBondContact O-CB 3.38Å; D948-N951 PolarHBondContact O-N 2.99Å; D948-K952 PolarHBondContact O-N 3.25Å
949	V	90.8	Very high	95	Very high	95 Å²	95	41.5 Å²	41.5	58%	0.576	19%	0.193	S	C	*	.	H	α-helix	trans	-55.9	-35.4	-175.9	-177.6	0	0	0	0	112.8	K952 E953	V949-K952 VanDerWaalsContact O-CB 3.26Å; V949-K952 WeakPolarHBondContact O-CB 2.97Å; V949-K952 PolarHBondContact O-N 3.36Å; V949-E953 WeakPolarHBondContact O-CG 3.22Å; V949-E953 PolarHBondContact O-N 3.44Å
950	R	90.9	Very high	94.9	Very high	67 Å²	67	41.8 Å²	41.8	25%	0.253	20%	0.195	S	C	.	.	H	α-helix	trans	-79.9	-31	-180	-57.5	156.3	-63.3	171.8	-8.9	111.7	D824 D948 K952 E953 L954	D824-R950 VanDerWaalsContact CA-NH1 3.31Å; D824-R950 PolarHBondContact O-NH1 3.14Å; D824-R950 PolarHBondContact O-NH2 3.38Å; D948-R950 PolarHBondContact O-N 3.02Å; D948-R950 IonicContact OD1-CZ 3.4Å; D948-R950 PolarHBondContact OD1-N 3.49Å; D948-R950 IonicContact OD1-NE 2.58Å; D948-R950 PolarHBondContact OD1-NE 3.45Å; D948-R950 IonicContact OD1-NH2 2.77Å; D948-R950 IonicContact OD2-CZ 3.58Å; D948-R950 IonicContact OD2-NE 2.75Å; D948-R950 IonicContact OD2-NH2 2.68Å; D948-R950 PolarHBondContact OD2-NH2 2.93Å; R950-K952 VanDerWaalsContact C-N 3.29Å; R950-E953 PolarHBondContact O-N 2.81Å; R950-L954 WeakPolarHBondContact O-CB 3.31Å; R950-L954 VanDerWaalsContact O-CG 3.25Å; R950-L954 WeakPolarHBondContact O-CG 3.38Å; R950-L954 PolarHBondContact O-N 3.21Å
951	N	94.8	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-40.1	166.9	-72	-4	0	0	0	109.8	R911 R915 L920 M945 D948 E953 L954 I955	R911-N951 PolarHBondContact O-ND2 3.41Å; R915-N951 WeakPolarHBondContact CB-OD1 3.25Å; R915-N951 WeakPolarHBondContact CD-OD1 3.34Å; R915-N951 PolarHBondContact NH1-OD1 3.05Å; L920-N951 HydrophobicContact CD1-CB 4.38Å; M945-N951 WeakPolarHBondContact O-CB 3.12Å; M945-N951 PolarHBondContact O-ND2 3.34Å; M945-N951 VanDerWaalsContact O-ND2 3.11Å; D948-N951 HydrophobicContact CB-CB 4.08Å; D948-N951 CarbonylContact O-C 3.56Å; D948-N951 WeakPolarHBondContact O-CA 3.35Å; D948-N951 WeakPolarHBondContact O-CB 3.38Å; D948-N951 PolarHBondContact O-N 2.99Å; N951-E953 PolarHBondContact O-N 3.5Å; N951-L954 PolarHBondContact O-N 2.95Å; N951-I955 HydrophobicContact CB-CD1 4.21Å; N951-I955 VanDerWaalsContact O-CB 3.25Å; N951-I955 WeakPolarHBondContact O-CB 3.5Å; N951-I955 WeakPolarHBondContact O-CD1 3.23Å; N951-I955 WeakPolarHBondContact O-CG1 3.3Å; N951-I955 PolarHBondContact O-N 3.4Å
952	K	94.8	Very high	94.8	Very high	21 Å²	21	49.3 Å²	49.3	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-58	-45	175.3	-168.4	174.3	-63.8	-149.4	0	112.1	A946 D948 V949 R950 G956 E995 V996 T998 N1000 N1003	A946-K952 HydrophobicContact CB-CB 4.35Å; A946-K952 HydrophobicContact CB-CG 4.47Å; A946-K952 WeakPolarHBondContact O-CE 3.49Å; D948-K952 PolarHBondContact O-N 3.25Å; V949-K952 VanDerWaalsContact O-CB 3.26Å; V949-K952 WeakPolarHBondContact O-CB 2.97Å; V949-K952 PolarHBondContact O-N 3.36Å; R950-K952 VanDerWaalsContact C-N 3.29Å; K952-G956 PolarHBondContact O-N 3.34Å; K952-E995 VanDerWaalsContact CE-O 3.26Å; K952-E995 WeakPolarHBondContact CE-O 3.31Å; K952-E995 PolarHBondContact NZ-O 3Å; K952-E995 IonicContact NZ-OE1 3.83Å; K952-E995 PolarHBondContact NZ-OE1 2.79Å; K952-V996 WeakPolarHBondContact CG-O 3.31Å; K952-T998 PolarHBondContact NZ-O 3.41Å; K952-N1000 HydrophobicContact CD-CB 4.29Å; K952-N1003 PolarHBondContact O-ND2 3.3Å
953	E	94.6	Very high	94.8	Very high	94 Å²	94	49.3 Å²	49.3	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-49.4	173.9	-70.5	160.1	-166.6	0	0	112.1	V949 R950 N951 G956 K957	V949-E953 WeakPolarHBondContact O-CG 3.22Å; V949-E953 PolarHBondContact O-N 3.44Å; R950-E953 PolarHBondContact O-N 2.81Å; N951-E953 PolarHBondContact O-N 3.5Å; E953-G956 PolarHBondContact O-N 3.22Å; E953-K957 WeakPolarHBondContact O-CB 3.23Å; E953-K957 PolarHBondContact O-N 3.12Å
954	L	95.6	Very high	94.7	Very high	61 Å²	61	44.9 Å²	44.9	32%	0.319	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-44.8	-179.9	-68.5	170.3	0	0	0	112.4	R915 L920 R950 N951 G956 K957 Y958	R915-L954 HydrophobicContact CG-CD1 3.94Å; L920-L954 HydrophobicContact CD1-CB 4.07Å; L920-L954 HydrophobicContact CD1-CD1 4.04Å; R950-L954 WeakPolarHBondContact O-CB 3.31Å; R950-L954 VanDerWaalsContact O-CG 3.25Å; R950-L954 WeakPolarHBondContact O-CG 3.38Å; R950-L954 PolarHBondContact O-N 3.21Å; N951-L954 PolarHBondContact O-N 2.95Å; L954-G956 VanDerWaalsContact C-N 3.35Å; L954-K957 PolarHBondContact O-N 3.39Å; L954-Y958 HydrophobicContact CB-CD2 4.49Å; L954-Y958 HydrophobicContact CD2-CD2 4.27Å; L954-Y958 HydrophobicContact CD2-CE2 3.85Å; L954-Y958 WeakPolarHBondContact O-CB 3.47Å; L954-Y958 VanDerWaalsContact O-CD2 3.23Å; L954-Y958 WeakPolarHBondContact O-CD2 3.21Å; L954-Y958 PolarHBondContact O-N 3.47Å
955	I	96.8	Very high	94.7	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-42.7	177.1	-66.3	164.9	0	0	0	109.7	L920 L942 M945 A946 N951 K957 Y958 A959 M960 V996	L920-I955 HydrophobicContact CD1-CG1 4.49Å; L920-I955 HydrophobicContact CD2-CD1 4.08Å; L920-I955 HydrophobicContact CD2-CG1 4.12Å; L942-I955 HydrophobicContact CD2-CD1 3.97Å; L942-I955 HydrophobicContact CD2-CG1 4.02Å; M945-I955 HydrophobicContact CB-CD1 3.96Å; A946-I955 HydrophobicContact CB-CD1 4.08Å; N951-I955 HydrophobicContact CB-CD1 4.21Å; N951-I955 VanDerWaalsContact O-CB 3.25Å; N951-I955 WeakPolarHBondContact O-CB 3.5Å; N951-I955 WeakPolarHBondContact O-CD1 3.23Å; N951-I955 WeakPolarHBondContact O-CG1 3.3Å; N951-I955 PolarHBondContact O-N 3.4Å; I955-K957 VanDerWaalsContact C-N 3.29Å; I955-K957 PolarHBondContact O-N 3.12Å; I955-Y958 PolarHBondContact O-N 3.33Å; I955-A959 HydrophobicContact CG2-CB 3.74Å; I955-A959 WeakPolarHBondContact O-CA 3.41Å; I955-A959 WeakPolarHBondContact O-CB 3.31Å; I955-A959 PolarHBondContact O-N 3.2Å; I955-M960 PolarHBondContact O-N 2.98Å; I955-V996 HydrophobicContact CB-CG2 4.39Å; I955-V996 HydrophobicContact CG2-CG1 4.45Å; I955-V996 HydrophobicContact CG2-CG2 3.6Å
956	G	95.9	Very high	94.6	Very high	2 Å²	2	51.9 Å²	51.9	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-31	175.3	0	0	0	0	0	114.3	K952 E953 L954 M960 N1003	K952-G956 PolarHBondContact O-N 3.34Å; E953-G956 PolarHBondContact O-N 3.22Å; L954-G956 VanDerWaalsContact C-N 3.35Å; G956-M960 VanDerWaalsContact O-CB 3.3Å; G956-M960 WeakPolarHBondContact O-CB 3.44Å; G956-N1003 WeakPolarHBondContact CA-OD1 3.48Å
957	K	94.4	Very high	94.4	Very high	147 Å²	147	52 Å²	52	64%	0.639	24%	0.236	S	C	*	.	H	α-helix	trans	-79.2	-38	176.3	-173.9	177.8	177.2	-164.4	0	113.8	E953 L954 I955	E953-K957 WeakPolarHBondContact O-CB 3.23Å; E953-K957 PolarHBondContact O-N 3.12Å; L954-K957 PolarHBondContact O-N 3.39Å; I955-K957 VanDerWaalsContact C-N 3.29Å; I955-K957 PolarHBondContact O-N 3.12Å
958	Y	94.6	Very high	94.2	Very high	138 Å²	138	50.6 Å²	50.6	54%	0.541	23%	0.231	S	C	.	.	H	α-helix	trans	-112	-28.8	-168.9	-63.6	-69.3	0	0	0	114.8	L954 I955	L954-Y958 HydrophobicContact CB-CD2 4.49Å; L954-Y958 HydrophobicContact CD2-CD2 4.27Å; L954-Y958 HydrophobicContact CD2-CE2 3.85Å; L954-Y958 WeakPolarHBondContact O-CB 3.47Å; L954-Y958 VanDerWaalsContact O-CD2 3.23Å; L954-Y958 WeakPolarHBondContact O-CD2 3.21Å; L954-Y958 PolarHBondContact O-N 3.47Å; I955-Y958 PolarHBondContact O-N 3.33Å
959	A	96.8	Very high	93.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-20.3	-177.4	0	0	0	0	0	114.4	V924 I955 R961 D962 L963	V924-A959 HydrophobicContact CG1-CB 4.27Å; V924-A959 HydrophobicContact CG2-CB 3.43Å; V924-A959 VanDerWaalsContact CG2-CB 3.43Å; I955-A959 HydrophobicContact CG2-CB 3.74Å; I955-A959 WeakPolarHBondContact O-CA 3.41Å; I955-A959 WeakPolarHBondContact O-CB 3.31Å; I955-A959 PolarHBondContact O-N 3.2Å; A959-R961 VanDerWaalsContact C-N 3.32Å; A959-R961 PolarHBondContact O-N 3.02Å; A959-D962 PolarHBondContact O-N 2.93Å; A959-L963 HydrophobicContact CB-CD1 4Å; A959-L963 HydrophobicContact CB-CG 4.37Å; A959-L963 PolarHBondContact O-N 2.82Å
960	M	97.3	Very high	91.7	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-55.8	-42.3	-166.4	-174.2	64.5	70.4	0	0	113.6	I955 G956 V964 L993 V996 I997 N1003 A1006 L1007 A1010	I955-M960 PolarHBondContact O-N 2.98Å; G956-M960 VanDerWaalsContact O-CB 3.3Å; G956-M960 WeakPolarHBondContact O-CB 3.44Å; M960-V964 WeakPolarHBondContact O-CB 3.37Å; M960-V964 VanDerWaalsContact O-CG2 3.28Å; M960-V964 WeakPolarHBondContact O-CG2 3.44Å; M960-V964 PolarHBondContact O-N 2.96Å; M960-V964 HydrophobicContact SD-CG2 4.45Å; M960-L993 HydrophobicContact CE-CD2 4.48Å; M960-L993 HydrophobicContact SD-CD2 3.54Å; M960-L993 VanDerWaalsContact SD-CD2 3.54Å; M960-V996 HydrophobicContact CE-CG1 3.76Å; M960-I997 HydrophobicContact CE-CG2 4.28Å; M960-N1003 HydrophobicContact CE-CB 4.3Å; M960-N1003 WeakPolarHBondContact CE-O 3.44Å; M960-A1006 HydrophobicContact CG-CB 4.16Å; M960-L1007 HydrophobicContact CE-CB 4.07Å; M960-L1007 HydrophobicContact SD-CB 3.65Å; M960-L1007 HydrophobicContact SD-CD1 3.79Å; M960-L1007 HydrophobicContact SD-CG 4.27Å; M960-A1010 HydrophobicContact CG-CB 4.16Å
961	R	96.3	Very high	89.5	Confident	170 Å²	170	53.5 Å²	53.5	64%	0.642	27%	0.274	S	S	*	.	H	α-helix	trans	-63.9	-43.3	178.3	-173	-169.2	67.3	162.5	3	111.8	A959 V964 H965	A959-R961 VanDerWaalsContact C-N 3.32Å; A959-R961 PolarHBondContact O-N 3.02Å; R961-V964 PolarHBondContact O-N 2.93Å; R961-H965 WeakPolarHBondContact O-CB 3.31Å; R961-H965 PolarHBondContact O-N 3.27Å
962	D	96.7	Very high	87.1	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-73.9	-38.1	-176.8	-62.3	-79.2	0	0	0	111.3	L927 R928 A959 H965 R966	L927-D962 HydrophobicContact CB-CB 4.5Å; R928-D962 IonicContact CZ-OD1 3.75Å; R928-D962 IonicContact CZ-OD2 2.78Å; R928-D962 IonicContact NE-OD1 3.16Å; R928-D962 PolarHBondContact NE-OD1 3.25Å; R928-D962 IonicContact NE-OD2 2.89Å; R928-D962 VanDerWaalsContact NH2-CG 3.29Å; R928-D962 IonicContact NH2-OD1 2.71Å; R928-D962 PolarHBondContact NH2-OD1 3.39Å; R928-D962 VanDerWaalsContact NH2-OD1 3.16Å; R928-D962 IonicContact NH2-OD2 3.4Å; R928-D962 PolarHBondContact NH2-OD2 2.89Å; A959-D962 PolarHBondContact O-N 2.93Å; D962-H965 WeakPolarHBondContact O-CB 3.48Å; D962-H965 PolarHBondContact O-N 2.89Å; D962-R966 PolarHBondContact O-N 3.22Å; D962-R966 VanDerWaalsContact O-N 3.15Å
963	L	97.2	Very high	84.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-44.5	168.4	-71.4	168.9	0	0	0	112.1	L927 A959 R966 L967 V989 T992 L993	L927-L963 HydrophobicContact CD1-CD2 3.62Å; L927-L963 HydrophobicContact CD1-CG 3.8Å; L927-L963 HydrophobicContact CD2-CD2 4.28Å; A959-L963 HydrophobicContact CB-CD1 4Å; A959-L963 HydrophobicContact CB-CG 4.37Å; A959-L963 PolarHBondContact O-N 2.82Å; L963-R966 PolarHBondContact O-N 3.17Å; L963-L967 PolarHBondContact O-N 3.41Å; L963-V989 HydrophobicContact CB-CG1 4.46Å; L963-V989 HydrophobicContact CD2-CG1 4.37Å; L963-V989 VanDerWaalsContact O-CG1 3.26Å; L963-V989 WeakPolarHBondContact O-CG1 3.44Å; L963-T992 HydrophobicContact CD1-CG2 4Å; L963-T992 HydrophobicContact CD2-CG2 4.01Å; L963-L993 HydrophobicContact CB-CD2 3.76Å; L963-L993 HydrophobicContact CB-CG 4.28Å; L963-L993 HydrophobicContact CD1-CD2 4Å; L963-L993 HydrophobicContact CG-CD2 4.5Å
964	V	96.5	Very high	81.8	Confident	6 Å²	6	65.4 Å²	65.4	4%	0.036	35%	0.349	C	S	.	.	H	α-helix	trans	-69.7	-32.9	176	171.8	0	0	0	0	111.9	M960 R961 R966 L967 L1007 A1010 K1015	M960-V964 WeakPolarHBondContact O-CB 3.37Å; M960-V964 VanDerWaalsContact O-CG2 3.28Å; M960-V964 WeakPolarHBondContact O-CG2 3.44Å; M960-V964 PolarHBondContact O-N 2.96Å; M960-V964 HydrophobicContact SD-CG2 4.45Å; R961-V964 PolarHBondContact O-N 2.93Å; V964-R966 PolarHBondContact O-N 3.15Å; V964-L967 PolarHBondContact O-N 2.75Å; V964-L1007 HydrophobicContact CG2-CD1 3.43Å; V964-L1007 VanDerWaalsContact CG2-CD1 3.43Å; V964-A1010 HydrophobicContact CB-CB 4.3Å; V964-A1010 WeakPolarHBondContact CG1-O 3.46Å; V964-A1010 HydrophobicContact CG2-CB 4.12Å; V964-K1015 HydrophobicContact CG1-CD 4.32Å; V964-K1015 WeakPolarHBondContact O-CD 3.4Å; V964-K1015 WeakPolarHBondContact O-CE 3.31Å; V964-K1015 PolarHBondContact O-NZ 3.32Å
965	H	93.9	Very high	79	Confident	137 Å²	137	68.7 Å²	68.7	63%	0.634	37%	0.367	S	S	*	.	H	α-helix	trans	-58.6	-40.6	174.1	-167.2	86.5	0	0	0	110.8	R961 D962 L967 K1015	R961-H965 WeakPolarHBondContact O-CB 3.31Å; R961-H965 PolarHBondContact O-N 3.27Å; D962-H965 WeakPolarHBondContact O-CB 3.48Å; D962-H965 PolarHBondContact O-N 2.89Å; H965-L967 PolarHBondContact O-N 3.03Å; H965-K1015 PolarHBondContact O-NZ 2.91Å
966	R	93.2	Very high	76.2	Confident	36 Å²	36	74.9 Å²	74.9	14%	0.136	41%	0.405	C	S	.	.	H	α-helix	trans	-71.3	-15.4	178.3	-72.9	-67.5	177.4	-179.7	1.1	116.3	L927 R928 I929 V935 D962 L963 V964 M981 V989	L927-R966 VanDerWaalsContact O-CZ 3.26Å; L927-R966 PolarHBondContact O-NE 3.27Å; L927-R966 PolarHBondContact O-NH2 2.87Å; R928-R966 PolarHBondContact O-NH2 3.17Å; I929-R966 PolarHBondContact O-NH2 2.71Å; V935-R966 HydrophobicContact CG1-CG 4.28Å; D962-R966 PolarHBondContact O-N 3.22Å; D962-R966 VanDerWaalsContact O-N 3.15Å; L963-R966 PolarHBondContact O-N 3.17Å; V964-R966 PolarHBondContact O-N 3.15Å; R966-M981 HydrophobicContact CB-CE 4Å; R966-M981 VanDerWaalsContact CD-SD 3.52Å; R966-M981 WeakPolarHBondContact O-CE 3.46Å; R966-V989 HydrophobicContact CB-CG2 4.18Å
967	L	92.9	Very high	73.5	Confident	3 Å²	3	79.7 Å²	79.7	2%	0.016	44%	0.444	C	S	.	.	S	Bend	trans	-69.1	140.5	168.1	-67	179.5	0	0	0	110.4	L963 V964 H965 V986 V989 L993 K1015 L1016 I1019	L963-L967 PolarHBondContact O-N 3.41Å; V964-L967 PolarHBondContact O-N 2.75Å; H965-L967 PolarHBondContact O-N 3.03Å; L967-V986 HydrophobicContact CD2-CG1 4.36Å; L967-V989 HydrophobicContact CD2-CB 4.33Å; L967-V989 HydrophobicContact CD2-CG1 3.7Å; L967-V989 HydrophobicContact CG-CG1 4.06Å; L967-L993 HydrophobicContact CD1-CD1 3.74Å; L967-L993 HydrophobicContact CD2-CD1 4.49Å; L967-L993 HydrophobicContact CG-CD1 4.23Å; L967-K1015 HydrophobicContact CB-CB 4.04Å; L967-K1015 HydrophobicContact CB-CD 3.68Å; L967-K1015 HydrophobicContact CD1-CB 4.25Å; L967-K1015 WeakPolarHBondContact O-CD 3.23Å; L967-K1015 WeakPolarHBondContact O-CE 3.46Å; L967-K1015 PolarHBondContact O-NZ 3.42Å; L967-L1016 HydrophobicContact CD1-CD2 3.71Å; L967-L1016 HydrophobicContact CD1-CG 3.79Å; L967-I1019 HydrophobicContact CB-CD1 4.3Å; L967-I1019 HydrophobicContact CD2-CD1 4.11Å
968	P	86.9	Confident	71.3	Confident	47 Å²	47	77 Å²	77	31%	0.305	44%	0.444	S	S	.	.			trans	-60.7	146.8	170.7	25	-33.7	0	0	0	111	V986 I1019	P968-V986 HydrophobicContact CG-CG1 4.31Å; P968-V986 HydrophobicContact CG-CG2 4.42Å; P968-I1019 HydrophobicContact CG-CD1 3.82Å; P968-I1019 HydrophobicContact CG-CG1 3.86Å
969	G	71.9	Confident	69.6	Low	35 Å²	35	78.5 Å²	78.5	36%	0.361	45%	0.453	S	S	.	.			trans	-139.6	143.3	-174.6	0	0	0	0	0	112.7	N971	G969-N971 VanDerWaalsContact C-N 3.31Å; G969-N971 PolarHBondContact O-N 3.46Å
970	G	53.9	Low	68.4	Low	71 Å²	71	83 Å²	83	73%	0.732	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.8	-165.6	0	0	0	0	0	116.6
971	N	45.1	Very low	67.8	Low	133 Å²	133	84.6 Å²	84.6	71%	0.711	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-5	-170	-65.8	-4.1	0	0	0	114.7	G969 S973	G969-N971 VanDerWaalsContact C-N 3.31Å; G969-N971 PolarHBondContact O-N 3.46Å; N971-S973 VanDerWaalsContact C-N 3.29Å; N971-S973 PolarHBondContact O-N 3.38Å
972	N	43.3	Very low	67.6	Low	125 Å²	125	78.2 Å²	78.2	67%	0.668	48%	0.48	S	S	*	.			trans	-90.5	38	-178.4	-79.3	17.9	0	0	0	113.3	N974	N972-N974 PolarHBondContact O-N 2.89Å
973	S	40.7	Very low	67.4	Low	99 Å²	99	79.8 Å²	79.8	69%	0.692	49%	0.489	S	S	*	.	S	Bend	trans	-70.6	-14.8	174.9	58.8	0	0	0	0	114.1	N971	N971-S973 VanDerWaalsContact C-N 3.29Å; N971-S973 PolarHBondContact O-N 3.38Å
974	N	37.5	Very low	67.3	Low	140 Å²	140	83.1 Å²	83.1	75%	0.749	51%	0.506	S	S	*	.	S	Bend	trans	-110.8	-3.7	-166.1	-69.6	19.2	0	0	0	114.8	N972	N972-N974 PolarHBondContact O-N 2.89Å
975	N	36.8	Very low	67.3	Low	131 Å²	131	82.8 Å²	82.8	70%	0.701	50%	0.504	S	S	*	.	S	Bend	trans	-89.6	118.4	168.4	-91.1	15.1	0	0	0	109.6
976	T	38	Very low	67.4	Low	132 Å²	132	76.5 Å²	76.5	81%	0.81	48%	0.475	S	S	*	.			trans	-68.4	141.1	180	45.1	0	0	0	0	112.7	S978	T976-S978 PolarHBondContact O-N 3.22Å
977	A	40	Very low	67.5	Low	103 Å²	103	75.5 Å²	75.5	85%	0.851	47%	0.473	S	S	*	.			trans	70.4	11.7	154.7	0	0	0	0	0	119.8	K979	A977-K979 PolarHBondContact O-N 3.47Å
978	S	48.1	Very low	67.7	Low	91 Å²	91	75.9 Å²	75.9	64%	0.636	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-69.9	127.1	155.1	58.5	0	0	0	0	109.2	T976 A980	T976-S978 PolarHBondContact O-N 3.22Å; S978-A980 PolarHBondContact O-N 2.81Å
979	K	58.1	Low	68.3	Low	168 Å²	168	73.6 Å²	73.6	73%	0.73	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-66.9	124.8	177.8	-174.8	-179.6	178.1	-175.1	0	108.2	A977 M981	A977-K979 PolarHBondContact O-N 3.47Å; K979-M981 PolarHBondContact O-N 3.05Å; K979-M981 VanDerWaalsContact O-N 3.12Å
980	A	72.9	Confident	69.5	Low	94 Å²	94	72 Å²	72	78%	0.777	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-56.7	121.7	175.4	0	0	0	0	0	109.2	S978	S978-A980 PolarHBondContact O-N 2.81Å
981	M	83.9	Confident	71.6	Confident	40 Å²	40	69.7 Å²	69.7	20%	0.197	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-62.3	150.2	-178.2	-63.1	-155.8	-35	0	0	110.9	D932 V935 R966 K979 T985 V986	D932-M981 WeakPolarHBondContact OD1-CA 3.48Å; D932-M981 VanDerWaalsContact OD1-CB 3.32Å; D932-M981 WeakPolarHBondContact OD1-CB 3.13Å; V935-M981 HydrophobicContact CG1-SD 4.35Å; R966-M981 HydrophobicContact CB-CE 4Å; R966-M981 VanDerWaalsContact CD-SD 3.52Å; R966-M981 WeakPolarHBondContact O-CE 3.46Å; K979-M981 PolarHBondContact O-N 3.05Å; K979-M981 VanDerWaalsContact O-N 3.12Å; M981-T985 HydrophobicContact CE-CG2 3.5Å; M981-T985 HydrophobicContact SD-CG2 4Å; M981-V986 HydrophobicContact CB-CG2 4.42Å; M981-V986 HydrophobicContact CE-CG2 4.39Å
982	S	91.9	Very high	74.1	Confident	37 Å²	37	63.3 Å²	63.3	26%	0.259	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.5	152.8	-177.9	65.7	0	0	0	0	112	D932 D984 T985 V986	D932-S982 PolarHBondContact OD1-N 3.21Å; D932-S982 WeakPolarHBondContact OD2-CB 3.44Å; D932-S982 PolarHBondContact OD2-N 2.89Å; D932-S982 PolarHBondContact OD2-OG 2.84Å; S982-D984 PolarHBondContact O-N 3.42Å; S982-T985 PolarHBondContact O-N 2.93Å; S982-T985 PolarHBondContact OG-N 3.47Å; S982-T985 PolarHBondContact OG-OG1 2.91Å; S982-V986 WeakPolarHBondContact O-CG2 3.38Å; S982-V986 PolarHBondContact O-N 2.86Å
983	D	93.1	Very high	76.8	Confident	48 Å²	48	57.4 Å²	57.4	26%	0.257	35%	0.352	S	S	.	.	H	α-helix	trans	-59.3	-25	174.4	-96.5	15.6	0	0	0	112.4	T987 H1027 S1028 V1031	D983-T987 VanDerWaalsContact O-CB 3.24Å; D983-T987 WeakPolarHBondContact O-CB 3.41Å; D983-T987 PolarHBondContact O-N 3.35Å; D983-T987 PolarHBondContact O-OG1 3.15Å; D983-H1027 IonicContact OD1-ND1 3.08Å; D983-S1028 WeakPolarHBondContact OD2-CA 3.44Å; D983-S1028 WeakPolarHBondContact OD2-CB 3.49Å; D983-S1028 PolarHBondContact OD2-N 3.01Å; D983-S1028 PolarHBondContact OD2-OG 3.37Å; D983-V1031 HydrophobicContact CB-CG2 3.6Å; D983-V1031 VanDerWaalsContact CG-CG2 3.44Å; D983-V1031 WeakPolarHBondContact O-CG2 3.28Å
984	D	94.3	Very high	79.5	Confident	69 Å²	69	54.9 Å²	54.9	37%	0.369	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-46.4	171.7	-75.9	-49.3	0	0	0	111.8	S982 T987 A988 K1030	S982-D984 PolarHBondContact O-N 3.42Å; D984-T987 WeakPolarHBondContact O-CB 3.39Å; D984-T987 PolarHBondContact O-N 3.42Å; D984-A988 WeakPolarHBondContact O-CB 3.26Å; D984-A988 PolarHBondContact O-N 3.46Å; D984-K1030 IonicContact OD1-NZ 3.17Å; D984-K1030 PolarHBondContact OD1-NZ 3.09Å
985	T	96.3	Very high	82.3	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-43.6	173.8	-49.4	0	0	0	0	111.9	D932 V935 C936 M981 S982 T987 A988 V989	D932-T985 PolarHBondContact O-OG1 3.49Å; D932-T985 VanDerWaalsContact OD1-CB 3.26Å; D932-T985 WeakPolarHBondContact OD1-CB 3.14Å; D932-T985 PolarHBondContact OD1-OG1 2.95Å; D932-T985 PolarHBondContact OD2-OG1 3.29Å; V935-T985 HydrophobicContact CB-CG2 4.19Å; V935-T985 HydrophobicContact CG1-CG2 3.72Å; C936-T985 HydrophobicContact CB-CG2 4.11Å; M981-T985 HydrophobicContact CE-CG2 3.5Å; M981-T985 HydrophobicContact SD-CG2 4Å; S982-T985 PolarHBondContact O-N 2.93Å; S982-T985 PolarHBondContact OG-N 3.47Å; S982-T985 PolarHBondContact OG-OG1 2.91Å; T985-T987 VanDerWaalsContact C-N 3.32Å; T985-T987 PolarHBondContact O-N 2.94Å; T985-A988 PolarHBondContact O-N 2.96Å; T985-V989 WeakPolarHBondContact O-CG2 3.42Å; T985-V989 PolarHBondContact O-N 3.29Å
986	V	95.9	Very high	85.2	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-38.1	176.3	-179.3	0	0	0	0	110.7	L967 P968 M981 S982 C990 I1019 V1031	L967-V986 HydrophobicContact CD2-CG1 4.36Å; P968-V986 HydrophobicContact CG-CG1 4.31Å; P968-V986 HydrophobicContact CG-CG2 4.42Å; M981-V986 HydrophobicContact CB-CG2 4.42Å; M981-V986 HydrophobicContact CE-CG2 4.39Å; S982-V986 WeakPolarHBondContact O-CG2 3.38Å; S982-V986 PolarHBondContact O-N 2.86Å; V986-C990 WeakPolarHBondContact O-CB 3.15Å; V986-C990 PolarHBondContact O-N 3.48Å; V986-C990 PolarHBondContact O-SG 3.14Å; V986-I1019 HydrophobicContact CG1-CD1 4.38Å; V986-V1031 HydrophobicContact CB-CG1 4.45Å; V986-V1031 HydrophobicContact CB-CG2 4.2Å; V986-V1031 HydrophobicContact CG1-CG1 3.74Å; V986-V1031 HydrophobicContact CG1-CG2 4.33Å
987	T	96.6	Very high	88.1	Confident	15 Å²	15	37.5 Å²	37.5	9%	0.092	23%	0.23	C	C	.	.	H	α-helix	trans	-63	-45.8	172	-60.2	0	0	0	0	111.4	D983 D984 T985 V989 C990 C991 K1030 V1031 A1034	D983-T987 VanDerWaalsContact O-CB 3.24Å; D983-T987 WeakPolarHBondContact O-CB 3.41Å; D983-T987 PolarHBondContact O-N 3.35Å; D983-T987 PolarHBondContact O-OG1 3.15Å; D984-T987 WeakPolarHBondContact O-CB 3.39Å; D984-T987 PolarHBondContact O-N 3.42Å; T985-T987 VanDerWaalsContact C-N 3.32Å; T985-T987 PolarHBondContact O-N 2.94Å; T987-V989 PolarHBondContact O-N 2.99Å; T987-C990 PolarHBondContact O-N 3.4Å; T987-C991 WeakPolarHBondContact O-CB 3.44Å; T987-C991 PolarHBondContact O-N 3.34Å; T987-C991 PolarHBondContact O-SG 2.97Å; T987-C991 VanDerWaalsContact O-SG 3.36Å; T987-K1030 HydrophobicContact CG2-CD 4.49Å; T987-K1030 HydrophobicContact CG2-CG 4.1Å; T987-V1031 VanDerWaalsContact OG1-CG2 3.3Å; T987-V1031 WeakPolarHBondContact OG1-CG2 3.42Å; T987-A1034 HydrophobicContact CG2-CB 4.13Å
988	A	97.6	Very high	90.7	Very high	11 Å²	11	33.9 Å²	33.9	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-46.4	178.9	0	0	0	0	0	111.5	A939 D984 T985 C991 T992	A939-A988 HydrophobicContact CB-CB 4.25Å; D984-A988 WeakPolarHBondContact O-CB 3.26Å; D984-A988 PolarHBondContact O-N 3.46Å; T985-A988 PolarHBondContact O-N 2.96Å; A988-C991 PolarHBondContact O-N 3.27Å; A988-T992 WeakPolarHBondContact O-CB 3.23Å; A988-T992 PolarHBondContact O-N 2.87Å; A988-T992 PolarHBondContact O-OG1 3.07Å
989	V	98.2	Very high	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-45.3	174.6	173.4	0	0	0	0	111.2	A939 L963 R966 L967 T985 T987 C991 T992 L993	A939-V989 HydrophobicContact CB-CG2 4.11Å; L963-V989 HydrophobicContact CB-CG1 4.46Å; L963-V989 HydrophobicContact CD2-CG1 4.37Å; L963-V989 VanDerWaalsContact O-CG1 3.26Å; L963-V989 WeakPolarHBondContact O-CG1 3.44Å; R966-V989 HydrophobicContact CB-CG2 4.18Å; L967-V989 HydrophobicContact CD2-CB 4.33Å; L967-V989 HydrophobicContact CD2-CG1 3.7Å; L967-V989 HydrophobicContact CG-CG1 4.06Å; T985-V989 WeakPolarHBondContact O-CG2 3.42Å; T985-V989 PolarHBondContact O-N 3.29Å; T987-V989 PolarHBondContact O-N 2.99Å; V989-C991 PolarHBondContact O-N 3.01Å; V989-T992 WeakPolarHBondContact O-CB 3.48Å; V989-T992 PolarHBondContact O-N 2.78Å; V989-L993 HydrophobicContact CG1-CD1 4.15Å; V989-L993 HydrophobicContact CG1-CG 4.47Å; V989-L993 WeakPolarHBondContact O-CB 3.3Å; V989-L993 WeakPolarHBondContact O-CG 3.45Å; V989-L993 PolarHBondContact O-N 3.08Å
990	C	98	Very high	94.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-44.9	175	-75	0	0	0	0	112.7	V986 T987 T992 L993 H994 A1034 V1038	V986-C990 WeakPolarHBondContact O-CB 3.15Å; V986-C990 PolarHBondContact O-N 3.48Å; V986-C990 PolarHBondContact O-SG 3.14Å; T987-C990 PolarHBondContact O-N 3.4Å; C990-T992 VanDerWaalsContact C-N 3.3Å; C990-T992 PolarHBondContact O-N 3.01Å; C990-L993 PolarHBondContact O-N 3.4Å; C990-H994 WeakPolarHBondContact O-CB 3.42Å; C990-H994 PolarHBondContact O-N 2.9Å; C990-A1034 HydrophobicContact CB-CB 3.65Å; C990-V1038 HydrophobicContact CB-CG2 4.33Å; C990-V1038 WeakPolarHBondContact O-CG2 3.39Å
991	C	97.8	Very high	95.6	Very high	23 Å²	23	31.1 Å²	31.1	16%	0.155	16%	0.159	C	C	.	.	H	α-helix	trans	-66.3	-32	176.4	-69.5	0	0	0	0	112.7	T987 A988 V989 E995	T987-C991 WeakPolarHBondContact O-CB 3.44Å; T987-C991 PolarHBondContact O-N 3.34Å; T987-C991 PolarHBondContact O-SG 2.97Å; T987-C991 VanDerWaalsContact O-SG 3.36Å; A988-C991 PolarHBondContact O-N 3.27Å; V989-C991 PolarHBondContact O-N 3.01Å; C991-E995 PolarHBondContact O-N 3.3Å; C991-E995 VanDerWaalsContact O-N 3.08Å
992	T	98.3	Very high	96.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-49.2	174.2	-54	0	0	0	0	110.6	A939 L942 R943 L963 A988 V989 C990 H994 E995 V996	A939-T992 PolarHBondContact O-OG1 2.86Å; L942-T992 HydrophobicContact CB-CG2 4.1Å; R943-T992 HydrophobicContact CB-CG2 4.27Å; L963-T992 HydrophobicContact CD1-CG2 4Å; L963-T992 HydrophobicContact CD2-CG2 4.01Å; A988-T992 WeakPolarHBondContact O-CB 3.23Å; A988-T992 PolarHBondContact O-N 2.87Å; A988-T992 PolarHBondContact O-OG1 3.07Å; V989-T992 WeakPolarHBondContact O-CB 3.48Å; V989-T992 PolarHBondContact O-N 2.78Å; C990-T992 VanDerWaalsContact C-N 3.3Å; C990-T992 PolarHBondContact O-N 3.01Å; T992-H994 VanDerWaalsContact C-N 3.32Å; T992-H994 PolarHBondContact O-N 3.28Å; T992-E995 PolarHBondContact O-N 2.92Å; T992-V996 HydrophobicContact CG2-CG2 4.42Å; T992-V996 WeakPolarHBondContact O-CB 3.47Å; T992-V996 WeakPolarHBondContact O-CG2 3.39Å; T992-V996 PolarHBondContact O-N 3.1Å
993	L	98.5	Very high	96.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59	-43.2	174.7	-72	175.1	0	0	0	111.5	M960 L963 L967 V989 C990 V996 I997 L1007 V1038	M960-L993 HydrophobicContact CE-CD2 4.48Å; M960-L993 HydrophobicContact SD-CD2 3.54Å; M960-L993 VanDerWaalsContact SD-CD2 3.54Å; L963-L993 HydrophobicContact CB-CD2 3.76Å; L963-L993 HydrophobicContact CB-CG 4.28Å; L963-L993 HydrophobicContact CD1-CD2 4Å; L963-L993 HydrophobicContact CG-CD2 4.5Å; L967-L993 HydrophobicContact CD1-CD1 3.74Å; L967-L993 HydrophobicContact CD2-CD1 4.49Å; L967-L993 HydrophobicContact CG-CD1 4.23Å; V989-L993 HydrophobicContact CG1-CD1 4.15Å; V989-L993 HydrophobicContact CG1-CG 4.47Å; V989-L993 WeakPolarHBondContact O-CB 3.3Å; V989-L993 WeakPolarHBondContact O-CG 3.45Å; V989-L993 PolarHBondContact O-N 3.08Å; C990-L993 PolarHBondContact O-N 3.4Å; L993-V996 PolarHBondContact O-N 3.19Å; L993-I997 WeakPolarHBondContact O-CG1 3.3Å; L993-I997 WeakPolarHBondContact O-CG2 3.47Å; L993-I997 PolarHBondContact O-N 3.08Å; L993-L1007 HydrophobicContact CD1-CD1 4.21Å; L993-L1007 HydrophobicContact CD2-CD1 4.07Å; L993-V1038 HydrophobicContact CB-CG1 4.34Å; L993-V1038 HydrophobicContact CB-CG2 4.29Å
994	H	97.9	Very high	96.7	Very high	46 Å²	46	32.9 Å²	32.9	21%	0.213	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-49.2	176.6	-178.6	-105.6	0	0	0	112	C990 T992 T998 V1038 S1041	C990-H994 WeakPolarHBondContact O-CB 3.42Å; C990-H994 PolarHBondContact O-N 2.9Å; T992-H994 VanDerWaalsContact C-N 3.32Å; T992-H994 PolarHBondContact O-N 3.28Å; H994-T998 VanDerWaalsContact O-CB 3.25Å; H994-T998 WeakPolarHBondContact O-CB 3.21Å; H994-T998 PolarHBondContact O-N 3.3Å; H994-T998 PolarHBondContact O-OG1 3.46Å; H994-V1038 HydrophobicContact CB-CG2 3.93Å; H994-S1041 PolarHBondContact CD2-OG 3.31Å; H994-S1041 WeakPolarHBondContact NE2-CB 3.47Å; H994-S1041 PolarHBondContact NE2-OG 2.87Å
995	E	97.1	Very high	96.8	Very high	38 Å²	38	34.2 Å²	34.2	18%	0.178	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-45.1	177.1	-172.9	56.2	-125.5	0	0	110.9	R943 A946 L947 K952 C991 T992 I997 T998	R943-E995 HydrophobicContact CG-CB 3.98Å; R943-E995 HydrophobicContact CG-CG 4.39Å; A946-E995 HydrophobicContact CB-CG 4.11Å; L947-E995 HydrophobicContact CD2-CG 4.44Å; K952-E995 VanDerWaalsContact CE-O 3.26Å; K952-E995 WeakPolarHBondContact CE-O 3.31Å; K952-E995 PolarHBondContact NZ-O 3Å; K952-E995 IonicContact NZ-OE1 3.83Å; K952-E995 PolarHBondContact NZ-OE1 2.79Å; C991-E995 PolarHBondContact O-N 3.3Å; C991-E995 VanDerWaalsContact O-N 3.08Å; T992-E995 PolarHBondContact O-N 2.92Å; E995-I997 VanDerWaalsContact C-N 3.34Å; E995-I997 PolarHBondContact O-N 3.02Å; E995-T998 PolarHBondContact O-N 2.97Å; E995-T998 VanDerWaalsContact O-N 3.09Å
996	V	97.4	Very high	96.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-37.8	-178.4	170.3	0	0	0	0	112.5	A946 K952 I955 M960 T992 L993 N1003	A946-V996 HydrophobicContact CB-CG2 3.97Å; K952-V996 WeakPolarHBondContact CG-O 3.31Å; I955-V996 HydrophobicContact CB-CG2 4.39Å; I955-V996 HydrophobicContact CG2-CG1 4.45Å; I955-V996 HydrophobicContact CG2-CG2 3.6Å; M960-V996 HydrophobicContact CE-CG1 3.76Å; T992-V996 HydrophobicContact CG2-CG2 4.42Å; T992-V996 WeakPolarHBondContact O-CB 3.47Å; T992-V996 WeakPolarHBondContact O-CG2 3.39Å; T992-V996 PolarHBondContact O-N 3.1Å; L993-V996 PolarHBondContact O-N 3.19Å; V996-N1003 HydrophobicContact CG1-CB 4.21Å; V996-N1003 WeakPolarHBondContact O-CB 3.46Å; V996-N1003 PolarHBondContact O-ND2 3.46Å
997	I	97.4	Very high	96.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-85.5	-13	175.1	73.2	170.3	0	0	0	113.9	M960 L993 E995 K999 N1000 N1003 A1004 L1007 V1038 M1042 Y1045	M960-I997 HydrophobicContact CE-CG2 4.28Å; L993-I997 WeakPolarHBondContact O-CG1 3.3Å; L993-I997 WeakPolarHBondContact O-CG2 3.47Å; L993-I997 PolarHBondContact O-N 3.08Å; E995-I997 VanDerWaalsContact C-N 3.34Å; E995-I997 PolarHBondContact O-N 3.02Å; I997-K999 PolarHBondContact O-N 2.92Å; I997-N1000 PolarHBondContact O-N 3.37Å; I997-N1003 HydrophobicContact CG2-CB 4.34Å; I997-A1004 HydrophobicContact CB-CB 4.13Å; I997-A1004 HydrophobicContact CG2-CB 4.38Å; I997-L1007 HydrophobicContact CD1-CD2 4.12Å; I997-L1007 HydrophobicContact CG2-CB 4.17Å; I997-L1007 HydrophobicContact CG2-CD2 3.77Å; I997-V1038 HydrophobicContact CD1-CG1 3.75Å; I997-V1038 WeakPolarHBondContact CD1-O 3.46Å; I997-M1042 HydrophobicContact CD1-CG 3.48Å; I997-M1042 VanDerWaalsContact CD1-CG 3.48Å; I997-Y1045 PolarHBondContact O-OH 2.76Å
998	T	94.5	Very high	96.9	Very high	27 Å²	27	36.5 Å²	36.5	17%	0.166	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	118.9	-175.1	-75	0	0	0	0	111	K952 H994 E995 N1000	K952-T998 PolarHBondContact NZ-O 3.41Å; H994-T998 VanDerWaalsContact O-CB 3.25Å; H994-T998 WeakPolarHBondContact O-CB 3.21Å; H994-T998 PolarHBondContact O-N 3.3Å; H994-T998 PolarHBondContact O-OG1 3.46Å; E995-T998 PolarHBondContact O-N 2.97Å; E995-T998 VanDerWaalsContact O-N 3.09Å; T998-N1000 PolarHBondContact O-N 2.73Å
999	K	91.9	Very high	96.8	Very high	201 Å²	201	40.7 Å²	40.7	87%	0.874	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	16.9	-172.8	-56.3	175.3	-177.5	174.9	0	114.9	I997 Y1045	I997-K999 PolarHBondContact O-N 2.92Å; K999-Y1045 WeakPolarHBondContact CA-OH 3.34Å; K999-Y1045 PolarHBondContact N-OH 2.88Å
1000	N	95	Very high	96.7	Very high	20 Å²	20	42.3 Å²	42.3	11%	0.107	21%	0.211	C	C	.	.			trans	-128.2	107.8	170	-173.1	-41.7	0	0	0	110.9	K952 I997 T998 E1002 N1003 A1004 Y1045	K952-N1000 HydrophobicContact CD-CB 4.29Å; I997-N1000 PolarHBondContact O-N 3.37Å; T998-N1000 PolarHBondContact O-N 2.73Å; N1000-E1002 PolarHBondContact OD1-N 2.84Å; N1000-N1003 HydrophobicContact CB-CB 4.09Å; N1000-N1003 VanDerWaalsContact CG-CG 3.42Å; N1000-N1003 PolarHBondContact OD1-N 2.93Å; N1000-A1004 PolarHBondContact O-N 3.42Å; N1000-Y1045 PolarHBondContact N-OH 3.31Å
1001	M	95.9	Very high	96.5	Very high	74 Å²	74	44.1 Å²	44.1	37%	0.365	23%	0.23	S	C	.	.	H	α-helix	trans	-74.3	-30.3	-178.7	-172.7	170.9	65.4	0	0	113.2	N1003 A1004 K1005 Y1045 D1047 L1048	M1001-N1003 VanDerWaalsContact C-N 3.34Å; M1001-A1004 PolarHBondContact O-N 3.41Å; M1001-K1005 PolarHBondContact O-N 3.38Å; M1001-Y1045 HydrophobicContact CB-CD1 3.69Å; M1001-Y1045 HydrophobicContact CB-CE1 3.77Å; M1001-Y1045 HydrophobicContact CB-CG 4.31Å; M1001-Y1045 HydrophobicContact CG-CD1 3.74Å; M1001-Y1045 HydrophobicContact CG-CE1 4.32Å; M1001-Y1045 HydrophobicContact CG-CG 3.97Å; M1001-Y1045 HydrophobicContact SD-CD1 4.09Å; M1001-Y1045 HydrophobicContact SD-CG 4.46Å; M1001-D1047 HydrophobicContact SD-CB 4.08Å; M1001-L1048 HydrophobicContact CG-CD1 3.72Å; M1001-L1048 HydrophobicContact CG-CD2 4.19Å; M1001-L1048 HydrophobicContact CG-CG 3.82Å; M1001-L1048 HydrophobicContact SD-CD2 4.45Å; M1001-L1048 HydrophobicContact SD-CG 4.11Å
1002	E	96.2	Very high	96.5	Very high	156 Å²	156	43 Å²	43	73%	0.729	22%	0.222	S	C	*	.	H	α-helix	trans	-66.7	-40.6	177.6	-58.4	-169.1	163.8	0	0	110.5	N1000 K1005 A1006	N1000-E1002 PolarHBondContact OD1-N 2.84Å; E1002-K1005 CarbonylContact O-C 3.55Å; E1002-K1005 WeakPolarHBondContact O-CB 3.46Å; E1002-K1005 PolarHBondContact O-N 3.23Å; E1002-A1006 PolarHBondContact O-N 3.48Å
1003	N	97.4	Very high	96.3	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-39.7	172.2	-69.1	-1.2	0	0	0	112	K952 G956 M960 V996 I997 N1000 M1001 K1005 A1006 L1007	K952-N1003 PolarHBondContact O-ND2 3.3Å; G956-N1003 WeakPolarHBondContact CA-OD1 3.48Å; M960-N1003 HydrophobicContact CE-CB 4.3Å; M960-N1003 WeakPolarHBondContact CE-O 3.44Å; V996-N1003 HydrophobicContact CG1-CB 4.21Å; V996-N1003 WeakPolarHBondContact O-CB 3.46Å; V996-N1003 PolarHBondContact O-ND2 3.46Å; I997-N1003 HydrophobicContact CG2-CB 4.34Å; N1000-N1003 HydrophobicContact CB-CB 4.09Å; N1000-N1003 VanDerWaalsContact CG-CG 3.42Å; N1000-N1003 PolarHBondContact OD1-N 2.93Å; M1001-N1003 VanDerWaalsContact C-N 3.34Å; N1003-K1005 PolarHBondContact O-N 3.26Å; N1003-A1006 PolarHBondContact O-N 3.23Å; N1003-L1007 WeakPolarHBondContact O-CB 3.23Å; N1003-L1007 PolarHBondContact O-N 3.42Å
1004	A	97.6	Very high	96.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.1	-28.3	173.7	0	0	0	0	0	112.9	I997 N1000 M1001 M1042 Y1045 L1048	I997-A1004 HydrophobicContact CB-CB 4.13Å; I997-A1004 HydrophobicContact CG2-CB 4.38Å; N1000-A1004 PolarHBondContact O-N 3.42Å; M1001-A1004 PolarHBondContact O-N 3.41Å; A1004-M1042 WeakPolarHBondContact O-CE 3.35Å; A1004-Y1045 HydrophobicContact CB-CD2 3.59Å; A1004-Y1045 HydrophobicContact CB-CE2 3.5Å; A1004-Y1045 VanDerWaalsContact CB-CE2 3.5Å; A1004-L1048 HydrophobicContact CB-CD1 3.82Å
1005	K	96.4	Very high	95.9	Very high	97 Å²	97	48.6 Å²	48.6	42%	0.422	25%	0.248	S	C	.	.	H	α-helix	trans	-75.5	-43.3	170.6	-171.2	-165.5	167.1	-168.1	0	111.4	M1001 E1002 N1003 L1007 R1008 D1009 L1048 L1051	M1001-K1005 PolarHBondContact O-N 3.38Å; E1002-K1005 CarbonylContact O-C 3.55Å; E1002-K1005 WeakPolarHBondContact O-CB 3.46Å; E1002-K1005 PolarHBondContact O-N 3.23Å; N1003-K1005 PolarHBondContact O-N 3.26Å; K1005-L1007 VanDerWaalsContact C-N 3.32Å; K1005-L1007 PolarHBondContact O-N 3.46Å; K1005-R1008 WeakPolarHBondContact O-CA 3.49Å; K1005-R1008 VanDerWaalsContact O-CB 3.3Å; K1005-R1008 WeakPolarHBondContact O-CB 3.23Å; K1005-R1008 PolarHBondContact O-N 3.12Å; K1005-R1008 VanDerWaalsContact O-N 3.08Å; K1005-D1009 WeakPolarHBondContact CE-OD2 3.47Å; K1005-D1009 PolarHBondContact O-N 2.98Å; K1005-L1048 HydrophobicContact CB-CD1 4.34Å; K1005-L1048 HydrophobicContact CB-CD2 4.17Å; K1005-L1048 HydrophobicContact CG-CD2 4.37Å; K1005-L1051 HydrophobicContact CG-CD2 4.47Å
1006	A	97.4	Very high	95.8	Very high	29 Å²	29	46.8 Å²	46.8	24%	0.24	24%	0.239	C	C	.	.	H	α-helix	trans	-61.4	-38.3	176.4	0	0	0	0	0	112.4	M960 E1002 N1003 R1008 D1009 A1010	M960-A1006 HydrophobicContact CG-CB 4.16Å; E1002-A1006 PolarHBondContact O-N 3.48Å; N1003-A1006 PolarHBondContact O-N 3.23Å; A1006-R1008 VanDerWaalsContact C-N 3.28Å; A1006-R1008 PolarHBondContact O-N 3.08Å; A1006-D1009 PolarHBondContact O-N 3.33Å; A1006-A1010 VanDerWaalsContact O-CB 3.31Å; A1006-A1010 WeakPolarHBondContact O-CB 3.32Å; A1006-A1010 PolarHBondContact O-N 3.46Å
1007	L	97.9	Very high	95.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-37.1	173	177.7	54.7	0	0	0	112.3	M960 V964 L993 I997 N1003 K1005 G1012 L1016 V1038 M1042	M960-L1007 HydrophobicContact CE-CB 4.07Å; M960-L1007 HydrophobicContact SD-CB 3.65Å; M960-L1007 HydrophobicContact SD-CD1 3.79Å; M960-L1007 HydrophobicContact SD-CG 4.27Å; V964-L1007 HydrophobicContact CG2-CD1 3.43Å; V964-L1007 VanDerWaalsContact CG2-CD1 3.43Å; L993-L1007 HydrophobicContact CD1-CD1 4.21Å; L993-L1007 HydrophobicContact CD2-CD1 4.07Å; I997-L1007 HydrophobicContact CD1-CD2 4.12Å; I997-L1007 HydrophobicContact CG2-CB 4.17Å; I997-L1007 HydrophobicContact CG2-CD2 3.77Å; N1003-L1007 WeakPolarHBondContact O-CB 3.23Å; N1003-L1007 PolarHBondContact O-N 3.42Å; K1005-L1007 VanDerWaalsContact C-N 3.32Å; K1005-L1007 PolarHBondContact O-N 3.46Å; L1007-G1012 WeakPolarHBondContact O-CA 3.28Å; L1007-G1012 PolarHBondContact O-N 2.92Å; L1007-L1016 HydrophobicContact CD1-CD1 4.43Å; L1007-L1016 HydrophobicContact CD2-CD1 4.19Å; L1007-V1038 HydrophobicContact CD2-CG1 3.61Å; L1007-M1042 HydrophobicContact CB-CE 4.18Å; L1007-M1042 HydrophobicContact CD2-CE 3.98Å; L1007-M1042 HydrophobicContact CD2-CG 4.18Å; L1007-M1042 HydrophobicContact CD2-SD 3.58Å; L1007-M1042 VanDerWaalsContact CD2-SD 3.58Å; L1007-M1042 HydrophobicContact CG-CE 3.92Å; L1007-M1042 HydrophobicContact CG-SD 4.06Å
1008	R	96.5	Very high	95.4	Very high	38 Å²	38	49.7 Å²	49.7	14%	0.143	27%	0.267	C	S	.	.	H	α-helix	trans	-68.6	-51	172.2	173.3	-165.5	129.5	-69.9	-23.3	111.2	K1005 A1006 A1010 G1011 I1013 M1042 L1051 Y1052 D1055	K1005-R1008 WeakPolarHBondContact O-CA 3.49Å; K1005-R1008 VanDerWaalsContact O-CB 3.3Å; K1005-R1008 WeakPolarHBondContact O-CB 3.23Å; K1005-R1008 PolarHBondContact O-N 3.12Å; K1005-R1008 VanDerWaalsContact O-N 3.08Å; A1006-R1008 VanDerWaalsContact C-N 3.28Å; A1006-R1008 PolarHBondContact O-N 3.08Å; R1008-A1010 PolarHBondContact O-N 3.39Å; R1008-G1011 PolarHBondContact O-N 3.27Å; R1008-I1013 HydrophobicContact CB-CD1 3.82Å; R1008-I1013 HydrophobicContact CB-CG1 4.43Å; R1008-I1013 HydrophobicContact CG-CD1 3.65Å; R1008-M1042 HydrophobicContact CB-CE 4.26Å; R1008-L1051 VanDerWaalsContact CZ-CD2 3.47Å; R1008-Y1052 HydrophobicContact CB-CE1 4.13Å; R1008-Y1052 HydrophobicContact CG-CD1 4.38Å; R1008-Y1052 HydrophobicContact CG-CE1 4.22Å; R1008-D1055 WeakPolarHBondContact CD-OD2 3.49Å; R1008-D1055 IonicContact CZ-OD2 3.59Å; R1008-D1055 IonicContact NE-OD2 3.56Å; R1008-D1055 PolarHBondContact NE-OD2 3.04Å; R1008-D1055 IonicContact NH2-OD2 3.35Å
1009	D	95.9	Very high	95.2	Very high	99 Å²	99	48.5 Å²	48.5	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-25	-178.8	-72.1	-48.4	0	0	0	112.6	K1005 A1006 G1011	K1005-D1009 WeakPolarHBondContact CE-OD2 3.47Å; K1005-D1009 PolarHBondContact O-N 2.98Å; A1006-D1009 PolarHBondContact O-N 3.33Å; D1009-G1011 VanDerWaalsContact C-N 3.31Å
1010	A	95.9	Very high	95.2	Very high	34 Å²	34	40 Å²	40	28%	0.281	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.3	172.2	0	0	0	0	0	114.8	M960 V964 A1006 R1008	M960-A1010 HydrophobicContact CG-CB 4.16Å; V964-A1010 HydrophobicContact CB-CB 4.3Å; V964-A1010 WeakPolarHBondContact CG1-O 3.46Å; V964-A1010 HydrophobicContact CG2-CB 4.12Å; A1006-A1010 VanDerWaalsContact O-CB 3.31Å; A1006-A1010 WeakPolarHBondContact O-CB 3.32Å; A1006-A1010 PolarHBondContact O-N 3.46Å; R1008-A1010 PolarHBondContact O-N 3.39Å
1011	G	94.6	Very high	94.8	Very high	37 Å²	37	43.2 Å²	43.2	38%	0.381	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	11.6	-178.9	0	0	0	0	0	115.3	R1008 D1009 I1013 E1014	R1008-G1011 PolarHBondContact O-N 3.27Å; D1009-G1011 VanDerWaalsContact C-N 3.31Å; G1011-I1013 VanDerWaalsContact C-N 3.31Å; G1011-I1013 PolarHBondContact O-N 3.42Å; G1011-E1014 PolarHBondContact O-N 3.42Å
1012	G	95.8	Very high	94.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-27.8	-171.8	0	0	0	0	0	115.3	L1007 E1014 K1015 L1016	L1007-G1012 WeakPolarHBondContact O-CA 3.28Å; L1007-G1012 PolarHBondContact O-N 2.92Å; G1012-E1014 PolarHBondContact O-N 2.74Å; G1012-K1015 PolarHBondContact O-N 2.93Å; G1012-L1016 WeakPolarHBondContact O-CB 3.27Å; G1012-L1016 WeakPolarHBondContact O-CD1 3.28Å; G1012-L1016 VanDerWaalsContact O-CG 3.23Å; G1012-L1016 WeakPolarHBondContact O-CG 3.36Å; G1012-L1016 PolarHBondContact O-N 2.79Å
1013	I	95.7	Very high	93	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-46.8	-179.4	-59	169.8	0	0	0	110.8	R1008 G1011 K1015 L1016 V1017 L1039 M1042 Y1052 W1057 F1062	R1008-I1013 HydrophobicContact CB-CD1 3.82Å; R1008-I1013 HydrophobicContact CB-CG1 4.43Å; R1008-I1013 HydrophobicContact CG-CD1 3.65Å; G1011-I1013 VanDerWaalsContact C-N 3.31Å; G1011-I1013 PolarHBondContact O-N 3.42Å; I1013-K1015 PolarHBondContact O-N 3.23Å; I1013-L1016 PolarHBondContact O-N 3.35Å; I1013-V1017 HydrophobicContact CG2-CG2 3.99Å; I1013-V1017 WeakPolarHBondContact O-CB 3.4Å; I1013-V1017 VanDerWaalsContact O-CG2 3.23Å; I1013-V1017 WeakPolarHBondContact O-CG2 3.3Å; I1013-V1017 PolarHBondContact O-N 2.88Å; I1013-L1039 HydrophobicContact CG2-CD2 4.34Å; I1013-M1042 HydrophobicContact CD1-CE 4Å; I1013-M1042 HydrophobicContact CG1-CE 3.62Å; I1013-M1042 HydrophobicContact CG1-SD 4.11Å; I1013-Y1052 HydrophobicContact CD1-CD1 3.8Å; I1013-Y1052 HydrophobicContact CD1-CE1 3.89Å; I1013-W1057 HydrophobicContact CB-CZ2 4.42Å; I1013-W1057 HydrophobicContact CG2-CD2 3.66Å; I1013-W1057 HydrophobicContact CG2-CE3 4.1Å; I1013-W1057 HydrophobicContact CG2-CG 4.05Å; I1013-W1057 HydrophobicContact CG2-CH2 4.37Å; I1013-W1057 HydrophobicContact CG2-CZ2 3.97Å; I1013-W1057 HydrophobicContact CG2-CZ3 4.44Å; I1013-F1062 HydrophobicContact CD1-CE1 4.13Å; I1013-F1062 HydrophobicContact CD1-CZ 3.92Å; I1013-F1062 HydrophobicContact CG1-CE1 4.2Å; I1013-F1062 HydrophobicContact CG1-CZ 4.42Å; I1013-F1062 HydrophobicContact CG2-CE1 4.1Å; I1013-F1062 HydrophobicContact CG2-CZ 4.06Å
1014	E	93.9	Very high	91.4	Very high	113 Å²	113	44.2 Å²	44.2	53%	0.528	26%	0.259	S	S	.	.	H	α-helix	trans	-59.7	-47.4	-176.9	-173.1	-173.5	164	0	0	111.3	G1011 G1012 V1017 G1018 W1057	G1011-E1014 PolarHBondContact O-N 3.42Å; G1012-E1014 PolarHBondContact O-N 2.74Å; E1014-V1017 PolarHBondContact O-N 3.26Å; E1014-G1018 PolarHBondContact O-N 2.78Å; E1014-W1057 HydrophobicContact CB-CH2 4.25Å; E1014-W1057 HydrophobicContact CB-CZ2 4.13Å; E1014-W1057 HydrophobicContact CG-CH2 4.45Å
1015	K	94	Very high	89.8	Confident	46 Å²	46	51.7 Å²	51.7	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-48.3	176.5	-66.1	-166.9	173	-168.3	0	112.1	V964 H965 L967 G1012 I1013 V1017 G1018 I1019	V964-K1015 HydrophobicContact CG1-CD 4.32Å; V964-K1015 WeakPolarHBondContact O-CD 3.4Å; V964-K1015 WeakPolarHBondContact O-CE 3.31Å; V964-K1015 PolarHBondContact O-NZ 3.32Å; H965-K1015 PolarHBondContact O-NZ 2.91Å; L967-K1015 HydrophobicContact CB-CB 4.04Å; L967-K1015 HydrophobicContact CB-CD 3.68Å; L967-K1015 HydrophobicContact CD1-CB 4.25Å; L967-K1015 WeakPolarHBondContact O-CD 3.23Å; L967-K1015 WeakPolarHBondContact O-CE 3.46Å; L967-K1015 PolarHBondContact O-NZ 3.42Å; G1012-K1015 PolarHBondContact O-N 2.93Å; I1013-K1015 PolarHBondContact O-N 3.23Å; K1015-V1017 VanDerWaalsContact C-N 3.31Å; K1015-V1017 PolarHBondContact O-N 2.81Å; K1015-G1018 PolarHBondContact O-N 3.16Å; K1015-G1018 VanDerWaalsContact O-N 3.17Å; K1015-I1019 VanDerWaalsContact O-CG1 3.27Å; K1015-I1019 WeakPolarHBondContact O-CG1 3.34Å; K1015-I1019 PolarHBondContact O-N 3.42Å
1016	L	95.4	Very high	89.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.2	-35.6	179.2	-69.8	165.9	0	0	0	112.5	L967 L1007 G1012 I1013 S1020 A1035 V1038 L1039	L967-L1016 HydrophobicContact CD1-CD2 3.71Å; L967-L1016 HydrophobicContact CD1-CG 3.79Å; L1007-L1016 HydrophobicContact CD1-CD1 4.43Å; L1007-L1016 HydrophobicContact CD2-CD1 4.19Å; G1012-L1016 WeakPolarHBondContact O-CB 3.27Å; G1012-L1016 WeakPolarHBondContact O-CD1 3.28Å; G1012-L1016 VanDerWaalsContact O-CG 3.23Å; G1012-L1016 WeakPolarHBondContact O-CG 3.36Å; G1012-L1016 PolarHBondContact O-N 2.79Å; I1013-L1016 PolarHBondContact O-N 3.35Å; L1016-S1020 VanDerWaalsContact O-CB 3.32Å; L1016-S1020 WeakPolarHBondContact O-CB 3.47Å; L1016-S1020 PolarHBondContact O-N 3.48Å; L1016-S1020 PolarHBondContact O-OG 3.5Å; L1016-A1035 HydrophobicContact CD2-CB 3.92Å; L1016-V1038 HydrophobicContact CD1-CB 4.06Å; L1016-V1038 HydrophobicContact CD1-CG1 3.56Å; L1016-V1038 HydrophobicContact CD2-CB 4.23Å; L1016-V1038 HydrophobicContact CD2-CG1 4.47Å; L1016-V1038 HydrophobicContact CD2-CG2 4.3Å; L1016-L1039 HydrophobicContact CB-CD1 3.96Å; L1016-L1039 HydrophobicContact CB-CD2 3.95Å; L1016-L1039 HydrophobicContact CB-CG 3.82Å
1017	V	93.5	Very high	88.5	Confident	14 Å²	14	55 Å²	55	9%	0.085	31%	0.308	C	S	.	.	H	α-helix	trans	-68.5	-43	173.2	169.9	0	0	0	0	110.7	I1013 E1014 K1015 I1019 S1020 K1021 L1039 W1057 H1061	I1013-V1017 HydrophobicContact CG2-CG2 3.99Å; I1013-V1017 WeakPolarHBondContact O-CB 3.4Å; I1013-V1017 VanDerWaalsContact O-CG2 3.23Å; I1013-V1017 WeakPolarHBondContact O-CG2 3.3Å; I1013-V1017 PolarHBondContact O-N 2.88Å; E1014-V1017 PolarHBondContact O-N 3.26Å; K1015-V1017 VanDerWaalsContact C-N 3.31Å; K1015-V1017 PolarHBondContact O-N 2.81Å; V1017-I1019 VanDerWaalsContact C-N 3.31Å; V1017-I1019 PolarHBondContact O-N 2.71Å; V1017-S1020 WeakPolarHBondContact CA-OG 3.43Å; V1017-S1020 PolarHBondContact O-N 2.93Å; V1017-S1020 PolarHBondContact O-OG 3.04Å; V1017-K1021 HydrophobicContact CG1-CD 3.98Å; V1017-K1021 HydrophobicContact CG1-CG 4.37Å; V1017-K1021 VanDerWaalsContact O-CB 3.3Å; V1017-K1021 WeakPolarHBondContact O-CB 3.47Å; V1017-K1021 WeakPolarHBondContact O-CG 3.36Å; V1017-K1021 PolarHBondContact O-N 3.39Å; V1017-L1039 HydrophobicContact CG2-CD1 4.19Å; V1017-L1039 HydrophobicContact CG2-CD2 4.13Å; V1017-W1057 HydrophobicContact CB-CZ3 4.24Å; V1017-W1057 HydrophobicContact CG1-CZ3 4.09Å; V1017-W1057 HydrophobicContact CG2-CE3 4.33Å; V1017-W1057 HydrophobicContact CG2-CZ3 3.97Å; V1017-H1061 HydrophobicContact CG2-CB 4.13Å
1018	G	91.3	Very high	88.2	Confident	48 Å²	48	56.8 Å²	56.8	50%	0.495	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-39.9	175.2	0	0	0	0	0	113	E1014 K1015 S1022	E1014-G1018 PolarHBondContact O-N 2.78Å; K1015-G1018 PolarHBondContact O-N 3.16Å; K1015-G1018 VanDerWaalsContact O-N 3.17Å; G1018-S1022 WeakPolarHBondContact O-CB 3.36Å; G1018-S1022 PolarHBondContact O-N 3.48Å
1019	I	91.7	Very high	87.9	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-69.4	-55.1	175.4	-64.5	161.4	0	0	0	110.9	L967 P968 V986 K1015 V1017 K1021 S1022 V1031 A1035	L967-I1019 HydrophobicContact CB-CD1 4.3Å; L967-I1019 HydrophobicContact CD2-CD1 4.11Å; P968-I1019 HydrophobicContact CG-CD1 3.82Å; P968-I1019 HydrophobicContact CG-CG1 3.86Å; V986-I1019 HydrophobicContact CG1-CD1 4.38Å; K1015-I1019 VanDerWaalsContact O-CG1 3.27Å; K1015-I1019 WeakPolarHBondContact O-CG1 3.34Å; K1015-I1019 PolarHBondContact O-N 3.42Å; V1017-I1019 VanDerWaalsContact C-N 3.31Å; V1017-I1019 PolarHBondContact O-N 2.71Å; I1019-K1021 VanDerWaalsContact C-N 3.26Å; I1019-K1021 PolarHBondContact O-N 2.91Å; I1019-S1022 WeakPolarHBondContact O-CB 3.33Å; I1019-S1022 PolarHBondContact O-N 3.25Å; I1019-S1022 VanDerWaalsContact O-N 3.08Å; I1019-S1022 PolarHBondContact O-OG 3.32Å; I1019-V1031 HydrophobicContact CG2-CG1 3.44Å; I1019-V1031 VanDerWaalsContact CG2-CG1 3.44Å; I1019-A1035 HydrophobicContact CB-CB 3.97Å; I1019-A1035 HydrophobicContact CG2-CB 3.58Å
1020	S	91.4	Very high	87.7	Confident	23 Å²	23	60.8 Å²	60.8	16%	0.161	35%	0.346	C	S	.	.	H	α-helix	trans	-68.7	-20.5	-174.8	57	0	0	0	0	114.3	L1016 V1017 S1036 L1039	L1016-S1020 VanDerWaalsContact O-CB 3.32Å; L1016-S1020 WeakPolarHBondContact O-CB 3.47Å; L1016-S1020 PolarHBondContact O-N 3.48Å; L1016-S1020 PolarHBondContact O-OG 3.5Å; V1017-S1020 WeakPolarHBondContact CA-OG 3.43Å; V1017-S1020 PolarHBondContact O-N 2.93Å; V1017-S1020 PolarHBondContact O-OG 3.04Å; S1020-S1036 WeakPolarHBondContact CB-OG 3.49Å; S1020-L1039 VanDerWaalsContact OG-CD1 3.23Å; S1020-L1039 WeakPolarHBondContact OG-CD1 3.34Å
1021	K	86.9	Confident	87.5	Confident	86 Å²	86	59.2 Å²	59.2	37%	0.374	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	12.1	172.4	-57.3	-169.2	179.4	-168.1	0	113.5	V1017 I1019 Y1060 H1061	V1017-K1021 HydrophobicContact CG1-CD 3.98Å; V1017-K1021 HydrophobicContact CG1-CG 4.37Å; V1017-K1021 VanDerWaalsContact O-CB 3.3Å; V1017-K1021 WeakPolarHBondContact O-CB 3.47Å; V1017-K1021 WeakPolarHBondContact O-CG 3.36Å; V1017-K1021 PolarHBondContact O-N 3.39Å; I1019-K1021 VanDerWaalsContact C-N 3.26Å; I1019-K1021 PolarHBondContact O-N 2.91Å; K1021-Y1060 VanDerWaalsContact CE-O 3.31Å; K1021-Y1060 WeakPolarHBondContact CE-O 3.43Å; K1021-Y1060 VanDerWaalsContact NZ-CE1 3.32Å; K1021-Y1060 PolarHBondContact NZ-O 3.11Å; K1021-H1061 PolarHBondContact NZ-CD2 3.33Å
1022	S	82.9	Confident	87.5	Confident	24 Å²	24	59.1 Å²	59.1	17%	0.168	33%	0.325	C	S	.	.	S	Bend	trans	-63.1	146.7	174.1	71.6	0	0	0	0	111	G1018 I1019	G1018-S1022 WeakPolarHBondContact O-CB 3.36Å; G1018-S1022 PolarHBondContact O-N 3.48Å; I1019-S1022 WeakPolarHBondContact O-CB 3.33Å; I1019-S1022 PolarHBondContact O-N 3.25Å; I1019-S1022 VanDerWaalsContact O-N 3.08Å; I1019-S1022 PolarHBondContact O-OG 3.32Å
1023	K	71.6	Confident	87.3	Confident	170 Å²	170	65 Å²	65	74%	0.739	35%	0.35	S	S	*	.			trans	-70	144.3	166.7	-63.7	-171.4	-176.1	-173	0	108.1	D1025 K1026	K1023-D1025 PolarHBondContact O-N 3.29Å; K1023-K1026 PolarHBondContact O-N 2.9Å
1024	G	63.5	Low	87.3	Confident	64 Å²	64	65.1 Å²	65.1	66%	0.66	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-15	-164.7	0	0	0	0	0	116.3	K1026	G1024-K1026 VanDerWaalsContact C-N 3.29Å; G1024-K1026 PolarHBondContact O-N 2.93Å
1025	D	63.8	Low	87.4	Confident	157 Å²	157	59.7 Å²	59.7	84%	0.84	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.7	177.9	-29.9	-75.2	0	0	0	113.3	K1023	K1023-D1025 PolarHBondContact O-N 3.29Å
1026	K	80.6	Confident	87.5	Confident	161 Å²	161	58.3 Å²	58.3	70%	0.7	32%	0.322	S	S	*	.	S	Bend	trans	-99	-32.3	-175.8	-70	-164.4	172.7	-166.1	0	115.3	K1023 G1024	K1023-K1026 PolarHBondContact O-N 2.9Å; G1024-K1026 VanDerWaalsContact C-N 3.29Å; G1024-K1026 PolarHBondContact O-N 2.93Å
1027	H	86	Confident	87.5	Confident	35 Å²	35	61.8 Å²	61.8	16%	0.162	34%	0.339	C	S	.	.	S	Bend	trans	-148.6	139.9	-178.7	-67.8	-54	0	0	0	109.2	D983 V1031 V1032	D983-H1027 IonicContact OD1-ND1 3.08Å; H1027-V1031 HydrophobicContact CB-CB 4.21Å; H1027-V1031 HydrophobicContact CB-CG1 3.88Å; H1027-V1032 HydrophobicContact CB-CG2 4.15Å
1028	S	90.6	Very high	87.7	Confident	37 Å²	37	61.1 Å²	61.1	26%	0.259	34%	0.335	S	S	.	.			trans	-62.4	156	177.1	64.4	0	0	0	0	112.4	D983 K1030 V1031 V1032	D983-S1028 WeakPolarHBondContact OD2-CA 3.44Å; D983-S1028 WeakPolarHBondContact OD2-CB 3.49Å; D983-S1028 PolarHBondContact OD2-N 3.01Å; D983-S1028 PolarHBondContact OD2-OG 3.37Å; S1028-K1030 PolarHBondContact O-N 3.29Å; S1028-V1031 PolarHBondContact O-N 3.13Å; S1028-V1031 VanDerWaalsContact O-N 3.07Å; S1028-V1032 WeakPolarHBondContact O-CG2 3.31Å; S1028-V1032 PolarHBondContact O-N 3.14Å
1029	P	90.3	Very high	88	Confident	109 Å²	109	58.9 Å²	58.9	71%	0.708	31%	0.311	S	S	*	.	H	α-helix	trans	-54.2	-25.9	173.3	-27.9	36	0	0	0	114.2	K1033	P1029-K1033 WeakPolarHBondContact O-CB 3.41Å; P1029-K1033 PolarHBondContact O-N 3.05Å
1030	K	91.8	Very high	88.1	Confident	113 Å²	113	61.4 Å²	61.4	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-63.8	-52.2	175.1	-177	-177.5	177.9	176.5	0	111.3	D984 T987 S1028 K1033 A1034	D984-K1030 IonicContact OD1-NZ 3.17Å; D984-K1030 PolarHBondContact OD1-NZ 3.09Å; T987-K1030 HydrophobicContact CG2-CD 4.49Å; T987-K1030 HydrophobicContact CG2-CG 4.1Å; S1028-K1030 PolarHBondContact O-N 3.29Å; K1030-K1033 PolarHBondContact O-N 3.37Å; K1030-A1034 WeakPolarHBondContact O-CB 3.4Å; K1030-A1034 PolarHBondContact O-N 2.93Å
1031	V	93	Very high	88.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.5	-45.8	176.3	165.5	0	0	0	0	111.3	D983 V986 T987 I1019 H1027 S1028 K1033 A1034 A1035	D983-V1031 HydrophobicContact CB-CG2 3.6Å; D983-V1031 VanDerWaalsContact CG-CG2 3.44Å; D983-V1031 WeakPolarHBondContact O-CG2 3.28Å; V986-V1031 HydrophobicContact CB-CG1 4.45Å; V986-V1031 HydrophobicContact CB-CG2 4.2Å; V986-V1031 HydrophobicContact CG1-CG1 3.74Å; V986-V1031 HydrophobicContact CG1-CG2 4.33Å; T987-V1031 VanDerWaalsContact OG1-CG2 3.3Å; T987-V1031 WeakPolarHBondContact OG1-CG2 3.42Å; I1019-V1031 HydrophobicContact CG2-CG1 3.44Å; I1019-V1031 VanDerWaalsContact CG2-CG1 3.44Å; H1027-V1031 HydrophobicContact CB-CB 4.21Å; H1027-V1031 HydrophobicContact CB-CG1 3.88Å; S1028-V1031 PolarHBondContact O-N 3.13Å; S1028-V1031 VanDerWaalsContact O-N 3.07Å; V1031-K1033 VanDerWaalsContact C-N 3.34Å; V1031-K1033 PolarHBondContact O-N 3.14Å; V1031-A1034 PolarHBondContact O-N 3.44Å; V1031-A1035 PolarHBondContact O-N 3.49Å
1032	V	93.1	Very high	88.8	Confident	36 Å²	36	56.6 Å²	56.6	22%	0.218	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-43.6	178.1	172.4	0	0	0	0	111.3	H1027 S1028 S1036	H1027-V1032 HydrophobicContact CB-CG2 4.15Å; S1028-V1032 WeakPolarHBondContact O-CG2 3.31Å; S1028-V1032 PolarHBondContact O-N 3.14Å; V1032-S1036 VanDerWaalsContact O-CB 3.31Å; V1032-S1036 WeakPolarHBondContact O-CB 3.31Å; V1032-S1036 PolarHBondContact O-N 2.84Å; V1032-S1036 PolarHBondContact O-OG 3.17Å
1033	K	92.9	Very high	89.4	Confident	122 Å²	122	56.4 Å²	56.4	53%	0.53	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-45.4	175.3	-176.9	178.1	178.6	-179.1	0	111.6	P1029 K1030 V1031 S1036 Q1037	P1029-K1033 WeakPolarHBondContact O-CB 3.41Å; P1029-K1033 PolarHBondContact O-N 3.05Å; K1030-K1033 PolarHBondContact O-N 3.37Å; V1031-K1033 VanDerWaalsContact C-N 3.34Å; V1031-K1033 PolarHBondContact O-N 3.14Å; K1033-S1036 PolarHBondContact O-N 3.32Å; K1033-Q1037 PolarHBondContact O-N 2.86Å
1034	A	95.3	Very high	90.5	Very high	7 Å²	7	54.6 Å²	54.6	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-46.6	-180	0	0	0	0	0	112.2	T987 C990 K1030 V1031 S1036 Q1037 V1038	T987-A1034 HydrophobicContact CG2-CB 4.13Å; C990-A1034 HydrophobicContact CB-CB 3.65Å; K1030-A1034 WeakPolarHBondContact O-CB 3.4Å; K1030-A1034 PolarHBondContact O-N 2.93Å; V1031-A1034 PolarHBondContact O-N 3.44Å; A1034-S1036 VanDerWaalsContact C-N 3.33Å; A1034-S1036 PolarHBondContact O-N 2.89Å; A1034-Q1037 WeakPolarHBondContact O-CB 3.4Å; A1034-Q1037 PolarHBondContact O-N 3.41Å; A1034-Q1037 VanDerWaalsContact O-N 3.12Å; A1034-V1038 PolarHBondContact O-N 2.9Å
1035	A	96	Very high	92.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-40.9	175.4	0	0	0	0	0	112.1	L1016 I1019 V1031 Q1037 V1038 L1039	L1016-A1035 HydrophobicContact CD2-CB 3.92Å; I1019-A1035 HydrophobicContact CB-CB 3.97Å; I1019-A1035 HydrophobicContact CG2-CB 3.58Å; V1031-A1035 PolarHBondContact O-N 3.49Å; A1035-Q1037 VanDerWaalsContact C-N 3.28Å; A1035-Q1037 PolarHBondContact O-N 3.2Å; A1035-V1038 PolarHBondContact O-N 2.96Å; A1035-L1039 WeakPolarHBondContact O-CG 3.43Å; A1035-L1039 PolarHBondContact O-N 3.47Å; A1035-L1039 VanDerWaalsContact O-N 3.14Å
1036	S	95.4	Very high	93.5	Very high	16 Å²	16	55.2 Å²	55.2	11%	0.112	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-32.4	174.2	-58.3	0	0	0	0	112.6	S1020 V1032 K1033 A1034 N1040	S1020-S1036 WeakPolarHBondContact CB-OG 3.49Å; V1032-S1036 VanDerWaalsContact O-CB 3.31Å; V1032-S1036 WeakPolarHBondContact O-CB 3.31Å; V1032-S1036 PolarHBondContact O-N 2.84Å; V1032-S1036 PolarHBondContact O-OG 3.17Å; K1033-S1036 PolarHBondContact O-N 3.32Å; A1034-S1036 VanDerWaalsContact C-N 3.33Å; A1034-S1036 PolarHBondContact O-N 2.89Å; S1036-N1040 WeakPolarHBondContact O-CB 3.44Å; S1036-N1040 PolarHBondContact O-N 3.48Å; S1036-N1040 PolarHBondContact O-ND2 3.3Å
1037	Q	95.7	Very high	94.3	Very high	73 Å²	73	53.1 Å²	53.1	34%	0.341	26%	0.259	S	S	.	.	H	α-helix	trans	-69.5	-43.4	177.7	-166.6	177.8	8.2	0	0	111.6	K1033 A1034 A1035 L1039 N1040 S1041	K1033-Q1037 PolarHBondContact O-N 2.86Å; A1034-Q1037 WeakPolarHBondContact O-CB 3.4Å; A1034-Q1037 PolarHBondContact O-N 3.41Å; A1034-Q1037 VanDerWaalsContact O-N 3.12Å; A1035-Q1037 VanDerWaalsContact C-N 3.28Å; A1035-Q1037 PolarHBondContact O-N 3.2Å; Q1037-L1039 VanDerWaalsContact C-N 3.35Å; Q1037-L1039 PolarHBondContact O-N 3.36Å; Q1037-N1040 PolarHBondContact O-N 3.01Å; Q1037-S1041 PolarHBondContact O-N 3.07Å; Q1037-S1041 VanDerWaalsContact O-N 3.1Å
1038	V	97.6	Very high	94.7	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-55.7	-51.7	172.2	-174.6	0	0	0	0	110.1	C990 L993 H994 I997 L1007 L1016 A1034 A1035 N1040 S1041 M1042	C990-V1038 HydrophobicContact CB-CG2 4.33Å; C990-V1038 WeakPolarHBondContact O-CG2 3.39Å; L993-V1038 HydrophobicContact CB-CG1 4.34Å; L993-V1038 HydrophobicContact CB-CG2 4.29Å; H994-V1038 HydrophobicContact CB-CG2 3.93Å; I997-V1038 HydrophobicContact CD1-CG1 3.75Å; I997-V1038 WeakPolarHBondContact CD1-O 3.46Å; L1007-V1038 HydrophobicContact CD2-CG1 3.61Å; L1016-V1038 HydrophobicContact CD1-CB 4.06Å; L1016-V1038 HydrophobicContact CD1-CG1 3.56Å; L1016-V1038 HydrophobicContact CD2-CB 4.23Å; L1016-V1038 HydrophobicContact CD2-CG1 4.47Å; L1016-V1038 HydrophobicContact CD2-CG2 4.3Å; A1034-V1038 PolarHBondContact O-N 2.9Å; A1035-V1038 PolarHBondContact O-N 2.96Å; V1038-N1040 PolarHBondContact O-N 3.44Å; V1038-S1041 PolarHBondContact O-N 3.14Å; V1038-M1042 WeakPolarHBondContact O-CG 3.33Å; V1038-M1042 PolarHBondContact O-N 3.42Å
1039	L	97.2	Very high	94.9	Very high	1 Å²	1	54 Å²	54	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-45.7	-178.8	-78	170.7	0	0	0	113.3	I1013 L1016 V1017 S1020 A1035 Q1037 S1041 M1042 W1043 F1062	I1013-L1039 HydrophobicContact CG2-CD2 4.34Å; L1016-L1039 HydrophobicContact CB-CD1 3.96Å; L1016-L1039 HydrophobicContact CB-CD2 3.95Å; L1016-L1039 HydrophobicContact CB-CG 3.82Å; V1017-L1039 HydrophobicContact CG2-CD1 4.19Å; V1017-L1039 HydrophobicContact CG2-CD2 4.13Å; S1020-L1039 VanDerWaalsContact OG-CD1 3.23Å; S1020-L1039 WeakPolarHBondContact OG-CD1 3.34Å; A1035-L1039 WeakPolarHBondContact O-CG 3.43Å; A1035-L1039 PolarHBondContact O-N 3.47Å; A1035-L1039 VanDerWaalsContact O-N 3.14Å; Q1037-L1039 VanDerWaalsContact C-N 3.35Å; Q1037-L1039 PolarHBondContact O-N 3.36Å; L1039-S1041 VanDerWaalsContact C-N 3.31Å; L1039-S1041 PolarHBondContact O-N 3.33Å; L1039-M1042 WeakPolarHBondContact O-CB 3.34Å; L1039-M1042 PolarHBondContact O-N 3.44Å; L1039-W1043 PolarHBondContact O-N 3.46Å; L1039-W1043 VanDerWaalsContact O-N 3.12Å; L1039-F1062 CarbonylContact C-O 3.52Å; L1039-F1062 HydrophobicContact CB-CB 4.48Å; L1039-F1062 HydrophobicContact CB-CD1 4.35Å; L1039-F1062 WeakPolarHBondContact CB-O 3.48Å; L1039-F1062 HydrophobicContact CD2-CD1 3.65Å; L1039-F1062 HydrophobicContact CD2-CE1 4.06Å; L1039-F1062 HydrophobicContact CD2-CG 4.46Å; L1039-F1062 WeakPolarHBondContact O-CD1 3.49Å
1040	N	95.2	Very high	95.1	Very high	55 Å²	55	52.9 Å²	52.9	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-43.4	175.4	-85.5	-73.1	0	0	0	111.4	S1036 Q1037 V1038 W1043 Q1044 F1062	S1036-N1040 WeakPolarHBondContact O-CB 3.44Å; S1036-N1040 PolarHBondContact O-N 3.48Å; S1036-N1040 PolarHBondContact O-ND2 3.3Å; Q1037-N1040 PolarHBondContact O-N 3.01Å; V1038-N1040 PolarHBondContact O-N 3.44Å; N1040-W1043 PolarHBondContact O-N 3.21Å; N1040-Q1044 PolarHBondContact O-N 3.26Å; N1040-F1062 PolarHBondContact N-O 2.98Å
1041	S	95.6	Very high	95.3	Very high	8 Å²	8	49.7 Å²	49.7	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-33.3	177.1	-75.4	0	0	0	0	113.3	H994 Q1037 V1038 L1039 W1043 Q1044	H994-S1041 PolarHBondContact CD2-OG 3.31Å; H994-S1041 WeakPolarHBondContact NE2-CB 3.47Å; H994-S1041 PolarHBondContact NE2-OG 2.87Å; Q1037-S1041 PolarHBondContact O-N 3.07Å; Q1037-S1041 VanDerWaalsContact O-N 3.1Å; V1038-S1041 PolarHBondContact O-N 3.14Å; L1039-S1041 VanDerWaalsContact C-N 3.31Å; L1039-S1041 PolarHBondContact O-N 3.33Å; S1041-W1043 VanDerWaalsContact C-N 3.34Å; S1041-W1043 PolarHBondContact O-N 3.35Å; S1041-Q1044 PolarHBondContact O-N 2.87Å
1042	M	96.9	Very high	95.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60	-43.7	169.5	-66.8	-177.6	83.5	0	0	111.6	I997 A1004 L1007 R1008 I1013 V1038 L1039 Q1044 Y1045 Y1052 F1062	I997-M1042 HydrophobicContact CD1-CG 3.48Å; I997-M1042 VanDerWaalsContact CD1-CG 3.48Å; A1004-M1042 WeakPolarHBondContact O-CE 3.35Å; L1007-M1042 HydrophobicContact CB-CE 4.18Å; L1007-M1042 HydrophobicContact CD2-CE 3.98Å; L1007-M1042 HydrophobicContact CD2-CG 4.18Å; L1007-M1042 HydrophobicContact CD2-SD 3.58Å; L1007-M1042 VanDerWaalsContact CD2-SD 3.58Å; L1007-M1042 HydrophobicContact CG-CE 3.92Å; L1007-M1042 HydrophobicContact CG-SD 4.06Å; R1008-M1042 HydrophobicContact CB-CE 4.26Å; I1013-M1042 HydrophobicContact CD1-CE 4Å; I1013-M1042 HydrophobicContact CG1-CE 3.62Å; I1013-M1042 HydrophobicContact CG1-SD 4.11Å; V1038-M1042 WeakPolarHBondContact O-CG 3.33Å; V1038-M1042 PolarHBondContact O-N 3.42Å; L1039-M1042 WeakPolarHBondContact O-CB 3.34Å; L1039-M1042 PolarHBondContact O-N 3.44Å; M1042-Q1044 PolarHBondContact O-N 3.07Å; M1042-Y1045 PolarHBondContact O-N 2.69Å; M1042-Y1052 HydrophobicContact CB-CE2 4.44Å; M1042-Y1052 HydrophobicContact CE-CE1 4.07Å; M1042-F1062 HydrophobicContact CB-CD1 3.99Å; M1042-F1062 HydrophobicContact CB-CE1 3.99Å; M1042-F1062 HydrophobicContact SD-CE1 4.22Å
1043	W	95.4	Very high	95.4	Very high	20 Å²	20	54.6 Å²	54.6	8%	0.076	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-16.8	-178.4	-164.3	-109.8	0	0	0	114.3	L1039 N1040 S1041 Y1045 R1049 Y1052 Q1059 F1062 V1063	L1039-W1043 PolarHBondContact O-N 3.46Å; L1039-W1043 VanDerWaalsContact O-N 3.12Å; N1040-W1043 PolarHBondContact O-N 3.21Å; S1041-W1043 VanDerWaalsContact C-N 3.34Å; S1041-W1043 PolarHBondContact O-N 3.35Å; W1043-Y1045 VanDerWaalsContact C-N 3.27Å; W1043-Y1045 PolarHBondContact O-N 2.95Å; W1043-R1049 HydrophobicContact CD2-CG 4.25Å; W1043-R1049 HydrophobicContact CE3-CG 4.16Å; W1043-R1049 HydrophobicContact CH2-CB 4.35Å; W1043-R1049 HydrophobicContact CH2-CG 4.25Å; W1043-R1049 HydrophobicContact CZ2-CG 4.3Å; W1043-R1049 HydrophobicContact CZ3-CB 4.41Å; W1043-R1049 HydrophobicContact CZ3-CG 4.17Å; W1043-R1049 PolarHBondContact O-NE 3.11Å; W1043-R1049 PolarHBondContact O-NH2 2.69Å; W1043-Y1052 AromaticContact CE3-CD2 3.99Å; W1043-Y1052 HydrophobicContact CE3-CD2 3.99Å; W1043-Y1052 HydrophobicContact CZ3-CD2 4.13Å; W1043-Q1059 HydrophobicContact CH2-CB 4.19Å; W1043-Q1059 HydrophobicContact CZ2-CB 3.54Å; W1043-Q1059 HydrophobicContact CZ2-CG 4.08Å; W1043-F1062 HydrophobicContact CB-CB 3.67Å; W1043-F1062 HydrophobicContact CB-CG 4.17Å; W1043-F1062 HydrophobicContact CD2-CB 4.24Å; W1043-F1062 HydrophobicContact CD2-CD2 4.16Å; W1043-F1062 HydrophobicContact CD2-CG 4.37Å; W1043-F1062 HydrophobicContact CE3-CB 4.13Å; W1043-F1062 AromaticContact CE3-CD2 3.26Å; W1043-F1062 HydrophobicContact CE3-CD2 3.26Å; W1043-F1062 AromaticContact CE3-CE2 3.67Å; W1043-F1062 HydrophobicContact CE3-CE2 3.67Å; W1043-F1062 AromaticContact CE3-CG 3.78Å; W1043-F1062 HydrophobicContact CE3-CG 3.78Å; W1043-F1062 HydrophobicContact CE3-CZ 4.48Å; W1043-F1062 HydrophobicContact CG-CB 4.09Å; W1043-F1062 AromaticContact CZ3-CD2 3.63Å; W1043-F1062 HydrophobicContact CZ3-CD2 3.63Å; W1043-F1062 AromaticContact CZ3-CE2 3.75Å; W1043-F1062 HydrophobicContact CZ3-CE2 3.75Å; W1043-V1063 HydrophobicContact CG-CG2 4.26Å
1044	Q	94.9	Very high	95.5	Very high	133 Å²	133	57.1 Å²	57.1	62%	0.621	27%	0.268	S	S	*	.	H	α-helix	trans	-64.5	-32.7	176.3	-68.6	177.1	18.1	0	0	112	N1040 S1041 M1042 R1046	N1040-Q1044 PolarHBondContact O-N 3.26Å; S1041-Q1044 PolarHBondContact O-N 2.87Å; M1042-Q1044 PolarHBondContact O-N 3.07Å; Q1044-R1046 PolarHBondContact O-N 3.47Å
1045	Y	96.1	Very high	95.4	Very high	39 Å²	39	59.9 Å²	59.9	15%	0.153	28%	0.283	C	S	.	.			trans	-68.7	97.7	176.6	-62.3	-67.5	0	0	0	111.6	I997 K999 N1000 M1001 A1004 M1042 W1043 D1047 L1048	I997-Y1045 PolarHBondContact O-OH 2.76Å; K999-Y1045 WeakPolarHBondContact CA-OH 3.34Å; K999-Y1045 PolarHBondContact N-OH 2.88Å; N1000-Y1045 PolarHBondContact N-OH 3.31Å; M1001-Y1045 HydrophobicContact CB-CD1 3.69Å; M1001-Y1045 HydrophobicContact CB-CE1 3.77Å; M1001-Y1045 HydrophobicContact CB-CG 4.31Å; M1001-Y1045 HydrophobicContact CG-CD1 3.74Å; M1001-Y1045 HydrophobicContact CG-CE1 4.32Å; M1001-Y1045 HydrophobicContact CG-CG 3.97Å; M1001-Y1045 HydrophobicContact SD-CD1 4.09Å; M1001-Y1045 HydrophobicContact SD-CG 4.46Å; A1004-Y1045 HydrophobicContact CB-CD2 3.59Å; A1004-Y1045 HydrophobicContact CB-CE2 3.5Å; A1004-Y1045 VanDerWaalsContact CB-CE2 3.5Å; M1042-Y1045 PolarHBondContact O-N 2.69Å; W1043-Y1045 VanDerWaalsContact C-N 3.27Å; W1043-Y1045 PolarHBondContact O-N 2.95Å; Y1045-D1047 PolarHBondContact O-N 3.24Å; Y1045-L1048 HydrophobicContact CD2-CD1 4.39Å; Y1045-L1048 HydrophobicContact CG-CD1 4.33Å; Y1045-L1048 PolarHBondContact O-N 3.35Å
1046	R	94.8	Very high	95.3	Very high	194 Å²	194	63 Å²	63	73%	0.732	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-55.3	-39.6	-177.6	-62.5	-177	73	163.3	2	112.2	Q1044 L1048 R1049	Q1044-R1046 PolarHBondContact O-N 3.47Å; R1046-L1048 PolarHBondContact O-N 3.15Å; R1046-R1049 WeakPolarHBondContact O-CB 3.47Å; R1046-R1049 PolarHBondContact O-N 2.92Å
1047	D	95.7	Very high	95.3	Very high	117 Å²	117	64.9 Å²	64.9	63%	0.626	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-74.1	-26.7	-172.6	-47.5	-41.5	0	0	0	112.6	M1001 Y1045 S1050	M1001-D1047 HydrophobicContact SD-CB 4.08Å; Y1045-D1047 PolarHBondContact O-N 3.24Å; D1047-S1050 PolarHBondContact O-OG 3.39Å; D1047-S1050 VanDerWaalsContact O-OG 3.12Å
1048	L	95.7	Very high	95.1	Very high	13 Å²	13	63.8 Å²	63.8	7%	0.068	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-80.1	-14.7	174.5	-60.3	-175.8	0	0	0	113.1	M1001 A1004 K1005 Y1045 R1046 S1050 L1051 Y1052	M1001-L1048 HydrophobicContact CG-CD1 3.72Å; M1001-L1048 HydrophobicContact CG-CD2 4.19Å; M1001-L1048 HydrophobicContact CG-CG 3.82Å; M1001-L1048 HydrophobicContact SD-CD2 4.45Å; M1001-L1048 HydrophobicContact SD-CG 4.11Å; A1004-L1048 HydrophobicContact CB-CD1 3.82Å; K1005-L1048 HydrophobicContact CB-CD1 4.34Å; K1005-L1048 HydrophobicContact CB-CD2 4.17Å; K1005-L1048 HydrophobicContact CG-CD2 4.37Å; Y1045-L1048 HydrophobicContact CD2-CD1 4.39Å; Y1045-L1048 HydrophobicContact CG-CD1 4.33Å; Y1045-L1048 PolarHBondContact O-N 3.35Å; R1046-L1048 PolarHBondContact O-N 3.15Å; L1048-S1050 VanDerWaalsContact C-N 3.29Å; L1048-S1050 PolarHBondContact O-N 3.27Å; L1048-L1051 WeakPolarHBondContact O-CB 3.26Å; L1048-L1051 PolarHBondContact O-N 2.97Å; L1048-L1051 VanDerWaalsContact O-N 3.07Å; L1048-Y1052 HydrophobicContact CB-CD2 4.26Å; L1048-Y1052 HydrophobicContact CB-CE1 4.21Å; L1048-Y1052 HydrophobicContact CB-CE2 3.61Å; L1048-Y1052 VanDerWaalsContact CD1-OH 3.28Å; L1048-Y1052 WeakPolarHBondContact CD1-OH 3.41Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.4Å; L1048-Y1052 VanDerWaalsContact O-CG 3.3Å; L1048-Y1052 PolarHBondContact O-N 2.91Å
1049	R	94.9	Very high	94.8	Very high	78 Å²	78	69 Å²	69	29%	0.294	34%	0.344	S	S	.	.	H	α-helix	trans	-64.7	-29.1	-177.9	-63	178.9	-174.6	169.7	3	113.8	W1043 R1046 K1053	W1043-R1049 HydrophobicContact CD2-CG 4.25Å; W1043-R1049 HydrophobicContact CE3-CG 4.16Å; W1043-R1049 HydrophobicContact CH2-CB 4.35Å; W1043-R1049 HydrophobicContact CH2-CG 4.25Å; W1043-R1049 HydrophobicContact CZ2-CG 4.3Å; W1043-R1049 HydrophobicContact CZ3-CB 4.41Å; W1043-R1049 HydrophobicContact CZ3-CG 4.17Å; W1043-R1049 PolarHBondContact O-NE 3.11Å; W1043-R1049 PolarHBondContact O-NH2 2.69Å; R1046-R1049 WeakPolarHBondContact O-CB 3.47Å; R1046-R1049 PolarHBondContact O-N 2.92Å; R1049-K1053 WeakPolarHBondContact O-CB 3.33Å; R1049-K1053 VanDerWaalsContact O-CG 3.26Å; R1049-K1053 WeakPolarHBondContact O-CG 3.39Å; R1049-K1053 PolarHBondContact O-N 3.24Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å
1050	S	94.6	Very high	94.4	Very high	85 Å²	85	76 Å²	76	59%	0.594	37%	0.371	S	S	*	.	H	α-helix	trans	-66.8	-41.6	173.1	54.7	0	0	0	0	111	D1047 L1048 K1053 K1054	D1047-S1050 PolarHBondContact O-OG 3.39Å; D1047-S1050 VanDerWaalsContact O-OG 3.12Å; L1048-S1050 VanDerWaalsContact C-N 3.29Å; L1048-S1050 PolarHBondContact O-N 3.27Å; S1050-K1053 PolarHBondContact O-N 3.49Å; S1050-K1054 PolarHBondContact O-N 3.23Å
1051	L	94.4	Very high	94.2	Very high	47 Å²	47	75.6 Å²	75.6	25%	0.246	37%	0.367	C	S	.	.	H	α-helix	trans	-70.2	-45.1	178.8	-162.9	63	0	0	0	111.3	K1005 R1008 L1048 K1053 K1054 D1055	K1005-L1051 HydrophobicContact CG-CD2 4.47Å; R1008-L1051 VanDerWaalsContact CZ-CD2 3.47Å; L1048-L1051 WeakPolarHBondContact O-CB 3.26Å; L1048-L1051 PolarHBondContact O-N 2.97Å; L1048-L1051 VanDerWaalsContact O-N 3.07Å; L1051-K1053 VanDerWaalsContact C-N 3.29Å; L1051-K1053 PolarHBondContact O-N 3.28Å; L1051-K1054 WeakPolarHBondContact O-CB 3.38Å; L1051-K1054 PolarHBondContact O-N 2.97Å; L1051-K1054 VanDerWaalsContact O-N 3.11Å; L1051-D1055 VanDerWaalsContact O-CG 3.31Å; L1051-D1055 PolarHBondContact O-N 3.23Å
1052	Y	95.6	Very high	94	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-56.4	-42.1	172.4	-60	-34.4	0	0	0	112.3	R1008 I1013 M1042 W1043 L1048 D1055 G1056 W1057 F1062	R1008-Y1052 HydrophobicContact CB-CE1 4.13Å; R1008-Y1052 HydrophobicContact CG-CD1 4.38Å; R1008-Y1052 HydrophobicContact CG-CE1 4.22Å; I1013-Y1052 HydrophobicContact CD1-CD1 3.8Å; I1013-Y1052 HydrophobicContact CD1-CE1 3.89Å; M1042-Y1052 HydrophobicContact CB-CE2 4.44Å; M1042-Y1052 HydrophobicContact CE-CE1 4.07Å; W1043-Y1052 AromaticContact CE3-CD2 3.99Å; W1043-Y1052 HydrophobicContact CE3-CD2 3.99Å; W1043-Y1052 HydrophobicContact CZ3-CD2 4.13Å; L1048-Y1052 HydrophobicContact CB-CD2 4.26Å; L1048-Y1052 HydrophobicContact CB-CE1 4.21Å; L1048-Y1052 HydrophobicContact CB-CE2 3.61Å; L1048-Y1052 VanDerWaalsContact CD1-OH 3.28Å; L1048-Y1052 WeakPolarHBondContact CD1-OH 3.41Å; L1048-Y1052 WeakPolarHBondContact O-CD2 3.4Å; L1048-Y1052 VanDerWaalsContact O-CG 3.3Å; L1048-Y1052 PolarHBondContact O-N 2.91Å; Y1052-D1055 CarbonylContact O-C 3.59Å; Y1052-D1055 PolarHBondContact O-N 3.43Å; Y1052-G1056 PolarHBondContact O-N 2.95Å; Y1052-W1057 WeakPolarHBondContact O-CA 3.45Å; Y1052-W1057 WeakPolarHBondContact O-CB 3.44Å; Y1052-W1057 PolarHBondContact O-N 3.21Å; Y1052-F1062 HydrophobicContact CD1-CE1 4.49Å; Y1052-F1062 AromaticContact CD1-CZ 3.81Å; Y1052-F1062 HydrophobicContact CD1-CZ 3.81Å; Y1052-F1062 HydrophobicContact CD2-CE1 4.29Å; Y1052-F1062 HydrophobicContact CD2-CE2 4.05Å; Y1052-F1062 AromaticContact CD2-CZ 3.71Å; Y1052-F1062 HydrophobicContact CD2-CZ 3.71Å; Y1052-F1062 HydrophobicContact CE1-CZ 4.27Å; Y1052-F1062 HydrophobicContact CE2-CE1 4.31Å; Y1052-F1062 HydrophobicContact CE2-CZ 4.17Å; Y1052-F1062 HydrophobicContact CG-CE1 4.41Å; Y1052-F1062 AromaticContact CG-CE2 3.98Å; Y1052-F1062 HydrophobicContact CG-CE2 3.98Å; Y1052-F1062 AromaticContact CG-CZ 3.54Å; Y1052-F1062 HydrophobicContact CG-CZ 3.54Å
1053	K	94.5	Very high	93.1	Very high	139 Å²	139	77.4 Å²	77.4	60%	0.604	38%	0.378	S	S	*	.	H	α-helix	trans	-66.8	-36.6	175.4	-76.2	176	178	-171.5	0	113.5	R1049 S1050 L1051 D1055 G1056 W1057	R1049-K1053 WeakPolarHBondContact O-CB 3.33Å; R1049-K1053 VanDerWaalsContact O-CG 3.26Å; R1049-K1053 WeakPolarHBondContact O-CG 3.39Å; R1049-K1053 PolarHBondContact O-N 3.24Å; R1049-K1053 VanDerWaalsContact O-N 3.14Å; S1050-K1053 PolarHBondContact O-N 3.49Å; L1051-K1053 VanDerWaalsContact C-N 3.29Å; L1051-K1053 PolarHBondContact O-N 3.28Å; K1053-D1055 VanDerWaalsContact C-N 3.25Å; K1053-D1055 PolarHBondContact O-N 3.16Å; K1053-G1056 PolarHBondContact O-N 3.02Å; K1053-W1057 WeakPolarHBondContact CA-O 3.37Å
1054	K	94.7	Very high	91.7	Very high	174 Å²	174	78.6 Å²	78.6	76%	0.757	39%	0.392	S	S	*	.	H	α-helix	trans	-61.8	-38.6	173.9	-172.6	-171.6	175.7	-171.3	0	111	S1050 L1051 G1056	S1050-K1054 PolarHBondContact O-N 3.23Å; L1051-K1054 WeakPolarHBondContact O-CB 3.38Å; L1051-K1054 PolarHBondContact O-N 2.97Å; L1051-K1054 VanDerWaalsContact O-N 3.11Å; K1054-G1056 PolarHBondContact O-N 3.28Å
1055	D	93.2	Very high	89.6	Confident	66 Å²	66	75.8 Å²	75.8	35%	0.353	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	15.9	178.3	-56.5	-13.3	0	0	0	112.7	R1008 L1051 Y1052 K1053 W1057	R1008-D1055 WeakPolarHBondContact CD-OD2 3.49Å; R1008-D1055 IonicContact CZ-OD2 3.59Å; R1008-D1055 IonicContact NE-OD2 3.56Å; R1008-D1055 PolarHBondContact NE-OD2 3.04Å; R1008-D1055 IonicContact NH2-OD2 3.35Å; L1051-D1055 VanDerWaalsContact O-CG 3.31Å; L1051-D1055 PolarHBondContact O-N 3.23Å; Y1052-D1055 CarbonylContact O-C 3.59Å; Y1052-D1055 PolarHBondContact O-N 3.43Å; K1053-D1055 VanDerWaalsContact C-N 3.25Å; K1053-D1055 PolarHBondContact O-N 3.16Å; D1055-W1057 VanDerWaalsContact C-N 3.35Å; D1055-W1057 PolarHBondContact O-N 2.91Å; D1055-W1057 PolarHBondContact O-NE1 2.89Å
1056	G	93.9	Very high	87	Confident	64 Å²	64	79.4 Å²	79.4	66%	0.66	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-7.5	175.9	0	0	0	0	0	116.1	Y1052 K1053 K1054	Y1052-G1056 PolarHBondContact O-N 2.95Å; K1053-G1056 PolarHBondContact O-N 3.02Å; K1054-G1056 PolarHBondContact O-N 3.28Å
1057	W	94.3	Very high	84.4	Confident	57 Å²	57	73 Å²	73	22%	0.216	40%	0.403	C	S	.	.			trans	-83.9	146.3	-174.9	-53.8	103.1	0	0	0	113.3	I1013 E1014 V1017 Y1052 K1053 D1055 H1061 F1062	I1013-W1057 HydrophobicContact CB-CZ2 4.42Å; I1013-W1057 HydrophobicContact CG2-CD2 3.66Å; I1013-W1057 HydrophobicContact CG2-CE3 4.1Å; I1013-W1057 HydrophobicContact CG2-CG 4.05Å; I1013-W1057 HydrophobicContact CG2-CH2 4.37Å; I1013-W1057 HydrophobicContact CG2-CZ2 3.97Å; I1013-W1057 HydrophobicContact CG2-CZ3 4.44Å; E1014-W1057 HydrophobicContact CB-CH2 4.25Å; E1014-W1057 HydrophobicContact CB-CZ2 4.13Å; E1014-W1057 HydrophobicContact CG-CH2 4.45Å; V1017-W1057 HydrophobicContact CB-CZ3 4.24Å; V1017-W1057 HydrophobicContact CG1-CZ3 4.09Å; V1017-W1057 HydrophobicContact CG2-CE3 4.33Å; V1017-W1057 HydrophobicContact CG2-CZ3 3.97Å; Y1052-W1057 WeakPolarHBondContact O-CA 3.45Å; Y1052-W1057 WeakPolarHBondContact O-CB 3.44Å; Y1052-W1057 PolarHBondContact O-N 3.21Å; K1053-W1057 WeakPolarHBondContact CA-O 3.37Å; D1055-W1057 VanDerWaalsContact C-N 3.35Å; D1055-W1057 PolarHBondContact O-N 2.91Å; D1055-W1057 PolarHBondContact O-NE1 2.89Å; W1057-H1061 HydrophobicContact CE3-CB 3.85Å; W1057-H1061 AromaticContact CE3-CD2 3.76Å; W1057-H1061 AromaticContact CE3-CG 3.7Å; W1057-H1061 AromaticContact CZ3-CD2 3.84Å; W1057-F1062 HydrophobicContact CB-CE2 3.63Å; W1057-F1062 HydrophobicContact CB-CZ 4.1Å; W1057-F1062 HydrophobicContact CG-CE2 4.44Å; W1057-F1062 HydrophobicContact CG-CZ 4.5Å
1058	S	92.1	Very high	81.7	Confident	49 Å²	49	71.4 Å²	71.4	34%	0.343	40%	0.397	S	S	.	.			trans	-129.8	169.4	-178.1	72	0	0	0	0	111.6	Y1060 H1061 F1062	S1058-Y1060 PolarHBondContact O-N 3.24Å; S1058-Y1060 VanDerWaalsContact O-N 3.09Å; S1058-H1061 PolarHBondContact N-ND1 3.42Å; S1058-H1061 WeakPolarHBondContact O-CB 3.44Å; S1058-H1061 PolarHBondContact O-N 3.18Å; S1058-H1061 PolarHBondContact OG-CE1 3.36Å; S1058-H1061 PolarHBondContact OG-ND1 3.24Å; S1058-F1062 WeakPolarHBondContact O-CD2 3.43Å
1059	Q	90.7	Very high	79.2	Confident	111 Å²	111	78.1 Å²	78.1	52%	0.519	43%	0.432	S	S	.	.	H	α-helix	trans	-53.2	-36.2	-178.7	-175.5	161.9	-34	0	0	113.1	W1043 H1061 F1062 V1063	W1043-Q1059 HydrophobicContact CH2-CB 4.19Å; W1043-Q1059 HydrophobicContact CZ2-CB 3.54Å; W1043-Q1059 HydrophobicContact CZ2-CG 4.08Å; Q1059-H1061 PolarHBondContact O-N 3.46Å; Q1059-H1061 VanDerWaalsContact O-N 3.1Å; Q1059-F1062 PolarHBondContact O-N 3.48Å; Q1059-V1063 HydrophobicContact CG-CB 4.08Å; Q1059-V1063 HydrophobicContact CG-CG2 3.78Å; Q1059-V1063 PolarHBondContact O-N 3.03Å
1060	Y	89.4	Confident	76.6	Confident	147 Å²	147	80.7 Å²	80.7	58%	0.576	45%	0.447	S	S	*	.	H	α-helix	trans	-62.5	-11.2	175.8	178.4	-115	0	0	0	114.5	K1021 S1058	K1021-Y1060 VanDerWaalsContact CE-O 3.31Å; K1021-Y1060 WeakPolarHBondContact CE-O 3.43Å; K1021-Y1060 VanDerWaalsContact NZ-CE1 3.32Å; K1021-Y1060 PolarHBondContact NZ-O 3.11Å; S1058-Y1060 PolarHBondContact O-N 3.24Å; S1058-Y1060 VanDerWaalsContact O-N 3.09Å
1061	H	91.2	Very high	73.6	Confident	46 Å²	46	84 Å²	84	21%	0.213	45%	0.447	C	S	.	.	H	α-helix	trans	-93.7	-25.4	174.7	-64.8	87.4	0	0	0	112.7	V1017 K1021 W1057 S1058 Q1059	V1017-H1061 HydrophobicContact CG2-CB 4.13Å; K1021-H1061 PolarHBondContact NZ-CD2 3.33Å; W1057-H1061 HydrophobicContact CE3-CB 3.85Å; W1057-H1061 AromaticContact CE3-CD2 3.76Å; W1057-H1061 AromaticContact CE3-CG 3.7Å; W1057-H1061 AromaticContact CZ3-CD2 3.84Å; S1058-H1061 PolarHBondContact N-ND1 3.42Å; S1058-H1061 WeakPolarHBondContact O-CB 3.44Å; S1058-H1061 PolarHBondContact O-N 3.18Å; S1058-H1061 PolarHBondContact OG-CE1 3.36Å; S1058-H1061 PolarHBondContact OG-ND1 3.24Å; Q1059-H1061 PolarHBondContact O-N 3.46Å; Q1059-H1061 VanDerWaalsContact O-N 3.1Å
1062	F	90.1	Very high	70.8	Confident	1 Å²	1	87.9 Å²	87.9	0%	0.004	47%	0.468	C	S	.	.	H	α-helix	trans	-105.3	-37.2	-177.2	-63.8	-90	0	0	0	114	I1013 L1039 N1040 M1042 W1043 Y1052 W1057 S1058 Q1059	I1013-F1062 HydrophobicContact CD1-CE1 4.13Å; I1013-F1062 HydrophobicContact CD1-CZ 3.92Å; I1013-F1062 HydrophobicContact CG1-CE1 4.2Å; I1013-F1062 HydrophobicContact CG1-CZ 4.42Å; I1013-F1062 HydrophobicContact CG2-CE1 4.1Å; I1013-F1062 HydrophobicContact CG2-CZ 4.06Å; L1039-F1062 CarbonylContact C-O 3.52Å; L1039-F1062 HydrophobicContact CB-CB 4.48Å; L1039-F1062 HydrophobicContact CB-CD1 4.35Å; L1039-F1062 WeakPolarHBondContact CB-O 3.48Å; L1039-F1062 HydrophobicContact CD2-CD1 3.65Å; L1039-F1062 HydrophobicContact CD2-CE1 4.06Å; L1039-F1062 HydrophobicContact CD2-CG 4.46Å; L1039-F1062 WeakPolarHBondContact O-CD1 3.49Å; N1040-F1062 PolarHBondContact N-O 2.98Å; M1042-F1062 HydrophobicContact CB-CD1 3.99Å; M1042-F1062 HydrophobicContact CB-CE1 3.99Å; M1042-F1062 HydrophobicContact SD-CE1 4.22Å; W1043-F1062 HydrophobicContact CB-CB 3.67Å; W1043-F1062 HydrophobicContact CB-CG 4.17Å; W1043-F1062 HydrophobicContact CD2-CB 4.24Å; W1043-F1062 HydrophobicContact CD2-CD2 4.16Å; W1043-F1062 HydrophobicContact CD2-CG 4.37Å; W1043-F1062 HydrophobicContact CE3-CB 4.13Å; W1043-F1062 AromaticContact CE3-CD2 3.26Å; W1043-F1062 HydrophobicContact CE3-CD2 3.26Å; W1043-F1062 AromaticContact CE3-CE2 3.67Å; W1043-F1062 HydrophobicContact CE3-CE2 3.67Å; W1043-F1062 AromaticContact CE3-CG 3.78Å; W1043-F1062 HydrophobicContact CE3-CG 3.78Å; W1043-F1062 HydrophobicContact CE3-CZ 4.48Å; W1043-F1062 HydrophobicContact CG-CB 4.09Å; W1043-F1062 AromaticContact CZ3-CD2 3.63Å; W1043-F1062 HydrophobicContact CZ3-CD2 3.63Å; W1043-F1062 AromaticContact CZ3-CE2 3.75Å; W1043-F1062 HydrophobicContact CZ3-CE2 3.75Å; Y1052-F1062 HydrophobicContact CD1-CE1 4.49Å; Y1052-F1062 AromaticContact CD1-CZ 3.81Å; Y1052-F1062 HydrophobicContact CD1-CZ 3.81Å; Y1052-F1062 HydrophobicContact CD2-CE1 4.29Å; Y1052-F1062 HydrophobicContact CD2-CE2 4.05Å; Y1052-F1062 AromaticContact CD2-CZ 3.71Å; Y1052-F1062 HydrophobicContact CD2-CZ 3.71Å; Y1052-F1062 HydrophobicContact CE1-CZ 4.27Å; Y1052-F1062 HydrophobicContact CE2-CE1 4.31Å; Y1052-F1062 HydrophobicContact CE2-CZ 4.17Å; Y1052-F1062 HydrophobicContact CG-CE1 4.41Å; Y1052-F1062 AromaticContact CG-CE2 3.98Å; Y1052-F1062 HydrophobicContact CG-CE2 3.98Å; Y1052-F1062 AromaticContact CG-CZ 3.54Å; Y1052-F1062 HydrophobicContact CG-CZ 3.54Å; W1057-F1062 HydrophobicContact CB-CE2 3.63Å; W1057-F1062 HydrophobicContact CB-CZ 4.1Å; W1057-F1062 HydrophobicContact CG-CE2 4.44Å; W1057-F1062 HydrophobicContact CG-CZ 4.5Å; S1058-F1062 WeakPolarHBondContact O-CD2 3.43Å; Q1059-F1062 PolarHBondContact O-N 3.48Å
1063	V	79.6	Confident	68.2	Low	45 Å²	45	99.1 Å²	99.1	27%	0.273	51%	0.51	S	S	.	.	S	Bend	trans	-96.6	104.3	177.1	-177.2	0	0	0	0	107.1	W1043 Q1059	W1043-V1063 HydrophobicContact CG-CG2 4.26Å; Q1059-V1063 HydrophobicContact CG-CB 4.08Å; Q1059-V1063 HydrophobicContact CG-CG2 3.78Å; Q1059-V1063 PolarHBondContact O-N 3.03Å
1064	A	65.1	Low	65.1	Low	46 Å²	46	100.1 Å²	100.1	38%	0.38	52%	0.517	S	S	.	.			trans	-56.9	139.9	170.4	0	0	0	0	0	110.1	S1066	A1064-S1066 VanDerWaalsContact C-N 3.33Å; A1064-S1066 PolarHBondContact O-N 3.15Å
1065	S	51.4	Low	62.2	Low	74 Å²	74	102.1 Å²	102.1	52%	0.517	52%	0.52	S	S	.	.			trans	-72	85.1	-180	-63.2	0	0	0	0	111.2	S1067	S1065-S1067 PolarHBondContact O-N 3.19Å
1066	S	40.9	Very low	59.4	Low	115 Å²	115	104.9 Å²	104.9	80%	0.804	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	79.6	171.3	-59	0	0	0	0	111.2	A1064	A1064-S1066 VanDerWaalsContact C-N 3.33Å; A1064-S1066 PolarHBondContact O-N 3.15Å
1067	S	39.9	Very low	56.4	Low	58 Å²	58	110 Å²	110	41%	0.406	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	165.6	40.1	152.8	52.7	0	0	0	0	115.5	S1065 R1071	S1065-S1067 PolarHBondContact O-N 3.19Å; S1067-R1071 VanDerWaalsContact O-CD 3.23Å; S1067-R1071 WeakPolarHBondContact O-CD 3.45Å; S1067-R1071 WeakPolarHBondContact O-CG 3.28Å; S1067-R1071 PolarHBondContact O-NH1 3.26Å; S1067-R1071 PolarHBondContact OG-NH1 2.92Å
1068	T	40.5	Very low	53.3	Low	84 Å²	84	113.3 Å²	113.3	52%	0.515	57%	0.574	S	S	.	*	S	Bend	trans	-115.2	-41.8	169.5	49.9	0	0	0	0	114.4	E1070 R1071 D1072	T1068-E1070 PolarHBondContact O-N 3.02Å; T1068-R1071 PolarHBondContact O-N 3.1Å; T1068-D1072 PolarHBondContact O-N 2.61Å
1069	I	43	Very low	50.6	Low	154 Å²	154	115.6 Å²	115.6	79%	0.79	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-24.4	-173.4	-154.8	70.6	0	0	0	114.5
1070	E	38.6	Very low	47.8	Very low	133 Å²	133	115.6 Å²	115.6	62%	0.621	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-24.7	172.8	-66.8	-177.8	132.6	0	0	113.5	T1068 R1073	T1068-E1070 PolarHBondContact O-N 3.02Å; E1070-R1073 PolarHBondContact O-N 3.49Å
1071	R	33.5	Very low	45	Very low	155 Å²	155	120.4 Å²	120.4	59%	0.585	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-38.1	-178.1	-72.2	-168.1	179.3	125.5	-2.6	112.4	S1067 T1068 R1073 Q1074	S1067-R1071 VanDerWaalsContact O-CD 3.23Å; S1067-R1071 WeakPolarHBondContact O-CD 3.45Å; S1067-R1071 WeakPolarHBondContact O-CG 3.28Å; S1067-R1071 PolarHBondContact O-NH1 3.26Å; S1067-R1071 PolarHBondContact OG-NH1 2.92Å; T1068-R1071 PolarHBondContact O-N 3.1Å; R1071-R1073 PolarHBondContact O-N 3.44Å; R1071-Q1074 PolarHBondContact O-N 2.86Å
1072	D	34.9	Very low	42.1	Very low	128 Å²	128	124.6 Å²	124.6	68%	0.684	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-11.3	176.9	-70.2	-28.3	0	0	0	112.9	T1068	T1068-D1072 PolarHBondContact O-N 2.61Å
1073	R	40	Very low	40.2	Very low	235 Å²	235	130.6 Å²	130.6	89%	0.887	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	2.8	168	-102.9	-179	170.9	-179.8	-3.2	114.2	E1070 R1071	E1070-R1073 PolarHBondContact O-N 3.49Å; R1071-R1073 PolarHBondContact O-N 3.44Å
1074	Q	30.3	Very low	37.6	Very low	161 Å²	161	133.5 Å²	133.5	75%	0.752	71%	0.71	S	S	*	*			trans	-128.6	41.8	-179.4	-67.2	-168.4	-5.4	0	0	113.5	R1071	R1071-Q1074 PolarHBondContact O-N 2.86Å
1075	R	33.2	Very low	35.9	Very low	216 Å²	216	139 Å²	139	82%	0.815	73%	0.731	S	S	*	*			trans	-113	103.6	162.2	-71.7	-170.8	-179	-124.3	2.5	110.8
1076	P	33.9	Very low	35	Very low	123 Å²	123	140.4 Å²	140.4	80%	0.799	74%	0.741	S	S	*	*			trans	-62.7	160.4	165.4	-20.3	33.6	0	0	0	111.9
1077	Y	31.6	Very low	34.8	Very low	172 Å²	172	141.1 Å²	141.1	68%	0.675	74%	0.742	S	S	*	*			trans	-55.6	135.9	-176.4	-81.5	-102.9	0	0	0	114.3	M1213	Y1077-M1213 HydrophobicContact CD2-CE 4.4Å; Y1077-M1213 HydrophobicContact CE1-CE 4.15Å; Y1077-M1213 HydrophobicContact CE2-CE 3.72Å; Y1077-M1213 HydrophobicContact CE2-SD 4.4Å
1078	S	29.8	Very low	34.3	Very low	127 Å²	127	144.5 Å²	144.5	89%	0.888	76%	0.76	S	S	*	*			trans	-158.6	122.6	144.4	-80.4	0	0	0	0	108.7
1079	S	35.2	Very low	34.1	Very low	96 Å²	96	151.3 Å²	151.3	67%	0.671	78%	0.777	S	S	*	*			trans	-107.2	160.7	-168	-56	0	0	0	0	113.1
1080	S	31.5	Very low	33.4	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	78%	0.781	S	S	*	*			trans	69	103	150.7	-53.5	0	0	0	0	119.4
1081	R	30.5	Very low	33.1	Very low	247 Å²	247	149.8 Å²	149.8	93%	0.932	79%	0.788	S	S	*	*				-165.3	170.7	108.8	-105.1	172.8	-164.4	-128.1	1.7	113.8
1082	T	31	Very low	33.7	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	80%	0.795	S	S	*	*			trans	-89.4	170.2	-165.5	27.5	0	0	0	0	114.1
1083	P	49	Very low	33.4	Very low	127 Å²	127	148.5 Å²	148.5	83%	0.825	80%	0.799	S	S	*	*			trans	-94.8	164	-156.3	37.1	-37.4	0	0	0	115.7
1084	S	26.4	Very low	33	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	79%	0.786	S	S	*	*			trans	-150.2	120.3	160.4	-167.2	0	0	0	0	113.6
1085	I	29.1	Very low	33	Very low	160 Å²	160	145.5 Å²	145.5	82%	0.821	79%	0.789	S	S	*	*			trans	27	134.2	135.7	-51.8	177.8	0	0	0	120
1086	S	32.3	Very low	32.9	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	79%	0.785	S	S	*	*			trans	-60.6	169.9	174.6	-38.2	0	0	0	0	115.7
1087	P	36.8	Very low	32.7	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	79%	0.785	S	S	*	*				-131.1	179.3	115.8	38.4	-31.9	0	0	0	115.7
1088	V	29.3	Very low	32.7	Very low	129 Å²	129	136.4 Å²	136.4	78%	0.782	79%	0.793	S	S	*	*			trans	-88.3	162	-160.9	171.7	0	0	0	0	114.1
1089	R	37.1	Very low	32.8	Very low	227 Å²	227	134.6 Å²	134.6	86%	0.857	79%	0.785	S	S	*	*			trans	-28.9	141.4	164.2	-51.8	166.3	175.1	166	-3.9	115.4
1090	V	27.7	Very low	33	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	79%	0.791	S	S	*	*				-158.6	156.8	113.2	-115.9	0	0	0	0	113.1
1091	S	31.7	Very low	32.8	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	79%	0.786	S	S	*	*			trans	-125.6	160.3	155.6	-56.7	0	0	0	0	105.9
1092	P	45.7	Very low	33	Very low	113 Å²	113	128 Å²	128	73%	0.734	78%	0.779	S	S	*	*			cis	-151.4	-174.3	37.6	43.3	-22.4	0	0	0	117.9
1093	N	29.1	Very low	33.7	Very low	142 Å²	142	126.6 Å²	126.6	76%	0.759	77%	0.773	S	S	*	*			trans	66.7	161.1	157.1	-91.2	0.4	0	0	0	117.5
1094	N	31.4	Very low	32.9	Very low	115 Å²	115	130.7 Å²	130.7	62%	0.615	77%	0.772	S	S	*	*			cis	-156.4	163.5	10.8	-144	-21.9	0	0	0	113.2
1095	R	31.6	Very low	33	Very low	218 Å²	218	132.2 Å²	132.2	82%	0.823	77%	0.767	S	S	*	*			trans	66.2	154.8	157.7	-65.9	-177.1	177.2	173	-1.8	119.5
1096	S	31	Very low	32.8	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	77%	0.766	S	S	*	*			cis	-172.9	166.7	-24.1	-96.1	0	0	0	0	111.2
1097	A	29.2	Very low	32.7	Very low	98 Å²	98	134 Å²	134	81%	0.81	77%	0.765	S	S	*	*			trans	75.9	136.2	163.2	0	0	0	0	0	116.8
1098	S	30.8	Very low	32.1	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	76%	0.759	S	S	*	*			cis	-141.7	157	1.8	-81.8	0	0	0	0	112.9
1099	A	32	Very low	32	Very low	88 Å²	88	135 Å²	135	73%	0.727	77%	0.766	S	S	*	*			trans	-99.5	-179.7	163.9	0	0	0	0	0	110.1
1100	P	40	Very low	31.5	Very low	121 Å²	121	133 Å²	133	79%	0.786	76%	0.764	S	S	*	*				-117.5	156	61.7	0.8	23.3	0	0	0	113.3
1101	A	26.5	Very low	31.4	Very low	83 Å²	83	135.2 Å²	135.2	69%	0.686	77%	0.765	S	S	*	*				70.2	129.3	68.2	0	0	0	0	0	113.1
1102	S	35.1	Very low	31.2	Very low	112 Å²	112	141.2 Å²	141.2	78%	0.783	77%	0.77	S	S	*	*			cis	66.2	152.7	33.6	-142	0	0	0	0	111
1103	P	46.3	Very low	30.3	Very low	106 Å²	106	143.8 Å²	143.8	69%	0.688	77%	0.77	S	S	*	*			cis	-149.9	-161.2	29.1	34.3	-7.2	0	0	0	116.7
1104	R	30.7	Very low	30.5	Very low	212 Å²	212	142.3 Å²	142.3	80%	0.8	77%	0.766	S	S	*	*			trans	83.4	151.1	152.8	-73.6	-166.2	147.1	141.6	1.9	120.1
1105	E	30	Very low	30.3	Very low	140 Å²	140	141.9 Å²	141.9	65%	0.654	76%	0.764	S	S	*	*			cis	-178.7	169.7	-33.7	-119.8	179	166.4	0	0	107.6
1106	M	25.1	Very low	30.4	Very low	162 Å²	162	141.8 Å²	141.8	80%	0.798	77%	0.765	S	S	*	*			trans	67.8	156.5	166.2	-57.9	-159	-59.2	0	0	116.8
1107	I	28.5	Very low	30.4	Very low	138 Å²	138	145.6 Å²	145.6	71%	0.708	77%	0.772	S	S	*	*			cis	-148.2	167.1	-21.8	-116.2	170.9	0	0	0	109
1108	S	24.3	Very low	30.4	Very low	102 Å²	102	146.6 Å²	146.6	71%	0.713	77%	0.771	S	S	*	*			trans	-26.6	142.4	165.8	-45.1	0	0	0	0	117.2
1109	L	27.8	Very low	30.4	Very low	179 Å²	179	147.2 Å²	147.2	94%	0.937	77%	0.77	S	S	*	*				-154.8	166.4	112.1	-109.9	163.6	0	0	0	112
1110	K	26.6	Very low	30.3	Very low	184 Å²	184	146.4 Å²	146.4	80%	0.8	77%	0.771	S	S	*	*			trans	-138.4	105.5	-162.3	162.7	-144.5	170.1	-172.4	0	107.9
1111	E	26.1	Very low	29.9	Very low	194 Å²	194	144 Å²	144	91%	0.907	77%	0.767	S	S	*	*			trans	-154.1	161.1	156.9	-142.5	133.6	-124.9	0	0	112.4
1112	R	28.1	Very low	30	Very low	236 Å²	236	147.8 Å²	147.8	89%	0.891	78%	0.776	S	S	*	*			trans	-109.4	143.3	168.2	-48	176.8	-172	99.8	-6.6	106.3
1113	K	26.3	Very low	29.7	Very low	166 Å²	166	146.9 Å²	146.9	72%	0.722	78%	0.776	S	S	*	*				169.6	168.2	97.6	-167	156	179.8	-99.8	0	109.8	D1115	K1113-D1115 IonicContact NZ-OD1 3.52Å; K1113-D1115 PolarHBondContact NZ-OD1 2.98Å; K1113-D1115 IonicContact NZ-OD2 2.61Å; K1113-D1115 PolarHBondContact NZ-OD2 3.03Å
1114	T	32.8	Very low	28.8	Very low	111 Å²	111	147.7 Å²	147.7	68%	0.681	78%	0.779	S	S	*	*			trans	-60.6	179.2	156.6	45.7	0	0	0	0	110.4
1115	D	27.1	Very low	28.7	Very low	107 Å²	107	147.1 Å²	147.1	57%	0.572	78%	0.778	S	S	*	*				-166.4	171.5	81	-79.1	-42.5	0	0	0	114	K1113	K1113-D1115 IonicContact NZ-OD1 3.52Å; K1113-D1115 PolarHBondContact NZ-OD1 2.98Å; K1113-D1115 IonicContact NZ-OD2 2.61Å; K1113-D1115 PolarHBondContact NZ-OD2 3.03Å
1116	Y	34.6	Very low	28.7	Very low	215 Å²	215	148.5 Å²	148.5	84%	0.843	78%	0.784	S	S	*	*			trans	-41.5	156.8	151.1	-89.8	-130.3	0	0	0	112.3
1117	E	31.4	Very low	28.7	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	78%	0.783	S	S	*	*				-175.9	140.6	110.2	-101.5	170.6	173.2	0	0	115.9
1118	C	29.2	Very low	28.7	Very low	119 Å²	119	142.3 Å²	142.3	80%	0.804	79%	0.787	S	S	*	*			trans	-156.6	128	139.3	-176.1	0	0	0	0	103.9	G1120	C1118-G1120 PolarHBondContact SG-N 3.44Å; C1118-G1120 VanDerWaalsContact SG-N 3.42Å
1119	T	30.4	Very low	29	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	79%	0.792	S	S	*	*	S	Bend	cis	-68.8	122.6	37.6	40.7	0	0	0	0	119.6
1120	G	30.3	Very low	29.1	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	78%	0.777	S	S	*	*			trans	87.9	120	143.8	0	0	0	0	0	117.6	C1118	C1118-G1120 PolarHBondContact SG-N 3.44Å; C1118-G1120 VanDerWaalsContact SG-N 3.42Å
1121	G	29.9	Very low	29.2	Very low	69 Å²	69	138.7 Å²	138.7	71%	0.711	77%	0.77	S	S	*	*			cis	172	168.9	-7.5	0	0	0	0	0	114.8
1122	N	29.4	Very low	29.4	Very low	163 Å²	163	137.2 Å²	137.2	87%	0.872	76%	0.763	S	S	*	*			trans	71.2	114.5	164.3	-63.5	-11	0	0	0	121.5
1123	A	29.6	Very low	29.5	Very low	94 Å²	94	131.2 Å²	131.2	78%	0.777	75%	0.753	S	S	*	*			trans	74.9	146.5	137.1	0	0	0	0	0	119
1124	T	27.4	Very low	29.7	Very low	123 Å²	123	127.8 Å²	127.8	76%	0.755	75%	0.75	S	S	*	*			cis	-155.2	133.9	-0.7	-9.4	0	0	0	0	113
1125	Y	28.7	Very low	29.6	Very low	199 Å²	199	133 Å²	133	78%	0.78	76%	0.757	S	S	*	*			trans	61.2	115	138.5	-89.4	-124	0	0	0	125
1126	H	28.3	Very low	29.6	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.787	77%	0.768	S	S	*	*				78.3	121.1	123.1	-86.9	-113.5	0	0	0	125.2
1127	G	26.2	Very low	29.3	Very low	75 Å²	75	133.5 Å²	133.5	77%	0.773	77%	0.765	S	S	*	*			trans	102.3	156.4	138.4	0	0	0	0	0	118.6
1128	A	27.5	Very low	29.1	Very low	95 Å²	95	129.9 Å²	129.9	79%	0.785	77%	0.766	S	S	*	*			cis	-171	138.3	-19.3	0	0	0	0	0	113
1129	K	31.2	Very low	29	Very low	188 Å²	188	132.9 Å²	132.9	82%	0.817	77%	0.771	S	S	*	*			trans	58.4	165.7	160	-61.5	-168.6	173	-155.6	0	118.7
1130	G	29	Very low	28.9	Very low	62 Å²	62	133.4 Å²	133.4	64%	0.639	77%	0.774	S	S	*	*			cis	-156.5	157.5	-2.5	0	0	0	0	0	110.9
1131	E	28.6	Very low	28.6	Very low	138 Å²	138	134.7 Å²	134.7	65%	0.645	78%	0.778	S	S	*	*				85.1	110.6	85.8	-71.8	173.9	159.8	0	0	114.2
1132	H	31.2	Very low	28.5	Very low	164 Å²	164	139.7 Å²	139.7	76%	0.759	78%	0.783	S	S	*	*				98.7	158.7	105.6	-79.4	-22.2	0	0	0	114.6
1133	T	30.3	Very low	28.3	Very low	110 Å²	110	138.1 Å²	138.1	68%	0.675	77%	0.774	S	S	*	*			cis	-166	161.7	1	9.6	0	0	0	0	113.4
1134	S	30.4	Very low	28.2	Very low	94 Å²	94	140 Å²	140	66%	0.657	78%	0.776	S	S	*	*			trans	69	165.8	143.2	-77.4	0	0	0	0	120
1135	R	30.1	Very low	28.1	Very low	219 Å²	219	137.9 Å²	137.9	83%	0.826	78%	0.779	S	S	*	*			cis	-154.6	138.5	-1.5	-118.5	154	-163.8	180	2.3	109.1
1136	K	28.4	Very low	27.9	Very low	187 Å²	187	136.4 Å²	136.4	81%	0.813	78%	0.783	S	S	*	*				78.9	137.9	97	-174.1	179.6	176.4	-173.8	0	116.9
1137	D	28.3	Very low	27.8	Very low	147 Å²	147	132.7 Å²	132.7	79%	0.786	78%	0.776	S	S	*	*			trans	-69	155.9	-179.1	-37.3	-99.5	0	0	0	116.5
1138	A	27.3	Very low	27.9	Very low	107 Å²	107	135 Å²	135	88%	0.884	78%	0.775	S	S	*	*			trans	-149.8	148	154.5	0	0	0	0	0	109.6
1139	M	26.8	Very low	27.9	Very low	182 Å²	182	138 Å²	138	90%	0.897	78%	0.777	S	S	*	*			trans	-146.1	123.5	-166.6	179.5	179.9	-176.6	0	0	112.1
1140	T	27.3	Very low	27.6	Very low	145 Å²	145	138.3 Å²	138.3	89%	0.89	78%	0.775	S	S	*	*			trans	165.8	156.4	167.4	35.9	0	0	0	0	108.3
1141	A	25.4	Very low	27.6	Very low	98 Å²	98	144.3 Å²	144.3	81%	0.81	78%	0.778	S	S	*	*			cis	-164	179.2	-20.3	0	0	0	0	0	108.5
1142	Q	27	Very low	27.4	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	78%	0.778	S	S	*	*			trans	-86.4	163	-165.6	-57.7	172.5	-73.4	0	0	116.8
1143	N	26.4	Very low	27.3	Very low	129 Å²	129	140.4 Å²	140.4	69%	0.69	78%	0.775	S	S	*	*			trans	91.2	118.2	135.5	-79.6	-2.5	0	0	0	124
1144	T	27	Very low	27	Very low	134 Å²	134	146.8 Å²	146.8	82%	0.822	79%	0.789	S	S	*	*			trans	59.5	122.9	133.9	59.8	0	0	0	0	121.8
1145	G	24.3	Very low	26.8	Very low	79 Å²	79	146 Å²	146	81%	0.814	80%	0.796	S	S	*	*			trans	-177	71.8	172.2	0	0	0	0	0	118.1
1146	I	25.4	Very low	26.8	Very low	168 Å²	168	140.3 Å²	140.3	86%	0.862	80%	0.795	S	S	*	*			trans	10.7	117	151.4	-62.7	174.6	0	0	0	120.7
1147	S	26.9	Very low	27.4	Very low	92 Å²	92	137.4 Å²	137.4	64%	0.643	80%	0.795	S	S	*	*			trans	81.3	127.5	133	-154.3	0	0	0	0	125.8
1148	T	27.9	Very low	27.2	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	79%	0.794	S	S	*	*			trans	64	121.2	140	45.7	0	0	0	0	124.2
1149	L	27.1	Very low	27.2	Very low	157 Å²	157	139 Å²	139	82%	0.822	80%	0.795	S	S	*	*			trans	-141.9	125.7	133.3	-80	-178.6	0	0	0	112
1150	Y	25.1	Very low	27.4	Very low	195 Å²	195	136.5 Å²	136.5	77%	0.765	79%	0.786	S	S	*	*			trans	38.2	155.1	138.8	-79	-113.3	0	0	0	124
1151	R	28.8	Very low	27.4	Very low	189 Å²	189	136.9 Å²	136.9	71%	0.713	78%	0.781	S	S	*	*			cis	-177	163.4	-33.1	-151.3	-173.5	165.8	172.9	-2.7	110.8
1152	N	25.1	Very low	27.5	Very low	120 Å²	120	139.4 Å²	139.4	64%	0.642	77%	0.773	S	S	*	*			trans	85.1	123.1	162.9	-54.2	-21.9	0	0	0	115.8
1153	S	27.6	Very low	27.6	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	77%	0.768	S	S	*	*			cis	88.2	110.6	7.7	-35.5	0	0	0	0	118.5
1154	Y	25.1	Very low	27.7	Very low	244 Å²	244	138 Å²	138	96%	0.957	77%	0.766	S	S	*	*			trans	-165	149.2	143.5	-79.1	-67.4	0	0	0	106.3
1155	G	24.8	Very low	27.7	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	76%	0.761	S	S	*	*			cis	175.7	154.1	-7.4	0	0	0	0	0	109.5
1156	A	30.2	Very low	27.8	Very low	99 Å²	99	140.9 Å²	140.9	82%	0.818	76%	0.757	S	S	*	*			trans	-126.7	153.4	174.4	0	0	0	0	0	110.1
1157	P	41	Very low	27.8	Very low	125 Å²	125	138.2 Å²	138.2	81%	0.812	75%	0.754	S	S	*	*				-154.5	150.3	117.8	38.1	-20.3	0	0	0	118.2
1158	A	25.8	Very low	27.8	Very low	92 Å²	92	138.2 Å²	138.2	76%	0.76	76%	0.759	S	S	*	*				53.2	158.2	129.6	0	0	0	0	0	126.4
1159	E	27.3	Very low	27.5	Very low	195 Å²	195	140.9 Å²	140.9	91%	0.911	76%	0.763	S	S	*	*			trans	77.2	135.5	163.2	-52.6	-168.3	169.9	0	0	119.2
1160	D	29	Very low	28.1	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	75%	0.752	S	S	*	*			cis	-119.7	-113	-10	-173.3	21.2	0	0	0	110.2
1161	I	28.5	Very low	28	Very low	154 Å²	154	134.9 Å²	134.9	79%	0.79	76%	0.755	S	S	*	*			cis	-149.3	158.4	-8.1	-156.3	158.7	0	0	0	114
1162	K	28.3	Very low	28.4	Very low	150 Å²	150	130.8 Å²	130.8	65%	0.652	75%	0.753	S	S	*	*			trans	-65.2	162.4	-177.5	-59.5	176.5	-173.1	171.9	0	114.6
1163	H	28.6	Very low	28.3	Very low	152 Å²	152	134 Å²	134	70%	0.704	76%	0.764	S	S	*	*			cis	-170.7	135.6	-6	-108.9	12.7	0	0	0	107
1164	N	27	Very low	28.1	Very low	121 Å²	121	135.8 Å²	135.8	65%	0.647	76%	0.761	S	S	*	*				148.8	155.5	92.3	-95.2	-13.7	0	0	0	106.3
1165	Q	27.8	Very low	28.7	Very low	151 Å²	151	127.8 Å²	127.8	71%	0.706	74%	0.739	S	S	*	*			cis	-164.7	151.5	-10.8	-112.8	172.6	34.1	0	0	110
1166	V	26.1	Very low	28.8	Very low	123 Å²	123	126.4 Å²	126.4	75%	0.745	72%	0.717	S	S	*	*			trans	55.5	113.2	146.1	-178.6	0	0	0	0	118.7
1167	S	25.7	Very low	28.7	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	71%	0.705	S	S	*	*				65	146.1	89.5	-132.2	0	0	0	0	115.4
1168	A	28.1	Very low	28.1	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	69%	0.687	S	S	*	*			cis	-155.9	-171.1	16.6	0	0	0	0	0	113.8
1169	Q	21.2	Very low	28.2	Very low	178 Å²	178	127.8 Å²	127.8	83%	0.832	68%	0.675	S	S	*	*			trans	-74.2	-175.5	163.6	-103.7	-167.2	23.6	0	0	112.4
1170	P	38.8	Very low	28.2	Very low	91 Å²	91	127.9 Å²	127.9	59%	0.591	67%	0.669	S	S	*	*			cis	-142.7	162	-28.9	35.8	-17.7	0	0	0	116.4
1171	V	23.4	Very low	28.1	Very low	136 Å²	136	128.9 Å²	128.9	82%	0.824	67%	0.669	S	S	*	*			trans	65.1	168.4	144.4	169	0	0	0	0	117
1172	P	37.7	Very low	28	Very low	103 Å²	103	126.2 Å²	126.2	67%	0.669	66%	0.66	S	S	*	*			cis	-116.9	-165.3	-32	32.7	-13	0	0	0	114.2
1173	Q	22.4	Very low	27.8	Very low	188 Å²	188	128.1 Å²	128.1	88%	0.879	67%	0.665	S	S	*	*			trans	118.3	145.8	139.5	-90	170.9	-2.9	0	0	122.6
1174	E	23	Very low	27.6	Very low	136 Å²	136	127.4 Å²	127.4	64%	0.636	66%	0.661	S	S	*	*			trans	-75.6	178.2	168.5	-109.3	-168.8	157.4	0	0	111.7	R428	R428-E1174 IonicContact CZ-OE1 2.77Å; R428-E1174 IonicContact CZ-OE2 3.59Å; R428-E1174 IonicContact NH1-OE1 2.72Å; R428-E1174 IonicContact NH1-OE2 3.51Å; R428-E1174 PolarHBondContact NH1-OE2 3.04Å; R428-E1174 IonicContact NH2-OE1 3.74Å; R428-E1174 PolarHBondContact NH2-OE1 3.41Å; R428-E1174 IonicContact NH2-OE2 2.83Å; R428-E1174 PolarHBondContact NH2-OE2 3.2Å
1175	P	38.4	Very low	28.2	Very low	77 Å²	77	127 Å²	127	50%	0.5	67%	0.665	S	S	.	*			cis	-132.7	-123.9	-16.3	36.7	-15.2	0	0	0	110.8	E426	E426-P1175 WeakPolarHBondContact OE2-CG 3.38Å
1176	S	26.7	Very low	28.1	Very low	49 Å²	49	127.5 Å²	127.5	34%	0.343	67%	0.666	S	S	.	*			trans	115.6	83.1	147.2	-162	0	0	0	0	121.7	Y425 E426	Y425-S1176 WeakPolarHBondContact CD2-OG 3.35Å; E426-S1176 VanDerWaalsContact CB-CA 3.49Å; E426-S1176 WeakPolarHBondContact CB-OG 3.42Å; E426-S1176 PolarHBondContact N-OG 3.46Å; E426-S1176 VanDerWaalsContact N-OG 3.1Å; E426-S1176 VanDerWaalsContact OE1-CA 3.31Å; E426-S1176 WeakPolarHBondContact OE1-CA 3.42Å; E426-S1176 PolarHBondContact OE1-N 3.18Å
1177	R	27.4	Very low	28.1	Very low	151 Å²	151	129.5 Å²	129.5	57%	0.57	67%	0.667	S	S	*	*			trans	-46.6	178.4	158.2	-67.5	153.2	91.9	-165.9	12	117.4	Y425 E426 D427	Y425-R1177 CarbonylContact C-O 3.59Å; Y425-R1177 WeakPolarHBondContact CA-O 3.34Å; Y425-R1177 VanDerWaalsContact O-O 3.08Å; E426-R1177 HydrophobicContact CB-CB 3.97Å; E426-R1177 HydrophobicContact CG-CB 4.13Å; E426-R1177 HydrophobicContact CG-CG 4.37Å; E426-R1177 PolarHBondContact N-O 2.84Å; E426-R1177 WeakPolarHBondContact OE1-CB 3.24Å; E426-R1177 WeakPolarHBondContact OE1-CD 3.48Å; E426-R1177 WeakPolarHBondContact OE1-CG 3.31Å; E426-R1177 PolarHBondContact OE1-N 2.98Å; D427-R1177 PolarHBondContact O-NH1 2.81Å
1178	K	29.3	Very low	28	Very low	96 Å²	96	130.9 Å²	130.9	42%	0.417	67%	0.665	S	S	.	*			trans	72.8	160.4	141.8	-87.8	177.1	155.3	-73.4	0	115.8	I424 Y425	I424-K1178 CarbonylContact C-O 3.5Å; I424-K1178 VanDerWaalsContact C-O 3.22Å; Y425-K1178 PolarHBondContact N-O 3.41Å; Y425-K1178 WeakPolarHBondContact O-CB 3.42Å
1179	D	27.3	Very low	27.9	Very low	97 Å²	97	131 Å²	131	52%	0.519	66%	0.66	S	S	.	*			cis	-146.6	175.6	1.9	-125.6	-20.2	0	0	0	113.8
1180	Y	27.5	Very low	28.1	Very low	197 Å²	197	128.5 Å²	128.5	77%	0.773	66%	0.658	S	S	*	*			trans	-6.2	161.3	157.7	-81.1	-78.8	0	0	0	121.5
1181	E	27.1	Very low	27.7	Very low	151 Å²	151	135 Å²	135	71%	0.706	67%	0.671	S	S	*	*			cis	-160.3	-175.4	31.4	-132.5	176.7	-145.8	0	0	108.9
1182	T	25.5	Very low	27.7	Very low	98 Å²	98	135 Å²	135	60%	0.601	67%	0.666	S	S	*	*			cis	-160.5	141.4	21.5	-133.5	0	0	0	0	113.1
1183	Y	25.1	Very low	27.2	Very low	191 Å²	191	139.7 Å²	139.7	75%	0.749	67%	0.671	S	S	*	*			trans	42.7	133.1	156.6	-70.8	-110.7	0	0	0	122.2
1184	Q	24.6	Very low	27.3	Very low	136 Å²	136	136.7 Å²	136.7	64%	0.636	66%	0.662	S	S	*	*			cis	65.1	146.9	43.2	-76.9	-89	-38.7	0	0	114.1
1185	P	38.3	Very low	27.3	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	67%	0.669	S	S	*	*			cis	-142.1	-169.9	35.5	42.7	-21.9	0	0	0	118.6
1186	F	25.5	Very low	26.8	Very low	163 Å²	163	139.3 Å²	139.3	72%	0.715	68%	0.678	S	S	*	*			trans	-53.2	177.5	169.4	-66.7	-94.7	0	0	0	114.6
1187	Q	26.1	Very low	26.8	Very low	165 Å²	165	145.4 Å²	145.4	77%	0.771	70%	0.699	S	S	*	*			cis	-172.9	152.5	39.8	-151.5	167.4	34.2	0	0	115.7
1188	N	25.1	Very low	26.8	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	70%	0.704	S	S	*	*			trans	43.4	116.6	149.1	-71.7	5.6	0	0	0	125.5
1189	S	25.9	Very low	26.6	Very low	94 Å²	94	148.3 Å²	148.3	66%	0.657	72%	0.718	S	S	*	*				89.1	120.4	108.6	-155.8	0	0	0	0	124.5
1190	T	25.6	Very low	26.5	Very low	126 Å²	126	149.1 Å²	149.1	77%	0.773	72%	0.722	S	S	*	*			trans	74.2	138.2	137.3	45.1	0	0	0	0	125.3
1191	R	28.9	Very low	26.4	Very low	229 Å²	229	146.8 Å²	146.8	86%	0.864	72%	0.718	S	S	*	*			trans	101.2	104.1	142.1	-101.7	-178.7	174.5	176.3	-2	122.2
1192	N	25.2	Very low	26.4	Very low	136 Å²	136	144.5 Å²	144.5	73%	0.727	71%	0.714	S	S	*	*			trans	49.4	142.6	130	-63.3	30.2	0	0	0	125.2
1193	Y	27.2	Very low	26.4	Very low	200 Å²	200	148.8 Å²	148.8	78%	0.784	73%	0.727	S	S	*	*			trans	114.5	131.3	135	-95.5	-62.2	0	0	0	120.9
1194	D	24	Very low	26.4	Very low	126 Å²	126	148.5 Å²	148.5	67%	0.674	73%	0.732	S	S	*	*			trans	64.7	127.9	156.2	-67.2	-29.7	0	0	0	127.1
1195	E	23.2	Very low	26.4	Very low	170 Å²	170	153.3 Å²	153.3	79%	0.794	75%	0.745	S	S	*	*			trans	31.4	122.4	135.1	-67.8	-161.5	129.6	0	0	124.5
1196	S	27.2	Very low	26.2	Very low	97 Å²	97	153 Å²	153	68%	0.678	74%	0.743	S	S	*	*				92.9	125	118.8	75.9	0	0	0	0	123.3
1197	F	26.2	Very low	26.8	Very low	178 Å²	178	151.4 Å²	151.4	78%	0.781	75%	0.748	S	S	*	*			trans	78.2	137.8	132.2	-99.1	-57.4	0	0	0	124.2
1198	F	28.5	Very low	26.9	Very low	158 Å²	158	148.7 Å²	148.7	69%	0.693	75%	0.754	S	S	*	*			trans	60.1	148	165.8	-72.9	-91.7	0	0	0	118.6
1199	E	24.8	Very low	27	Very low	149 Å²	149	147.5 Å²	147.5	70%	0.696	76%	0.757	S	S	*	*			cis	-166.4	165.6	-29.5	-156.4	171.9	-139.5	0	0	110.6
1200	D	25.6	Very low	27.2	Very low	114 Å²	114	151.5 Å²	151.5	61%	0.61	77%	0.766	S	S	*	*			trans	81.3	121.5	140.7	-106.9	13.2	0	0	0	127
1201	Q	25.6	Very low	27	Very low	149 Å²	149	156.4 Å²	156.4	70%	0.696	77%	0.772	S	S	*	*			trans	85.7	108.8	132.2	-80.8	-171.4	58.5	0	0	125.9
1202	V	25.6	Very low	27.1	Very low	102 Å²	102	150.8 Å²	150.8	62%	0.618	76%	0.763	S	S	*	*				73.2	124.2	120.3	172.3	0	0	0	0	120.2
1203	H	26.8	Very low	27	Very low	189 Å²	189	151.2 Å²	151.2	88%	0.875	76%	0.762	S	S	*	*				-162.8	136.1	117.8	-105.3	72.8	0	0	0	112.2
1204	H	25.3	Very low	27	Very low	185 Å²	185	149.7 Å²	149.7	86%	0.856	76%	0.762	S	S	*	*			trans	-116	136.6	-179.2	-97.6	-62.4	0	0	0	112
1205	R	24.8	Very low	27.1	Very low	237 Å²	237	152 Å²	152	89%	0.894	77%	0.773	S	S	*	*			trans	-163.5	176.1	146.8	-120.1	-170.1	180	-158.3	-1.2	113.1
1206	P	33.4	Very low	27.1	Very low	105 Å²	105	147.1 Å²	147.1	68%	0.682	77%	0.768	S	S	*	*				-119.2	-175.8	-115.2	45.9	-30.3	0	0	0	113.7
1207	P	38.6	Very low	27.1	Very low	129 Å²	129	150.9 Å²	150.9	84%	0.838	78%	0.78	S	S	*	*			trans	-88.6	167.6	-162.3	35.7	-35.6	0	0	0	115.6
1208	A	27.2	Very low	27	Very low	108 Å²	108	151.7 Å²	151.7	89%	0.893	78%	0.783	S	S	*	*			trans	-132.8	167.1	174.7	0	0	0	0	0	111.9
1209	S	26.5	Very low	26.8	Very low	117 Å²	117	150.2 Å²	150.2	82%	0.818	79%	0.792	S	S	*	*			trans	-93	167.5	-161.6	57.3	0	0	0	0	116.6
1210	E	30.2	Very low	26.8	Very low	178 Å²	178	149.3 Å²	149.3	83%	0.832	80%	0.797	S	S	*	*			trans	-53.6	150.3	169.8	-53.2	174.4	113.1	0	0	114
1211	Y	23.1	Very low	26.8	Very low	229 Å²	229	147.6 Å²	147.6	90%	0.898	81%	0.806	S	S	*	*			trans	-165	146.2	133	-113.5	-73.3	0	0	0	111.7
1212	T	29.9	Very low	26.8	Very low	111 Å²	111	147.2 Å²	147.2	68%	0.681	81%	0.809	S	S	*	*			trans	-125	144.4	-175.4	-56.5	0	0	0	0	111.5
1213	M	23.4	Very low	26.8	Very low	144 Å²	144	152.8 Å²	152.8	71%	0.709	82%	0.82	S	S	*	*			trans	-145.3	159	164	-90.9	-66	179.2	0	0	111.7	Y1077	Y1077-M1213 HydrophobicContact CD2-CE 4.4Å; Y1077-M1213 HydrophobicContact CE1-CE 4.15Å; Y1077-M1213 HydrophobicContact CE2-CE 3.72Å; Y1077-M1213 HydrophobicContact CE2-SD 4.4Å
1214	H	27.5	Very low	26.8	Very low	168 Å²	168	147.9 Å²	147.9	78%	0.778	80%	0.804	S	S	*	*			trans	-117.9	150.5	-167.6	-83.3	-90.8	0	0	0	114.4
1215	L	25.6	Very low	26.9	Very low	176 Å²	176	144.4 Å²	144.4	92%	0.921	79%	0.791	S	S	*	*				176.5	148.6	118.1	-115.8	69.3	0	0	0	109.6
1216	G	23.4	Very low	26.9	Very low	66 Å²	66	142.3 Å²	142.3	68%	0.68	79%	0.789	S	S	*	*			cis	151.5	124	-13.7	0	0	0	0	0	113.7
1217	L	26.3	Very low	26.7	Very low	176 Å²	176	148.3 Å²	148.3	92%	0.921	80%	0.8	S	S	*	*			trans	-148.4	167.1	160.1	-109.6	174.6	0	0	0	110.7
1218	K	24.4	Very low	26.1	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	80%	0.797	S	S	*	*			trans	-116.1	150.8	-154.3	-58	168.5	-174.5	169.1	0	113.6
1219	S	24.8	Very low	26.2	Very low	126 Å²	126	147.1 Å²	147.1	88%	0.881	79%	0.794	S	S	*	*			trans	-134.8	143	155.4	-176.6	0	0	0	0	109.4
1220	T	25.3	Very low	26.3	Very low	131 Å²	131	146.2 Å²	146.2	80%	0.804	79%	0.794	S	S	*	*			trans	-128.7	110.9	-171.5	48.9	0	0	0	0	111.1
1221	G	24.8	Very low	26.2	Very low	78 Å²	78	148.6 Å²	148.6	80%	0.804	80%	0.795	S	S	*	*			trans	-115.3	101.6	176	0	0	0	0	0	111.7
1222	N	26.8	Very low	27.1	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	79%	0.785	S	S	*	*			trans	-148.5	98.2	179.3	-113.7	-14.2	0	0	0	110.5
1223	Y	24.7	Very low	26.9	Very low	218 Å²	218	147.7 Å²	147.7	86%	0.855	79%	0.793	S	S	*	*			trans	-161.6	152.3	142.7	-136.7	-96.8	0	0	0	112.3
1224	V	25.8	Very low	27.1	Very low	86 Å²	86	146.7 Å²	146.7	52%	0.521	80%	0.8	S	S	.	*			trans	-147.8	146.4	177.4	173.2	0	0	0	0	108.5
1225	D	28.7	Very low	27.2	Very low	113 Å²	113	147.5 Å²	147.5	60%	0.604	80%	0.804	S	S	*	*			trans	66.7	118.8	177.6	-58.7	-32.7	0	0	0	117.2
1226	F	25.3	Very low	27.2	Very low	193 Å²	193	147.4 Å²	147.4	85%	0.846	80%	0.804	S	S	*	*				-176.2	149.8	102.4	-108	-83.9	0	0	0	110.1
1227	Y	28.9	Very low	27.3	Very low	230 Å²	230	151 Å²	151	90%	0.902	81%	0.808	S	S	*	*			trans	-146.9	117.2	167.1	-111.6	-77.6	0	0	0	111.2
1228	S	25.7	Very low	27.3	Very low	112 Å²	112	152.6 Å²	152.6	78%	0.783	80%	0.802	S	S	*	*			trans	-164.3	123.2	167.4	-81.1	0	0	0	0	111.6
1229	A	28.4	Very low	27.3	Very low	101 Å²	101	150.6 Å²	150.6	84%	0.835	80%	0.796	S	S	*	*			trans	56.9	96.1	160.4	0	0	0	0	0	120.7
1230	A	30.4	Very low	27.7	Very low	98 Å²	98	150.9 Å²	150.9	81%	0.81	79%	0.793	S	S	*	*				45.2	152.4	123.3	0	0	0	0	0	124.2
1231	R	27.7	Very low	27.8	Very low	227 Å²	227	149.3 Å²	149.3	86%	0.857	79%	0.787	S	S	*	*			trans	100.7	148.6	167.2	-65	-95.4	162.3	163.2	-11.2	115.6
1232	P	42.2	Very low	27.8	Very low	104 Å²	104	154.5 Å²	154.5	68%	0.675	79%	0.79	S	S	*	*				-132.4	-175.4	-127.3	44.5	-30.8	0	0	0	117.7
1233	Y	25.3	Very low	27.7	Very low	217 Å²	217	159.1 Å²	159.1	85%	0.851	80%	0.799	S	S	*	*			trans	71.6	110.3	164.9	-86.4	-77.3	0	0	0	120
1234	S	26.9	Very low	27.8	Very low	124 Å²	124	154.2 Å²	154.2	87%	0.867	79%	0.794	S	S	*	*				-175.6	154.6	107.1	26.7	0	0	0	0	111.1
1235	E	29.8	Very low	27.8	Very low	185 Å²	185	154.9 Å²	154.9	86%	0.864	81%	0.809	S	S	*	*			trans	-95.8	148.2	-173.9	-56.7	173	123.5	0	0	112.9
1236	L	26.2	Very low	27.6	Very low	173 Å²	173	153.7 Å²	153.7	91%	0.906	81%	0.809	S	S	*	*			trans	-164.5	140.1	149	-119.7	146.9	0	0	0	112.3
1237	N	25.3	Very low	27.8	Very low	143 Å²	143	150 Å²	150	77%	0.765	80%	0.804	S	S	*	*			trans	-76.1	150.1	-179.4	-67	-43.4	0	0	0	113
1238	Y	25.5	Very low	27.7	Very low	208 Å²	208	144.2 Å²	144.2	82%	0.816	79%	0.789	S	S	*	*				-169.1	-178.9	112.6	-115.2	-82.4	0	0	0	112
1239	E	25.6	Very low	27.7	Very low	154 Å²	154	143.8 Å²	143.8	72%	0.72	79%	0.786	S	S	*	*			trans	-88.1	142.8	-150.8	-65.1	166.3	100	0	0	117.9
1240	T	33	Very low	27.7	Very low	132 Å²	132	146 Å²	146	81%	0.81	77%	0.773	S	S	*	*			trans	25.3	106.9	131	-46.4	0	0	0	0	119.6
1241	S	27.1	Very low	27.6	Very low	99 Å²	99	146.6 Å²	146.6	69%	0.692	77%	0.766	S	S	*	*				-175.7	156.6	127.9	46.6	0	0	0	0	113.6
1242	H	25.1	Very low	27.6	Very low	186 Å²	186	142.6 Å²	142.6	86%	0.861	76%	0.761	S	S	*	*			trans	55.9	94.3	168.6	-62.9	-70.3	0	0	0	120
1243	Y	24.5	Very low	26.8	Very low	238 Å²	238	144.6 Å²	144.6	93%	0.933	77%	0.766	S	S	*	*			trans	-98.4	131.6	155.6	-100.1	-87.5	0	0	0	111.3
1244	P	27	Very low	26.9	Very low	115 Å²	115	140.6 Å²	140.6	75%	0.747	76%	0.761	S	S	*	*			trans	-90.1	129.5	168.9	33.1	-30.6	0	0	0	112.3
1245	A	24.6	Very low	26.9	Very low	101 Å²	101	141.5 Å²	141.5	84%	0.835	76%	0.755	S	S	*	*			trans	35.2	95.5	160.2	0	0	0	0	0	118.6
1246	S	26.1	Very low	26.7	Very low	87 Å²	87	138.8 Å²	138.8	61%	0.608	75%	0.748	S	S	*	*			trans	-72.3	143.1	162.1	-173.8	0	0	0	0	111.3	D1248	S1246-D1248 WeakPolarHBondContact CB-OD2 3.49Å; S1246-D1248 PolarHBondContact O-N 2.99Å; S1246-D1248 PolarHBondContact OG-OD2 3.25Å
1247	P	28.3	Very low	26.7	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	74%	0.737	S	S	*	*	S	Bend	trans	-82.8	50.2	-174.6	35.8	-38.2	0	0	0	113.8	S1249	P1247-S1249 PolarHBondContact O-N 3.5Å
1248	D	27.8	Very low	26.8	Very low	109 Å²	109	136.1 Å²	136.1	58%	0.583	74%	0.735	S	S	*	*			trans	-87.6	5.4	-173.7	-66.5	-62.9	0	0	0	114.7	S1246 W1250	S1246-D1248 WeakPolarHBondContact CB-OD2 3.49Å; S1246-D1248 PolarHBondContact O-N 2.99Å; S1246-D1248 PolarHBondContact OG-OD2 3.25Å; D1248-W1250 VanDerWaalsContact C-N 3.33Å; D1248-W1250 PolarHBondContact O-N 3.47Å
1249	S	24.9	Very low	27	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	73%	0.729	S	S	*	*			trans	-90	37.3	-174.3	75.9	0	0	0	0	115.2	P1247	P1247-S1249 PolarHBondContact O-N 3.5Å
1250	W	28.5	Very low	27.1	Very low	149 Å²	149	128.6 Å²	128.6	56%	0.564	73%	0.73	S	S	*	*			trans	-134.6	73.6	175.6	-75.8	79.7	0	0	0	111.5	R933 D1248	R933-W1250 HydrophobicContact CG-CZ3 4.29Å; D1248-W1250 VanDerWaalsContact C-N 3.33Å; D1248-W1250 PolarHBondContact O-N 3.47Å
1251	V	28	Very low	26.5	Very low	109 Å²	109	128.3 Å²	128.3	66%	0.661	72%	0.723	S	S	*	*			trans	-135.6	0	162.3	-179.3	0	0	0	0	107.6

Retrieved 1,251 of 1,251 residues in 5094.7 ms (Link to these results)

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