A0A3Q0KR22_SCHMA Loading...

Condensin complex subunit 2

AlphaFold DB , UniProt , Accession A0A3Q0KR22, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 911 aa.

						>A0A3Q0KR22_SCHMA|A0A3Q0KR22
MLLSESRANLFDSFKADSPGDEFSKPKKCLKSGSSPQKSLNMVILQDENDDDDERLARRKSRLLEPHPASVNSPGANSTAARRRADAAAPRGIPQAQIGEHYGNCIRLAAENKITAKNAFNLHLIDYMSEMIKKEDFASFQIASSSLDAGAKIYAGRVDAVHQETYQVLTGLGRSGNPQNEDNESNADNVDDDDKTHSHSKPEQKKKTAAHRDIIHKQLNKIRIKTLADKIDVDPLFQHQTAAYDEGGTAELRLNQLSTANASCELILDSSTPVMLRTLTTTQPITPMNVTNVTEFLSSMLARSLNQLSICSTLQNFRFTDWDLNKNSFDSNSQMNWDANSQPISLLNQDNNDDGDDNGFNPFPVQDDSFCDNIHEDINLDPVFETGVQVEVNGSSAEAVNNNIRSDNLLANIPVTENTTATNTNTTTTTADGELFVSCLKNMLDKQYEHFGKLNDYLLGMWAGPEHWRKKAKRPKLDGAVKLNEDNPEKNFEHESGENEMGIVDKVIISRKMTKSKRDKAQRISYAETIKPSENRTRSGRLSRRDWLKNVLSSGVENSTASNSTIFKETYRQKANRQMNMLPSEWSDSRQTLYQLVNRDVILRPNILLDGRNLTNCNNITSENADYMVGTNELCAVLNVGSADRPVDNEYEDADGGLDQLRNHQDDDDDDDDAIIPFECAFTQNAGYNDGELTDMELISQPNKVARIEIGYARTAKMINVQRLKCAMWGFLEHTVPHVGLNIPSQSPLSVASTTSAPDANSLVDDQTSLNVNENQQQYPMNEDVIESDSGRTSYLPKVHGARGFSEVIDNLSGRISWQMAKELSISIALNCLLHLSNEKQLYLENVDSFSDIYISQGLPSFELKHLETYTNTCDNGDIISGTKSKSNNQKRNKTQHMRPSTLDSWLIEND
					

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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	41	Very low	33.4	Very low	231 Å²	231	148.8 Å²	148.8	100%	1.138	77%	0.769	S	S	*	*				0	106.9	0	-78.5	159.9	161.2	0	0	106.7
2	L	30.5	Very low	33.2	Very low	143 Å²	143	147.6 Å²	147.6	75%	0.749	77%	0.765	S	S	*	*				84.4	114.4	71.7	-81.7	174.3	0	0	0	111.9
3	L	33.8	Very low	33.1	Very low	142 Å²	142	141.7 Å²	141.7	74%	0.743	74%	0.744	S	S	*	*			trans	69.9	144.7	146.5	-57	165.6	0	0	0	115.9
4	S	34.5	Very low	33.2	Very low	86 Å²	86	144.6 Å²	144.6	60%	0.601	75%	0.748	S	S	*	*			cis	-171.4	153.6	-8.9	45.3	0	0	0	0	108.5
5	E	33.2	Very low	33.3	Very low	167 Å²	167	146.8 Å²	146.8	78%	0.78	75%	0.75	S	S	*	*				19.2	139.3	123.3	-46.9	168.8	105.7	0	0	117
6	S	35.6	Very low	33.6	Very low	90 Å²	90	142.4 Å²	142.4	63%	0.629	74%	0.742	S	S	*	*			cis	-173	152.6	44.7	-114.3	0	0	0	0	108.7
7	R	32	Very low	33.9	Very low	228 Å²	228	143.7 Å²	143.7	86%	0.86	75%	0.75	S	S	*	*				60.7	141.3	86.4	-122.1	179.6	170.1	179	-4.1	112.8
8	A	35.8	Very low	34.2	Very low	73 Å²	73	141.8 Å²	141.8	60%	0.603	75%	0.751	S	S	*	*			cis	-162.9	161	16.4	0	0	0	0	0	113.6
9	N	30.8	Very low	34.8	Very low	135 Å²	135	140.6 Å²	140.6	72%	0.722	75%	0.753	S	S	*	*			trans	22.2	135	133.4	-50.5	-11.4	0	0	0	121.6
10	L	32.5	Very low	35	Very low	158 Å²	158	137 Å²	137	83%	0.827	75%	0.75	S	S	*	*				163.3	118.4	108.4	-98	119.3	0	0	0	108.9
11	F	28.2	Very low	35.1	Very low	184 Å²	184	138.3 Å²	138.3	81%	0.807	76%	0.756	S	S	*	*				59.7	107.2	85.4	-111.9	-86.2	0	0	0	114.9
12	D	30.9	Very low	34.9	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	74%	0.74	S	S	*	*				146.4	142.5	103.5	-149.8	-13.8	0	0	0	115
13	S	32.2	Very low	35.1	Very low	71 Å²	71	137 Å²	137	50%	0.497	74%	0.741	S	S	.	*			trans	87.6	123	137.1	-88.7	0	0	0	0	125.9
14	F	33.9	Very low	34.9	Very low	183 Å²	183	134.4 Å²	134.4	80%	0.803	74%	0.735	S	S	*	*			trans	72.8	141.3	137.4	-73.7	-50.1	0	0	0	120.7
15	K	35.3	Very low	35	Very low	177 Å²	177	139.7 Å²	139.7	77%	0.77	75%	0.747	S	S	*	*			cis	-171.3	159.7	-4	-165.6	173.3	-179.6	177.9	0	111.8
16	A	38.2	Very low	35.1	Very low	76 Å²	76	136.6 Å²	136.6	63%	0.628	74%	0.742	S	S	*	*			trans	67.1	148.1	153.9	0	0	0	0	0	119.5
17	D	38.2	Very low	34.9	Very low	165 Å²	165	141.1 Å²	141.1	88%	0.882	75%	0.75	S	S	*	*			cis	-152.3	169.1	-6.7	-110.1	-32.7	0	0	0	112.5
18	S	38.7	Very low	34.9	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	75%	0.747	S	S	*	*			trans	-91.4	-162.1	-171.1	-140.7	0	0	0	0	113.3
19	P	46.1	Very low	34.6	Very low	119 Å²	119	140.6 Å²	140.6	77%	0.773	75%	0.752	S	S	*	*			cis	-140.2	-173.7	-12.9	37.1	-15.7	0	0	0	116.5
20	G	39.6	Very low	34.6	Very low	68 Å²	68	141.2 Å²	141.2	70%	0.701	75%	0.754	S	S	*	*			trans	113.7	87.7	149.8	0	0	0	0	0	116.9
21	D	36.2	Very low	34.6	Very low	165 Å²	165	142.3 Å²	142.3	88%	0.882	75%	0.753	S	S	*	*				49.7	115.7	91	-87.8	-32.2	0	0	0	116.4
22	E	37.3	Very low	34.7	Very low	169 Å²	169	139 Å²	139	79%	0.79	75%	0.752	S	S	*	*				169.2	132.1	82.6	-152.7	178.5	-179.2	0	0	113.1
23	F	34	Very low	34.9	Very low	176 Å²	176	136.4 Å²	136.4	77%	0.772	76%	0.757	S	S	*	*			trans	46.4	116.4	152.4	-84.4	-115.5	0	0	0	125.3
24	S	30.8	Very low	35.1	Very low	88 Å²	88	139 Å²	139	62%	0.615	78%	0.775	S	S	*	*				77.9	123	120.1	-77.6	0	0	0	0	124.1
25	K	35	Very low	34.9	Very low	197 Å²	197	134.6 Å²	134.6	86%	0.857	77%	0.768	S	S	*	*			trans	89.3	152.1	134.1	-76.9	-179	-179.9	174.2	0	118.9
26	P	37.1	Very low	34.9	Very low	103 Å²	103	132.3 Å²	132.3	67%	0.669	77%	0.77	S	S	*	*			trans	-128.8	168.1	-131.4	41.5	-28.4	0	0	0	115.3
27	K	31	Very low	34.5	Very low	185 Å²	185	137.4 Å²	137.4	80%	0.804	78%	0.782	S	S	*	*			trans	161.3	143.7	130.2	-90.6	160.6	-174.2	176.8	0	113.9
28	K	31.7	Very low	34.3	Very low	186 Å²	186	139.4 Å²	139.4	81%	0.809	78%	0.782	S	S	*	*			trans	76.3	116.7	146.8	-74.8	177.9	174.8	-171.5	0	121.8
29	C	28.6	Very low	33.9	Very low	103 Å²	103	139.4 Å²	139.4	70%	0.696	78%	0.782	S	S	*	*				81.7	124.4	124.4	-77.6	0	0	0	0	122.6
30	L	31.1	Very low	33.1	Very low	148 Å²	148	141.5 Å²	141.5	78%	0.775	79%	0.786	S	S	*	*			trans	67	137.2	136.7	-61.3	166.8	0	0	0	116
31	K	32.1	Very low	32.6	Very low	182 Å²	182	145.6 Å²	145.6	79%	0.791	79%	0.792	S	S	*	*			cis	-166	172.4	12.6	-104.9	174.6	178.3	-178	0	106.6
32	S	31.1	Very low	32.3	Very low	113 Å²	113	144.7 Å²	144.7	79%	0.79	78%	0.784	S	S	*	*			cis	-175.8	147.6	-16.4	47.3	0	0	0	0	110.4
33	G	34.6	Very low	32.1	Very low	81 Å²	81	141.9 Å²	141.9	84%	0.835	78%	0.778	S	S	*	*			trans	119.8	151.3	168.5	0	0	0	0	0	113.8
34	S	36.4	Very low	32.2	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	77%	0.774	S	S	*	*			cis	-154.1	158.3	-11.8	-171.4	0	0	0	0	109.7
35	S	31.1	Very low	32.6	Very low	91 Å²	91	142.4 Å²	142.4	64%	0.636	78%	0.78	S	S	*	*			trans	-67.6	166.2	-171	-162.4	0	0	0	0	114.8	Q37	S35-Q37 PolarHBondContact OG-N 3.36Å
36	P	34.3	Very low	32.9	Very low	128 Å²	128	140 Å²	140	83%	0.831	77%	0.772	S	S	*	*				-131	164.5	93.8	37.7	-29	0	0	0	115.6
37	Q	29.7	Very low	33.4	Very low	184 Å²	184	142.8 Å²	142.8	86%	0.86	78%	0.781	S	S	*	*			trans	-77.5	143.9	-167.5	-60.4	157.3	-82.4	0	0	114	S35	S35-Q37 PolarHBondContact OG-N 3.36Å
38	K	34.9	Very low	34.5	Very low	206 Å²	206	142.8 Å²	142.8	90%	0.896	78%	0.784	S	S	*	*			trans	-142	136.4	142	-103.9	-179.4	-179.7	-178.1	0	109.3
39	S	28.8	Very low	35.8	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	77%	0.774	S	S	*	*			trans	-69.7	124.2	-172.3	47.2	0	0	0	0	112.8
40	L	30.3	Very low	37.7	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	76%	0.764	S	S	*	*			trans	-102.6	83.4	166.5	-83.4	167.4	0	0	0	109.8	M42	L40-M42 VanDerWaalsContact C-N 3.28Å; L40-M42 PolarHBondContact O-N 2.66Å
41	N	28.7	Very low	39.8	Very low	153 Å²	153	136.7 Å²	136.7	82%	0.818	75%	0.754	S	S	*	*			trans	-80.4	83.8	156.4	-78.2	3.1	0	0	0	107.2	V43	N41-V43 PolarHBondContact O-N 3.21Å
42	M	30.2	Very low	41.7	Very low	146 Å²	146	133.2 Å²	133.2	72%	0.719	74%	0.744	S	S	*	*			trans	-89.8	89.6	168.9	-166.8	-177.4	78.6	0	0	107.9	L40 I44	L40-M42 VanDerWaalsContact C-N 3.28Å; L40-M42 PolarHBondContact O-N 2.66Å; M42-I44 HydrophobicContact CE-CD1 4.5Å; M42-I44 HydrophobicContact CE-CG1 4.11Å; M42-I44 PolarHBondContact O-N 3.49Å; M42-I44 VanDerWaalsContact O-N 3.13Å
43	V	32.3	Very low	43.9	Very low	110 Å²	110	132 Å²	132	67%	0.667	73%	0.729	S	S	*	*			trans	-61.1	114.7	169.3	-174.6	0	0	0	0	106.9	N41 L45	N41-V43 PolarHBondContact O-N 3.21Å; V43-L45 HydrophobicContact CB-CG 4.48Å; V43-L45 HydrophobicContact CG1-CD2 3.73Å; V43-L45 HydrophobicContact CG1-CG 3.79Å; V43-L45 PolarHBondContact O-N 3.23Å
44	I	35.6	Very low	45.8	Very low	135 Å²	135	131.7 Å²	131.7	69%	0.692	71%	0.706	S	S	*	*			trans	-77.4	80.2	165.5	-58.3	176.1	0	0	0	105.4	M42 Q46	M42-I44 HydrophobicContact CE-CD1 4.5Å; M42-I44 HydrophobicContact CE-CG1 4.11Å; M42-I44 PolarHBondContact O-N 3.49Å; M42-I44 VanDerWaalsContact O-N 3.13Å; I44-Q46 PolarHBondContact O-N 3.38Å
45	L	39.9	Very low	47.6	Very low	141 Å²	141	132.1 Å²	132.1	74%	0.738	69%	0.688	S	S	*	*			trans	-61.2	116.8	159.6	-67.5	176.7	0	0	0	105.5	V43 D47	V43-L45 HydrophobicContact CB-CG 4.48Å; V43-L45 HydrophobicContact CG1-CD2 3.73Å; V43-L45 HydrophobicContact CG1-CG 3.79Å; V43-L45 PolarHBondContact O-N 3.23Å; L45-D47 PolarHBondContact O-N 3.33Å
46	Q	42.5	Very low	49.8	Very low	146 Å²	146	131.1 Å²	131.1	68%	0.682	68%	0.676	S	S	*	*			trans	-69.5	116.7	165.4	-71	172.5	8.4	0	0	105.2	I44 E48	I44-Q46 PolarHBondContact O-N 3.38Å; Q46-E48 PolarHBondContact O-N 3.23Å
47	D	47.1	Very low	51.8	Low	161 Å²	161	127.5 Å²	127.5	86%	0.861	66%	0.656	S	S	*	*			trans	-51.3	116	170.5	-69.7	-47.4	0	0	0	107.7	L45 N49	L45-D47 PolarHBondContact O-N 3.33Å; D47-N49 PolarHBondContact O-N 3.2Å
48	E	53.3	Low	53.9	Low	186 Å²	186	124.2 Å²	124.2	87%	0.869	64%	0.636	S	S	*	*			trans	-60.2	128	165.2	-69.9	-175	130.3	0	0	106.7	Q46 D50	Q46-E48 PolarHBondContact O-N 3.23Å; E48-D50 PolarHBondContact O-N 3.37Å
49	N	58.9	Low	55.9	Low	111 Å²	111	121.8 Å²	121.8	59%	0.594	62%	0.621	S	S	*	*			trans	-74.3	78.5	177.1	-176.3	91.9	0	0	0	108.6	D47 D51	D47-N49 PolarHBondContact O-N 3.2Å; N49-D51 PolarHBondContact ND2-OD1 3.12Å; N49-D51 PolarHBondContact O-N 2.88Å
50	D	70.1	Confident	58	Low	89 Å²	89	121.8 Å²	121.8	48%	0.476	61%	0.607	S	S	.	*			trans	-63.8	100.3	168.4	-176.7	-19.6	0	0	0	107.9	E48 D52 D53 E54	E48-D50 PolarHBondContact O-N 3.37Å; D50-D52 PolarHBondContact O-N 3.24Å; D50-D52 WeakPolarHBondContact OD1-CA 3.2Å; D50-D52 WeakPolarHBondContact OD1-CB 3.32Å; D50-D52 PolarHBondContact OD1-N 2.99Å; D50-D53 HydrophobicContact CB-CB 3.96Å; D50-D53 PolarHBondContact O-N 2.79Å; D50-D53 PolarHBondContact OD1-N 3.28Å; D50-E54 WeakPolarHBondContact O-CB 3.41Å; D50-E54 PolarHBondContact O-N 3.4Å
51	D	73.9	Confident	59.7	Low	109 Å²	109	117.1 Å²	117.1	58%	0.583	59%	0.588	S	S	*	*	H	α-helix	trans	-59.1	-27.6	179.1	-85.8	-27.2	0	0	0	112.1	N49 R55	N49-D51 PolarHBondContact ND2-OD1 3.12Å; N49-D51 PolarHBondContact O-N 2.88Å; D51-R55 WeakPolarHBondContact O-CB 3.3Å; D51-R55 PolarHBondContact O-N 2.74Å
52	D	71.8	Confident	61.3	Low	108 Å²	108	119.7 Å²	119.7	58%	0.578	59%	0.586	S	S	*	*	H	α-helix	trans	-80.9	-38.3	176.9	-91.2	-29.4	0	0	0	111.6	D50 R55 L56	D50-D52 PolarHBondContact O-N 3.24Å; D50-D52 WeakPolarHBondContact OD1-CA 3.2Å; D50-D52 WeakPolarHBondContact OD1-CB 3.32Å; D50-D52 PolarHBondContact OD1-N 2.99Å; D52-R55 CarbonylContact O-C 3.56Å; D52-R55 PolarHBondContact O-N 2.95Å; D52-L56 VanDerWaalsContact O-CB 3.27Å; D52-L56 WeakPolarHBondContact O-CB 3.39Å; D52-L56 PolarHBondContact O-N 2.88Å
53	D	77.2	Confident	62.6	Low	87 Å²	87	120.2 Å²	120.2	47%	0.465	59%	0.591	S	S	.	*	H	α-helix	trans	-74.5	-30.5	173.7	-141.5	23.1	0	0	0	112.3	D50 L56 A57	D50-D53 HydrophobicContact CB-CB 3.96Å; D50-D53 PolarHBondContact O-N 2.79Å; D50-D53 PolarHBondContact OD1-N 3.28Å; D53-L56 PolarHBondContact O-N 2.87Å; D53-A57 WeakPolarHBondContact O-CB 3.4Å; D53-A57 PolarHBondContact O-N 3.4Å
54	E	74.4	Confident	63.6	Low	75 Å²	75	121.5 Å²	121.5	35%	0.35	59%	0.594	S	S	.	*	H	α-helix	trans	-67.1	-37.7	168.2	-152.3	-134.8	136.1	0	0	110.9	D50 A57 R58	D50-E54 WeakPolarHBondContact O-CB 3.41Å; D50-E54 PolarHBondContact O-N 3.4Å; E54-A57 PolarHBondContact O-N 3.25Å; E54-R58 WeakPolarHBondContact O-CB 3.48Å; E54-R58 WeakPolarHBondContact O-CG 3.31Å; E54-R58 PolarHBondContact O-N 3.22Å; E54-R58 IonicContact OE1-CZ 2.99Å; E54-R58 IonicContact OE1-NE 2.9Å; E54-R58 PolarHBondContact OE1-NE 2.85Å; E54-R58 IonicContact OE1-NH2 3.31Å; E54-R58 PolarHBondContact OE1-NH2 2.82Å; E54-R58 IonicContact OE2-CZ 3.03Å; E54-R58 IonicContact OE2-NE 3.7Å; E54-R58 IonicContact OE2-NH2 3.56Å; E54-R58 PolarHBondContact OE2-NH2 2.93Å
55	R	75.5	Confident	64.1	Low	134 Å²	134	122.4 Å²	122.4	51%	0.506	60%	0.595	S	S	.	*	H	α-helix	trans	-70.7	-32.4	173.8	-173.8	-179.9	-159.2	170.2	7.1	112.2	D51 D52 R59	D51-R55 WeakPolarHBondContact O-CB 3.3Å; D51-R55 PolarHBondContact O-N 2.74Å; D52-R55 CarbonylContact O-C 3.56Å; D52-R55 PolarHBondContact O-N 2.95Å; R55-R59 WeakPolarHBondContact O-CG 3.07Å; R55-R59 PolarHBondContact O-N 2.96Å; R55-R59 VanDerWaalsContact O-N 3.12Å
56	L	77.6	Confident	64.2	Low	71 Å²	71	121.4 Å²	121.4	37%	0.372	60%	0.597	S	S	.	*	H	α-helix	trans	-73	-40.4	173.2	-151.3	76.6	0	0	0	110.6	D52 D53 R59 K60	D52-L56 VanDerWaalsContact O-CB 3.27Å; D52-L56 WeakPolarHBondContact O-CB 3.39Å; D52-L56 PolarHBondContact O-N 2.88Å; D53-L56 PolarHBondContact O-N 2.87Å; L56-R59 CarbonylContact O-C 3.57Å; L56-R59 WeakPolarHBondContact O-CB 3.42Å; L56-R59 PolarHBondContact O-N 3.35Å; L56-R59 VanDerWaalsContact O-N 3.15Å; L56-K60 WeakPolarHBondContact O-CB 3.28Å; L56-K60 VanDerWaalsContact O-CG 3.31Å; L56-K60 WeakPolarHBondContact O-CG 3.35Å; L56-K60 PolarHBondContact O-N 2.9Å
57	A	76.2	Confident	64.2	Low	51 Å²	51	122.9 Å²	122.9	42%	0.421	60%	0.603	S	S	.	*	H	α-helix	trans	-63.7	-43	173.2	0	0	0	0	0	111.3	D53 E54 R59 K60 S61	D53-A57 WeakPolarHBondContact O-CB 3.4Å; D53-A57 PolarHBondContact O-N 3.4Å; E54-A57 PolarHBondContact O-N 3.25Å; A57-R59 VanDerWaalsContact C-N 3.27Å; A57-R59 PolarHBondContact O-N 2.9Å; A57-K60 PolarHBondContact O-N 2.78Å; A57-S61 WeakPolarHBondContact O-CB 3.44Å; A57-S61 PolarHBondContact O-N 3.45Å; A57-S61 PolarHBondContact O-OG 3.32Å; A57-S61 VanDerWaalsContact O-OG 3.12Å
58	R	74	Confident	63.9	Low	116 Å²	116	121 Å²	121	44%	0.438	60%	0.6	S	S	.	*	H	α-helix	trans	-64.4	-26.6	171.5	-75.1	-168.7	-118.9	118.7	-12.4	113.4	E54 S61 R62	E54-R58 WeakPolarHBondContact O-CB 3.48Å; E54-R58 WeakPolarHBondContact O-CG 3.31Å; E54-R58 PolarHBondContact O-N 3.22Å; E54-R58 IonicContact OE1-CZ 2.99Å; E54-R58 IonicContact OE1-NE 2.9Å; E54-R58 PolarHBondContact OE1-NE 2.85Å; E54-R58 IonicContact OE1-NH2 3.31Å; E54-R58 PolarHBondContact OE1-NH2 2.82Å; E54-R58 IonicContact OE2-CZ 3.03Å; E54-R58 IonicContact OE2-NE 3.7Å; E54-R58 IonicContact OE2-NH2 3.56Å; E54-R58 PolarHBondContact OE2-NH2 2.93Å; R58-S61 PolarHBondContact O-OG 2.9Å; R58-R62 WeakPolarHBondContact O-CD 3.38Å; R58-R62 VanDerWaalsContact O-CG 3.25Å; R58-R62 WeakPolarHBondContact O-CG 3.49Å
59	R	75.1	Confident	62.9	Low	154 Å²	154	117.3 Å²	117.3	58%	0.581	60%	0.601	S	S	*	*	H	α-helix	trans	-77.4	-42.1	170.8	-78	170.7	171	155.6	-4.5	111.9	R55 L56 A57 L63	R55-R59 WeakPolarHBondContact O-CG 3.07Å; R55-R59 PolarHBondContact O-N 2.96Å; R55-R59 VanDerWaalsContact O-N 3.12Å; L56-R59 CarbonylContact O-C 3.57Å; L56-R59 WeakPolarHBondContact O-CB 3.42Å; L56-R59 PolarHBondContact O-N 3.35Å; L56-R59 VanDerWaalsContact O-N 3.15Å; A57-R59 VanDerWaalsContact C-N 3.27Å; A57-R59 PolarHBondContact O-N 2.9Å; R59-L63 PolarHBondContact O-N 2.93Å
60	K	73.5	Confident	61.9	Low	111 Å²	111	117 Å²	117	48%	0.483	61%	0.608	S	S	.	*	H	α-helix	trans	-67.7	-41.6	177.5	-72.4	168.5	-179.2	168.7	0	111.8	L56 A57 L63 L64	L56-K60 WeakPolarHBondContact O-CB 3.28Å; L56-K60 VanDerWaalsContact O-CG 3.31Å; L56-K60 WeakPolarHBondContact O-CG 3.35Å; L56-K60 PolarHBondContact O-N 2.9Å; A57-K60 PolarHBondContact O-N 2.78Å; K60-L63 CarbonylContact O-C 3.56Å; K60-L63 WeakPolarHBondContact O-CA 3.45Å; K60-L63 WeakPolarHBondContact O-CB 3.45Å; K60-L63 PolarHBondContact O-N 3.41Å; K60-L64 WeakPolarHBondContact O-CB 3.23Å; K60-L64 PolarHBondContact O-N 2.97Å
61	S	66.6	Low	60.3	Low	65 Å²	65	118.5 Å²	118.5	46%	0.455	62%	0.62	S	S	.	*	H	α-helix	trans	-66.3	-41.5	178.9	66.1	0	0	0	0	112	A57 R58 L63 L64 E65	A57-S61 WeakPolarHBondContact O-CB 3.44Å; A57-S61 PolarHBondContact O-N 3.45Å; A57-S61 PolarHBondContact O-OG 3.32Å; A57-S61 VanDerWaalsContact O-OG 3.12Å; R58-S61 PolarHBondContact O-OG 2.9Å; S61-L63 PolarHBondContact O-N 2.96Å; S61-L63 VanDerWaalsContact O-N 3.11Å; S61-L64 CarbonylContact O-C 3.46Å; S61-L64 PolarHBondContact O-N 3.41Å; S61-E65 WeakPolarHBondContact O-CB 3.46Å; S61-E65 PolarHBondContact O-N 3.5Å
62	R	60.8	Low	58.5	Low	208 Å²	208	120.4 Å²	120.4	79%	0.785	63%	0.63	S	S	*	*	H	α-helix	trans	-61.3	-15.1	169.7	-74.5	177.2	179.8	-176.8	1.1	114.3	R58	R58-R62 WeakPolarHBondContact O-CD 3.38Å; R58-R62 VanDerWaalsContact O-CG 3.25Å; R58-R62 WeakPolarHBondContact O-CG 3.49Å
63	L	57.7	Low	56.6	Low	157 Å²	157	121.2 Å²	121.2	82%	0.822	64%	0.644	S	S	*	*	H	α-helix	trans	-97.9	-16.1	174.8	-152.6	97.6	0	0	0	112.9	R59 K60 S61	R59-L63 PolarHBondContact O-N 2.93Å; K60-L63 CarbonylContact O-C 3.56Å; K60-L63 WeakPolarHBondContact O-CA 3.45Å; K60-L63 WeakPolarHBondContact O-CB 3.45Å; K60-L63 PolarHBondContact O-N 3.41Å; S61-L63 PolarHBondContact O-N 2.96Å; S61-L63 VanDerWaalsContact O-N 3.11Å
64	L	55.2	Low	54.9	Low	137 Å²	137	122.1 Å²	122.1	72%	0.717	66%	0.655	S	S	*	*	H	α-helix	trans	-114.8	-7.6	-173.3	-79.7	162.8	0	0	0	113.7	K60 S61 P66	K60-L64 WeakPolarHBondContact O-CB 3.23Å; K60-L64 PolarHBondContact O-N 2.97Å; S61-L64 CarbonylContact O-C 3.46Å; S61-L64 PolarHBondContact O-N 3.41Å; L64-P66 WeakPolarHBondContact O-CD 3.47Å
65	E	45.5	Very low	53.2	Low	154 Å²	154	121.5 Å²	121.5	72%	0.72	67%	0.668	S	S	*	*	S	Bend	trans	-66.3	120.4	178.7	-165.2	165.7	-153.2	0	0	110.4	S61 H67	S61-E65 WeakPolarHBondContact O-CB 3.46Å; S61-E65 PolarHBondContact O-N 3.5Å; E65-H67 PolarHBondContact O-N 3.03Å
66	P	41.2	Very low	51.4	Low	119 Å²	119	118.9 Å²	118.9	77%	0.773	68%	0.676	S	S	*	*			trans	-75.7	96.8	-171.4	29.4	-34.3	0	0	0	110.7	L64	L64-P66 WeakPolarHBondContact O-CD 3.47Å
67	H	42.2	Very low	49.7	Very low	178 Å²	178	124 Å²	124	82%	0.824	70%	0.703	S	S	*	*			trans	-53.8	133.2	169.3	-90.4	-68.6	0	0	0	110.6	E65 A69	E65-H67 PolarHBondContact O-N 3.03Å; H67-A69 PolarHBondContact O-N 3.24Å
68	P	41.6	Very low	48.1	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	71%	0.713	S	S	*	*			trans	-61.2	128.7	179.3	24.7	-33.5	0	0	0	110.3	S70	P68-S70 PolarHBondContact O-N 2.93Å; P68-S70 VanDerWaalsContact O-N 3.08Å
69	A	32.7	Very low	46.5	Very low	110 Å²	110	121.6 Å²	121.6	91%	0.909	70%	0.7	S	S	*	*			trans	-65.4	108.6	-171	0	0	0	0	0	112.4	H67	H67-A69 PolarHBondContact O-N 3.24Å
70	S	37.5	Very low	44.9	Very low	105 Å²	105	117.5 Å²	117.5	73%	0.734	70%	0.699	S	S	*	*			trans	-152.7	99.1	160.4	-162.6	0	0	0	0	110.9	P68	P68-S70 PolarHBondContact O-N 2.93Å; P68-S70 VanDerWaalsContact O-N 3.08Å
71	V	35.8	Very low	43.4	Very low	120 Å²	120	115.7 Å²	115.7	73%	0.727	71%	0.705	S	S	*	*	S	Bend	trans	43	116.4	160.4	-86.8	0	0	0	0	120.7
72	N	35.6	Very low	42.2	Very low	149 Å²	149	121.1 Å²	121.1	80%	0.797	72%	0.715	S	S	*	*			trans	80.7	82.6	148	-53.2	-18.7	0	0	0	119
73	S	32.8	Very low	41.4	Very low	124 Å²	124	119.4 Å²	119.4	87%	0.867	71%	0.709	S	S	*	*			trans	-105.4	109.6	166.5	-56.5	0	0	0	0	111.7
74	P	41.7	Very low	40.7	Very low	107 Å²	107	121.8 Å²	121.8	70%	0.695	71%	0.707	S	S	*	*			trans	-78.6	132.9	173.5	-8.5	25.5	0	0	0	111.2
75	G	37.6	Very low	40.1	Very low	61 Å²	61	117.1 Å²	117.1	63%	0.629	69%	0.688	S	S	*	*			trans	-57.8	140.8	-170.7	0	0	0	0	0	115.8	N77	G75-N77 PolarHBondContact O-N 3.4Å; G75-N77 VanDerWaalsContact O-N 3.08Å
76	A	39.6	Very low	39.9	Very low	80 Å²	80	115.5 Å²	115.5	66%	0.661	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	105.4	165.1	0	0	0	0	0	109
77	N	41.1	Very low	40.2	Very low	178 Å²	178	114 Å²	114	95%	0.952	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.5	-15.5	160.3	-90.8	-14.8	0	0	0	111.1	G75	G75-N77 PolarHBondContact O-N 3.4Å; G75-N77 VanDerWaalsContact O-N 3.08Å
78	S	41.8	Very low	40.2	Very low	89 Å²	89	107.8 Å²	107.8	62%	0.622	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.4	-10.1	173.1	-166	0	0	0	0	113.7
79	T	40.9	Very low	40.5	Very low	27 Å²	27	103.2 Å²	103.2	17%	0.166	63%	0.634	C	S	.	*	H	α-helix	trans	-82.9	-14.2	-168.2	54.4	0	0	0	0	115.7	A81 R82 R83	T79-A81 VanDerWaalsContact C-N 3.33Å; T79-R82 PolarHBondContact O-N 2.86Å; T79-R83 WeakPolarHBondContact O-CB 3.46Å; T79-R83 VanDerWaalsContact O-CG 3.32Å; T79-R83 WeakPolarHBondContact O-CG 3.42Å; T79-R83 PolarHBondContact O-N 3.01Å
80	A	42.5	Very low	41.3	Very low	68 Å²	68	101.4 Å²	101.4	56%	0.562	61%	0.613	S	S	*	*	H	α-helix	trans	-69.1	-33	175.9	0	0	0	0	0	112.2	R84	A80-R84 PolarHBondContact O-N 3.23Å
81	A	41.8	Very low	41.9	Very low	73 Å²	73	106.6 Å²	106.6	60%	0.603	62%	0.616	S	S	*	*	H	α-helix	trans	-72.7	-42.6	172.1	0	0	0	0	0	111.6	T79 R84 A85	T79-A81 VanDerWaalsContact C-N 3.33Å; A81-R84 PolarHBondContact O-N 2.85Å; A81-A85 PolarHBondContact O-N 3.18Å; A81-A85 VanDerWaalsContact O-N 3.14Å
82	R	41.1	Very low	42.8	Very low	179 Å²	179	103.7 Å²	103.7	68%	0.675	61%	0.611	S	S	*	*	H	α-helix	trans	-64.4	-44.8	175.3	-82.5	-171.4	174.5	-171.2	-1.4	113.3	T79 R84 A85 D86	T79-R82 PolarHBondContact O-N 2.86Å; R82-R84 PolarHBondContact O-N 3.26Å; R82-A85 CarbonylContact O-C 3.49Å; R82-A85 WeakPolarHBondContact O-CA 3.45Å; R82-A85 WeakPolarHBondContact O-CB 3.41Å; R82-A85 PolarHBondContact O-N 3.33Å; R82-D86 PolarHBondContact O-N 3.06Å
83	R	43.3	Very low	44.1	Very low	173 Å²	173	98.5 Å²	98.5	65%	0.653	58%	0.583	S	S	*	*	H	α-helix	trans	-64.5	-25.7	177.5	-68.7	-179	-149.7	162.3	6	113.5	T79 A87	T79-R83 WeakPolarHBondContact O-CB 3.46Å; T79-R83 VanDerWaalsContact O-CG 3.32Å; T79-R83 WeakPolarHBondContact O-CG 3.42Å; T79-R83 PolarHBondContact O-N 3.01Å; R83-A87 WeakPolarHBondContact O-CB 3.24Å; R83-A87 PolarHBondContact O-N 3.05Å
84	R	43.8	Very low	45.8	Very low	207 Å²	207	96.2 Å²	96.2	78%	0.781	57%	0.565	S	S	*	*	H	α-helix	trans	-74.6	-27.5	168	-77.1	-178.3	178.2	142.6	-1.1	113	A80 A81 R82 A88	A80-R84 PolarHBondContact O-N 3.23Å; A81-R84 PolarHBondContact O-N 2.85Å; R82-R84 PolarHBondContact O-N 3.26Å; R84-A88 WeakPolarHBondContact O-CB 3.35Å
85	A	42.1	Very low	46.9	Very low	39 Å²	39	97.2 Å²	97.2	32%	0.322	56%	0.56	S	S	.	*	H	α-helix	trans	-83.6	-25.7	175.4	0	0	0	0	0	113.7	A81 R82	A81-A85 PolarHBondContact O-N 3.18Å; A81-A85 VanDerWaalsContact O-N 3.14Å; R82-A85 CarbonylContact O-C 3.49Å; R82-A85 WeakPolarHBondContact O-CA 3.45Å; R82-A85 WeakPolarHBondContact O-CB 3.41Å; R82-A85 PolarHBondContact O-N 3.33Å
86	D	42.2	Very low	48.3	Very low	120 Å²	120	98.8 Å²	98.8	64%	0.642	57%	0.567	S	S	*	*	H	α-helix	trans	-87.7	-14.6	176.7	-62.5	-38.8	0	0	0	112.6	R82	R82-D86 PolarHBondContact O-N 3.06Å
87	A	46.5	Very low	49.9	Very low	88 Å²	88	99.3 Å²	99.3	73%	0.727	56%	0.556	S	S	*	*	S	Bend	trans	-95.1	1.6	170.5	0	0	0	0	0	113.4	R83	R83-A87 WeakPolarHBondContact O-CB 3.24Å; R83-A87 PolarHBondContact O-N 3.05Å
88	A	41.7	Very low	51.6	Low	47 Å²	47	91.6 Å²	91.6	39%	0.388	52%	0.515	S	S	.	.	S	Bend	trans	-107.1	93.9	179.7	0	0	0	0	0	110.2	R84	R84-A88 WeakPolarHBondContact O-CB 3.35Å
89	A	48.7	Very low	53.4	Low	24 Å²	24	89.5 Å²	89.5	20%	0.198	51%	0.507	C	S	.	.	S	Bend	trans	59.1	150.2	-179	0	0	0	0	0	117.3	R91 D126	A89-R91 PolarHBondContact O-N 3.36Å; A89-D126 HydrophobicContact CB-CB 3.57Å
90	P	49.5	Very low	55.5	Low	71 Å²	71	94.7 Å²	94.7	46%	0.461	53%	0.529	S	S	.	.			trans	-63.1	120.4	161.8	28.5	-31.9	0	0	0	108.7	G92 H123 Y127	P90-G92 PolarHBondContact O-N 3.28Å; P90-H123 VanDerWaalsContact CD-NE2 3.27Å; P90-H123 WeakPolarHBondContact CD-NE2 3.41Å; P90-Y127 PolarHBondContact O-OH 2.98Å
91	R	50.4	Low	57.5	Low	214 Å²	214	92.8 Å²	92.8	81%	0.808	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	37	167	-67.4	-178.2	171.8	-168.5	-4.6	112.3	A89	A89-R91 PolarHBondContact O-N 3.36Å
92	G	54.4	Low	59.7	Low	60 Å²	60	91 Å²	91	62%	0.619	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-16.5	-170.8	0	0	0	0	0	115	P90 P94	P90-G92 PolarHBondContact O-N 3.28Å; G92-P94 WeakPolarHBondContact O-CD 3.41Å
93	I	62.3	Low	61.9	Low	40 Å²	40	84.2 Å²	84.2	21%	0.205	47%	0.472	C	S	.	.	S	Bend	trans	-83.5	117.2	176.4	-54.4	-171.8	0	0	0	108.9	Q97 I98 Y127	I93-Q97 HydrophobicContact CG2-CB 3.68Å; I93-Q97 HydrophobicContact CG2-CG 3.89Å; I93-I98 HydrophobicContact CG2-CG1 4.1Å; I93-Y127 HydrophobicContact CD1-CE2 4Å
94	P	69.6	Low	64.2	Low	75 Å²	75	78.7 Å²	78.7	49%	0.487	46%	0.455	S	S	.	.			trans	-63.5	150	177.8	25	-33	0	0	0	111.6	G92 A96 Q97 I98	G92-P94 WeakPolarHBondContact O-CD 3.41Å; P94-A96 PolarHBondContact O-N 3.12Å; P94-Q97 HydrophobicContact CG-CB 3.95Å; P94-Q97 PolarHBondContact O-N 3.47Å; P94-I98 PolarHBondContact O-N 3.5Å
95	Q	62.8	Low	66.5	Low	129 Å²	129	68.8 Å²	68.8	60%	0.603	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-32.3	-174.8	-162	82.8	-26.2	0	0	114.4
96	A	67.6	Low	68.8	Low	94 Å²	94	68.7 Å²	68.7	78%	0.777	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-35.4	177.2	0	0	0	0	0	113.4	P94	P94-A96 PolarHBondContact O-N 3.12Å
97	Q	74.3	Confident	71.2	Confident	91 Å²	91	69.6 Å²	69.6	43%	0.425	41%	0.406	S	S	.	.	H	α-helix	trans	-82.7	-14.2	-178.7	-168.5	173.1	29.6	0	0	112.3	I93 P94 G99 E100 H101	I93-Q97 HydrophobicContact CG2-CB 3.68Å; I93-Q97 HydrophobicContact CG2-CG 3.89Å; P94-Q97 HydrophobicContact CG-CB 3.95Å; P94-Q97 PolarHBondContact O-N 3.47Å; Q97-G99 VanDerWaalsContact C-N 3.28Å; Q97-G99 PolarHBondContact O-N 3.07Å; Q97-E100 PolarHBondContact O-N 3.16Å; Q97-H101 WeakPolarHBondContact O-CB 3.46Å; Q97-H101 PolarHBondContact O-N 3.21Å
98	I	75.2	Confident	73.4	Confident	16 Å²	16	66.9 Å²	66.9	8%	0.082	38%	0.379	C	S	.	.	H	α-helix	trans	-59.4	-36.6	170	-89.8	161.7	0	0	0	112.1	I93 P94 Y102 Y127	I93-I98 HydrophobicContact CG2-CG1 4.1Å; P94-I98 PolarHBondContact O-N 3.5Å; I98-Y102 WeakPolarHBondContact O-CB 3.27Å; I98-Y102 PolarHBondContact O-N 2.93Å; I98-Y127 HydrophobicContact CD1-CD1 3.76Å; I98-Y127 HydrophobicContact CD1-CE1 3.86Å; I98-Y127 HydrophobicContact CD1-CG 4.22Å; I98-Y127 HydrophobicContact CG1-CD1 4.19Å; I98-Y127 HydrophobicContact CG1-CD2 4.21Å; I98-Y127 HydrophobicContact CG1-CE1 4.29Å; I98-Y127 HydrophobicContact CG1-CE2 4.29Å; I98-Y127 HydrophobicContact CG1-CG 4.17Å
99	G	80.6	Confident	75.8	Confident	44 Å²	44	64.7 Å²	64.7	45%	0.454	36%	0.361	S	S	.	.	H	α-helix	trans	-68.6	-37.9	175.9	0	0	0	0	0	113.1	Q97 Y102 G103	Q97-G99 VanDerWaalsContact C-N 3.28Å; Q97-G99 PolarHBondContact O-N 3.07Å; G99-Y102 WeakPolarHBondContact O-CB 3.26Å; G99-G103 PolarHBondContact O-N 3.37Å
100	E	84	Confident	77.9	Confident	136 Å²	136	67.3 Å²	67.3	64%	0.636	38%	0.383	S	S	*	.	H	α-helix	trans	-68.6	-46.8	174.5	-176.6	-177.7	-167.6	0	0	111.4	Q97 Y102 G103 N104	Q97-E100 PolarHBondContact O-N 3.16Å; E100-Y102 VanDerWaalsContact C-N 3.3Å; E100-Y102 PolarHBondContact O-N 3.4Å; E100-G103 PolarHBondContact O-N 3.05Å; E100-N104 WeakPolarHBondContact O-CB 3.2Å; E100-N104 PolarHBondContact O-N 3.46Å
101	H	84.8	Confident	79.9	Confident	29 Å²	29	68.1 Å²	68.1	13%	0.134	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-39.4	175.9	-178.7	-78.6	0	0	0	111.4	Q97 N104 C105 H123	Q97-H101 WeakPolarHBondContact O-CB 3.46Å; Q97-H101 PolarHBondContact O-N 3.21Å; H101-N104 PolarHBondContact O-N 2.92Å; H101-C105 PolarHBondContact CE1-SG 3.02Å; H101-C105 PolarHBondContact O-N 3.13Å; H101-C105 PolarHBondContact O-SG 2.88Å; H101-H123 PolarHBondContact CE1-N 2.94Å; H101-H123 VanDerWaalsContact CE1-N 3.35Å
102	Y	88.1	Confident	81.8	Confident	36 Å²	36	63.6 Å²	63.6	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-57.2	-56.2	170.7	172.5	-99.6	0	0	0	111.4	I98 G99 E100 N104 C105 I106 L124 M131 F137 I142 S146	I98-Y102 WeakPolarHBondContact O-CB 3.27Å; I98-Y102 PolarHBondContact O-N 2.93Å; G99-Y102 WeakPolarHBondContact O-CB 3.26Å; E100-Y102 VanDerWaalsContact C-N 3.3Å; E100-Y102 PolarHBondContact O-N 3.4Å; Y102-N104 PolarHBondContact O-N 2.73Å; Y102-C105 WeakPolarHBondContact O-CB 3.35Å; Y102-C105 PolarHBondContact O-N 3.14Å; Y102-I106 HydrophobicContact CD1-CG1 4.34Å; Y102-I106 HydrophobicContact CD2-CG1 4.32Å; Y102-I106 HydrophobicContact CE1-CG1 3.81Å; Y102-I106 HydrophobicContact CE2-CD1 3.77Å; Y102-I106 HydrophobicContact CE2-CG1 3.78Å; Y102-I106 VanDerWaalsContact CZ-CG1 3.48Å; Y102-I106 WeakPolarHBondContact O-CG1 3.35Å; Y102-I106 PolarHBondContact O-N 3.46Å; Y102-L124 HydrophobicContact CD2-CD1 3.59Å; Y102-L124 HydrophobicContact CE2-CD1 4.06Å; Y102-M131 HydrophobicContact CD1-CE 4.18Å; Y102-M131 HydrophobicContact CD2-CE 3.41Å; Y102-M131 VanDerWaalsContact CD2-CE 3.41Å; Y102-M131 HydrophobicContact CD2-SD 3.86Å; Y102-M131 HydrophobicContact CE2-CE 4.06Å; Y102-M131 HydrophobicContact CG-CE 3.5Å; Y102-M131 VanDerWaalsContact CG-CE 3.5Å; Y102-M131 HydrophobicContact CG-SD 4.4Å; Y102-F137 HydrophobicContact CE2-CZ 4.12Å; Y102-I142 HydrophobicContact CE1-CG2 4.49Å; Y102-I142 WeakPolarHBondContact OH-CG2 3.36Å; Y102-I142 PolarHBondContact OH-O 3.22Å; Y102-S146 WeakPolarHBondContact CE2-OG 3.22Å; Y102-S146 PolarHBondContact OH-OG 3.16Å
103	G	88.1	Confident	83.7	Confident	36 Å²	36	66.2 Å²	66.2	37%	0.371	37%	0.367	S	S	.	.	H	α-helix	trans	-57.5	-36.6	178.3	0	0	0	0	0	113	G99 E100 R107	G99-G103 PolarHBondContact O-N 3.37Å; E100-G103 PolarHBondContact O-N 3.05Å; G103-R107 WeakPolarHBondContact O-CB 3.38Å; G103-R107 PolarHBondContact O-N 3.06Å
104	N	90.5	Very high	85	Confident	56 Å²	56	65.5 Å²	65.5	30%	0.299	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-40.8	174.5	-165.9	43	0	0	0	112.5	E100 H101 Y102 R107 L108	E100-N104 WeakPolarHBondContact O-CB 3.2Å; E100-N104 PolarHBondContact O-N 3.46Å; H101-N104 PolarHBondContact O-N 2.92Å; Y102-N104 PolarHBondContact O-N 2.73Å; N104-R107 PolarHBondContact O-N 2.99Å; N104-R107 PolarHBondContact OD1-NH2 3Å; N104-L108 WeakPolarHBondContact O-CB 3.37Å; N104-L108 VanDerWaalsContact O-CG 3.28Å; N104-L108 WeakPolarHBondContact O-CG 3.45Å; N104-L108 PolarHBondContact O-N 3.02Å
105	C	91.9	Very high	86.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-63.7	-44.8	175.2	-67	0	0	0	0	111.9	H101 Y102 R107 L108 A109 L124	H101-C105 PolarHBondContact CE1-SG 3.02Å; H101-C105 PolarHBondContact O-N 3.13Å; H101-C105 PolarHBondContact O-SG 2.88Å; Y102-C105 WeakPolarHBondContact O-CB 3.35Å; Y102-C105 PolarHBondContact O-N 3.14Å; C105-R107 PolarHBondContact O-N 3Å; C105-L108 PolarHBondContact O-N 3.47Å; C105-A109 VanDerWaalsContact O-CB 3.31Å; C105-A109 WeakPolarHBondContact O-CB 3.27Å; C105-A109 PolarHBondContact O-N 3.35Å; C105-L124 HydrophobicContact CB-CB 4.16Å; C105-L124 HydrophobicContact CB-CD2 4Å; C105-L124 HydrophobicContact CB-CG 4.48Å
106	I	91.4	Very high	87.4	Confident	37 Å²	37	60 Å²	60	19%	0.19	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-42.7	176.2	-59.4	-55	0	0	0	110.9	Y102 A109 A110 S145 A149	Y102-I106 HydrophobicContact CD1-CG1 4.34Å; Y102-I106 HydrophobicContact CD2-CG1 4.32Å; Y102-I106 HydrophobicContact CE1-CG1 3.81Å; Y102-I106 HydrophobicContact CE2-CD1 3.77Å; Y102-I106 HydrophobicContact CE2-CG1 3.78Å; Y102-I106 VanDerWaalsContact CZ-CG1 3.48Å; Y102-I106 WeakPolarHBondContact O-CG1 3.35Å; Y102-I106 PolarHBondContact O-N 3.46Å; I106-A109 PolarHBondContact O-N 3.39Å; I106-A110 WeakPolarHBondContact O-CB 3.11Å; I106-A110 PolarHBondContact O-N 2.99Å; I106-S145 WeakPolarHBondContact CD1-O 3.24Å; I106-A149 HydrophobicContact CD1-CB 3.71Å
107	R	92.3	Very high	88.5	Confident	138 Å²	138	64.8 Å²	64.8	52%	0.521	34%	0.342	S	S	.	.	H	α-helix	trans	-63.2	-47.3	176.1	179.3	174.7	58.3	-153.2	-4.2	112.3	G103 N104 C105 A109 A110 E111	G103-R107 WeakPolarHBondContact O-CB 3.38Å; G103-R107 PolarHBondContact O-N 3.06Å; N104-R107 PolarHBondContact O-N 2.99Å; N104-R107 PolarHBondContact OD1-NH2 3Å; C105-R107 PolarHBondContact O-N 3Å; R107-A109 VanDerWaalsContact C-N 3.27Å; R107-A109 PolarHBondContact O-N 3Å; R107-A110 PolarHBondContact O-N 3.48Å; R107-E111 WeakPolarHBondContact CD-OE1 3.4Å; R107-E111 HydrophobicContact CG-CG 4.34Å; R107-E111 WeakPolarHBondContact CG-OE1 3.18Å; R107-E111 WeakPolarHBondContact O-CB 3.25Å; R107-E111 WeakPolarHBondContact O-CG 3.39Å; R107-E111 PolarHBondContact O-N 2.65Å
108	L	92.8	Very high	89.3	Confident	31 Å²	31	62.4 Å²	62.4	16%	0.162	33%	0.332	C	S	.	.	H	α-helix	trans	-62.8	-34.1	177	-72	169.9	0	0	0	112.3	N104 C105 N112 K113 I114 L122	N104-L108 WeakPolarHBondContact O-CB 3.37Å; N104-L108 VanDerWaalsContact O-CG 3.28Å; N104-L108 WeakPolarHBondContact O-CG 3.45Å; N104-L108 PolarHBondContact O-N 3.02Å; C105-L108 PolarHBondContact O-N 3.47Å; L108-N112 PolarHBondContact O-N 3.33Å; L108-K113 HydrophobicContact CD2-CB 3.82Å; L108-K113 HydrophobicContact CD2-CD 4.37Å; L108-K113 PolarHBondContact O-N 2.95Å; L108-I114 HydrophobicContact CB-CD1 4.48Å; L108-I114 HydrophobicContact CB-CG1 4.02Å; L108-L122 HydrophobicContact CD1-CD1 4.32Å; L108-L122 HydrophobicContact CD1-CD2 3.81Å
109	A	92.4	Very high	90.1	Very high	2 Å²	2	61.7 Å²	61.7	2%	0.017	33%	0.328	C	S	.	.	H	α-helix	trans	-68.5	-42.4	173.4	0	0	0	0	0	112.4	C105 I106 R107 N112 I114 A149 K152	C105-A109 VanDerWaalsContact O-CB 3.31Å; C105-A109 WeakPolarHBondContact O-CB 3.27Å; C105-A109 PolarHBondContact O-N 3.35Å; I106-A109 PolarHBondContact O-N 3.39Å; R107-A109 VanDerWaalsContact C-N 3.27Å; R107-A109 PolarHBondContact O-N 3Å; A109-N112 PolarHBondContact O-N 3.46Å; A109-N112 PolarHBondContact O-OD1 2.89Å; A109-I114 HydrophobicContact CB-CD1 3.74Å; A109-A149 HydrophobicContact CB-CB 3.5Å; A109-K152 HydrophobicContact CB-CD 4.14Å; A109-K152 PolarHBondContact O-NZ 2.87Å
110	A	92.2	Very high	90.6	Very high	78 Å²	78	64 Å²	64	65%	0.645	33%	0.326	S	S	*	.	H	α-helix	trans	-67.5	-37.4	176.3	0	0	0	0	0	112.4	I106 R107 N112	I106-A110 WeakPolarHBondContact O-CB 3.11Å; I106-A110 PolarHBondContact O-N 2.99Å; R107-A110 PolarHBondContact O-N 3.48Å; A110-N112 PolarHBondContact O-N 3.15Å
111	E	92.8	Very high	90.9	Very high	88 Å²	88	63 Å²	63	41%	0.411	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-0.2	176.9	-67.2	175.7	-164.4	0	0	113.6	R107 K113	R107-E111 WeakPolarHBondContact CD-OE1 3.4Å; R107-E111 HydrophobicContact CG-CG 4.34Å; R107-E111 WeakPolarHBondContact CG-OE1 3.18Å; R107-E111 WeakPolarHBondContact O-CB 3.25Å; R107-E111 WeakPolarHBondContact O-CG 3.39Å; R107-E111 PolarHBondContact O-N 2.65Å; E111-K113 HydrophobicContact CB-CD 4.02Å; E111-K113 HydrophobicContact CB-CG 4Å; E111-K113 PolarHBondContact O-N 3.02Å; E111-K113 VanDerWaalsContact OE2-CD 3.3Å; E111-K113 WeakPolarHBondContact OE2-CD 3.38Å; E111-K113 WeakPolarHBondContact OE2-CE 3.28Å; E111-K113 IonicContact OE2-NZ 2.66Å; E111-K113 PolarHBondContact OE2-NZ 3.34Å
112	N	90.2	Very high	91.1	Very high	120 Å²	120	62 Å²	62	64%	0.642	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	34.1	-173.8	-65.5	-38.3	0	0	0	114	L108 A109 A110 K152	L108-N112 PolarHBondContact O-N 3.33Å; A109-N112 PolarHBondContact O-N 3.46Å; A109-N112 PolarHBondContact O-OD1 2.89Å; A110-N112 PolarHBondContact O-N 3.15Å; N112-K152 PolarHBondContact OD1-NZ 3.23Å
113	K	93	Very high	91.2	Very high	115 Å²	115	62 Å²	62	50%	0.5	32%	0.322	S	S	.	.			trans	-93.3	9	179.9	-70.5	179.8	-173.7	165	0	113.9	L108 E111 N118	L108-K113 HydrophobicContact CD2-CB 3.82Å; L108-K113 HydrophobicContact CD2-CD 4.37Å; L108-K113 PolarHBondContact O-N 2.95Å; E111-K113 HydrophobicContact CB-CD 4.02Å; E111-K113 HydrophobicContact CB-CG 4Å; E111-K113 PolarHBondContact O-N 3.02Å; E111-K113 VanDerWaalsContact OE2-CD 3.3Å; E111-K113 WeakPolarHBondContact OE2-CD 3.38Å; E111-K113 WeakPolarHBondContact OE2-CE 3.28Å; E111-K113 IonicContact OE2-NZ 2.66Å; E111-K113 PolarHBondContact OE2-NZ 3.34Å; K113-N118 PolarHBondContact O-ND2 3.14Å
114	I	91.1	Very high	91.3	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.128	31%	0.305	C	S	.	.			trans	-82.9	123.5	176.6	-59.5	177.4	0	0	0	108.3	L108 A109 N118 A119 L122 K152 I153	L108-I114 HydrophobicContact CB-CD1 4.48Å; L108-I114 HydrophobicContact CB-CG1 4.02Å; A109-I114 HydrophobicContact CB-CD1 3.74Å; I114-N118 WeakPolarHBondContact CA-OD1 3.49Å; I114-A119 HydrophobicContact CG2-CB 4.43Å; I114-L122 HydrophobicContact CD1-CD1 4.18Å; I114-L122 HydrophobicContact CG1-CD1 3.91Å; I114-L122 HydrophobicContact CG2-CD1 4.25Å; I114-K152 HydrophobicContact CD1-CB 4.01Å; I114-I153 HydrophobicContact CD1-CG1 3.93Å; I114-I153 HydrophobicContact CG2-CG1 4.23Å
115	T	91.7	Very high	91.2	Very high	72 Å²	72	60.5 Å²	60.5	44%	0.442	31%	0.305	S	S	.	.			trans	-138.2	163	-174.2	63.4	0	0	0	0	110.3	K117 N118 A119	T115-K117 PolarHBondContact O-N 2.85Å; T115-N118 PolarHBondContact N-OD1 3.42Å; T115-N118 PolarHBondContact O-N 3.28Å; T115-N118 PolarHBondContact O-OD1 2.94Å; T115-A119 WeakPolarHBondContact O-CB 3.46Å; T115-A119 PolarHBondContact O-N 3.49Å
116	A	90.1	Very high	91	Very high	17 Å²	17	62.7 Å²	62.7	14%	0.14	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-33.4	175.9	0	0	0	0	0	114.3	G156 D159 A160	A116-G156 WeakPolarHBondContact CA-O 3.44Å; A116-D159 HydrophobicContact CB-CB 4.25Å; A116-A160 HydrophobicContact CB-CB 3.88Å
117	K	90.3	Very high	90.6	Very high	194 Å²	194	62.1 Å²	62.1	84%	0.843	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-29	-179.4	-65.3	-175.2	178.1	-177.8	0	114.5	T115	T115-K117 PolarHBondContact O-N 2.85Å
118	N	92.1	Very high	90.2	Very high	41 Å²	41	57.4 Å²	57.4	22%	0.219	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-14.2	-176.3	68.4	18.1	0	0	0	114	K113 I114 T115 F120 N121 L122	K113-N118 PolarHBondContact O-ND2 3.14Å; I114-N118 WeakPolarHBondContact CA-OD1 3.49Å; T115-N118 PolarHBondContact N-OD1 3.42Å; T115-N118 PolarHBondContact O-N 3.28Å; T115-N118 PolarHBondContact O-OD1 2.94Å; N118-F120 PolarHBondContact O-N 3.4Å; N118-F120 VanDerWaalsContact O-N 3.15Å; N118-N121 PolarHBondContact O-N 3.35Å; N118-L122 PolarHBondContact O-N 2.98Å
119	A	90.7	Very high	89.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.7	-174.8	0	0	0	0	0	114.7	I114 T115 I153 R157	I114-A119 HydrophobicContact CG2-CB 4.43Å; T115-A119 WeakPolarHBondContact O-CB 3.46Å; T115-A119 PolarHBondContact O-N 3.49Å; A119-I153 WeakPolarHBondContact O-CG2 3.36Å; A119-R157 HydrophobicContact CB-CG 3.83Å; A119-R157 PolarHBondContact O-NE 3.35Å
120	F	92	Very high	88.8	Confident	93 Å²	93	63.5 Å²	63.5	41%	0.408	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-28.9	172.2	-70.8	-71.9	0	0	0	113.6	N118 L122 R157 A160 V161	N118-F120 PolarHBondContact O-N 3.4Å; N118-F120 VanDerWaalsContact O-N 3.15Å; F120-L122 VanDerWaalsContact C-N 3.28Å; F120-L122 PolarHBondContact O-N 2.82Å; F120-R157 HydrophobicContact CD1-CG 3.97Å; F120-R157 HydrophobicContact CE1-CB 4.16Å; F120-R157 HydrophobicContact CE1-CG 3.85Å; F120-R157 HydrophobicContact CG-CG 4.35Å; F120-R157 HydrophobicContact CZ-CB 4.1Å; F120-R157 HydrophobicContact CZ-CG 4.14Å; F120-A160 HydrophobicContact CD2-CB 4.49Å; F120-A160 HydrophobicContact CE2-CB 3.64Å; F120-A160 HydrophobicContact CZ-CB 4.43Å; F120-V161 HydrophobicContact CZ-CG2 4.31Å
121	N	90.4	Very high	87.8	Confident	114 Å²	114	60.8 Å²	60.8	61%	0.61	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-16.4	177.8	-64.2	-14.6	0	0	0	112.5	N118 H123	N118-N121 PolarHBondContact O-N 3.35Å; N121-H123 PolarHBondContact O-CE1 3.27Å; N121-H123 PolarHBondContact O-N 3.16Å; N121-H123 PolarHBondContact O-ND1 3.21Å
122	L	89.9	Confident	86.9	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.052	31%	0.313	C	S	.	.			trans	-90.2	100.8	177.3	-59.9	175.7	0	0	0	110.4	L108 I114 N118 F120 L124 I153 R157	L108-L122 HydrophobicContact CD1-CD1 4.32Å; L108-L122 HydrophobicContact CD1-CD2 3.81Å; I114-L122 HydrophobicContact CD1-CD1 4.18Å; I114-L122 HydrophobicContact CG1-CD1 3.91Å; I114-L122 HydrophobicContact CG2-CD1 4.25Å; N118-L122 PolarHBondContact O-N 2.98Å; F120-L122 VanDerWaalsContact C-N 3.28Å; F120-L122 PolarHBondContact O-N 2.82Å; L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 3.13Å; L122-I153 HydrophobicContact CB-CD1 3.72Å; L122-I153 HydrophobicContact CB-CG1 4.03Å; L122-I153 HydrophobicContact CB-CG2 4.44Å; L122-I153 HydrophobicContact CD1-CD1 4.29Å; L122-I153 HydrophobicContact CD1-CG1 4.03Å; L122-R157 PolarHBondContact O-NH2 3.32Å
123	H	89.2	Confident	86.2	Confident	34 Å²	34	63.3 Å²	63.3	16%	0.157	31%	0.314	C	S	.	.			trans	-87.9	22.5	-175.9	-60.6	91.5	0	0	0	114.4	P90 H101 N121 I125 D126 Y127	P90-H123 VanDerWaalsContact CD-NE2 3.27Å; P90-H123 WeakPolarHBondContact CD-NE2 3.41Å; H101-H123 PolarHBondContact CE1-N 2.94Å; H101-H123 VanDerWaalsContact CE1-N 3.35Å; N121-H123 PolarHBondContact O-CE1 3.27Å; N121-H123 PolarHBondContact O-N 3.16Å; N121-H123 PolarHBondContact O-ND1 3.21Å; H123-I125 VanDerWaalsContact C-N 3.3Å; H123-I125 PolarHBondContact O-N 3.22Å; H123-D126 IonicContact CD2-OD2 3.93Å; H123-D126 PolarHBondContact O-N 3.14Å; H123-Y127 HydrophobicContact CB-CD2 3.99Å; H123-Y127 HydrophobicContact CB-CE2 3.61Å; H123-Y127 WeakPolarHBondContact O-CD2 3.46Å; H123-Y127 PolarHBondContact O-N 3.48Å
124	L	89.6	Confident	84.9	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-58.2	-42.2	-178	178.2	62.3	0	0	0	112.1	Y102 C105 L122 D126 Y127 M128 A149 I153	Y102-L124 HydrophobicContact CD2-CD1 3.59Å; Y102-L124 HydrophobicContact CE2-CD1 4.06Å; C105-L124 HydrophobicContact CB-CB 4.16Å; C105-L124 HydrophobicContact CB-CD2 4Å; C105-L124 HydrophobicContact CB-CG 4.48Å; L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 3.13Å; L124-D126 VanDerWaalsContact C-N 3.27Å; L124-D126 PolarHBondContact O-N 2.97Å; L124-Y127 PolarHBondContact O-N 3.17Å; L124-M128 WeakPolarHBondContact O-CB 3.47Å; L124-M128 PolarHBondContact O-N 3.26Å; L124-A149 HydrophobicContact CD2-CB 3.54Å; L124-I153 HydrophobicContact CB-CD1 3.6Å; L124-I153 HydrophobicContact CD2-CD1 4.05Å; L124-I153 HydrophobicContact CG-CD1 4.42Å
125	I	90	Very high	83.7	Confident	59 Å²	59	68.6 Å²	68.6	30%	0.303	34%	0.339	S	S	.	.	H	α-helix	trans	-61.2	-39.1	-178.5	-58.6	176	0	0	0	110.7	H123 I153	H123-I125 VanDerWaalsContact C-N 3.3Å; H123-I125 PolarHBondContact O-N 3.22Å; I125-I153 HydrophobicContact CD1-CB 4.12Å; I125-I153 HydrophobicContact CD1-CG2 3.73Å; I125-I153 HydrophobicContact CG1-CG2 4.25Å
126	D	87.7	Confident	82.2	Confident	46 Å²	46	70.5 Å²	70.5	25%	0.246	35%	0.346	C	S	.	.	H	α-helix	trans	-72.2	-42.8	-177.6	-51.7	-72.6	0	0	0	111.3	A89 H123 L124 S129 R157	A89-D126 HydrophobicContact CB-CB 3.57Å; H123-D126 IonicContact CD2-OD2 3.93Å; H123-D126 PolarHBondContact O-N 3.14Å; L124-D126 VanDerWaalsContact C-N 3.27Å; L124-D126 PolarHBondContact O-N 2.97Å; D126-S129 PolarHBondContact O-OG 3.08Å; D126-R157 IonicContact OD2-NH2 3.45Å
127	Y	83.1	Confident	81	Confident	25 Å²	25	71.1 Å²	71.1	10%	0.098	35%	0.346	C	S	.	.	H	α-helix	trans	-77.6	-19	177.2	-61.1	-53.9	0	0	0	114.3	P90 I93 I98 H123 L124 S129 E130 M131	P90-Y127 PolarHBondContact O-OH 2.98Å; I93-Y127 HydrophobicContact CD1-CE2 4Å; I98-Y127 HydrophobicContact CD1-CD1 3.76Å; I98-Y127 HydrophobicContact CD1-CE1 3.86Å; I98-Y127 HydrophobicContact CD1-CG 4.22Å; I98-Y127 HydrophobicContact CG1-CD1 4.19Å; I98-Y127 HydrophobicContact CG1-CD2 4.21Å; I98-Y127 HydrophobicContact CG1-CE1 4.29Å; I98-Y127 HydrophobicContact CG1-CE2 4.29Å; I98-Y127 HydrophobicContact CG1-CG 4.17Å; H123-Y127 HydrophobicContact CB-CD2 3.99Å; H123-Y127 HydrophobicContact CB-CE2 3.61Å; H123-Y127 WeakPolarHBondContact O-CD2 3.46Å; H123-Y127 PolarHBondContact O-N 3.48Å; L124-Y127 PolarHBondContact O-N 3.17Å; Y127-S129 PolarHBondContact O-N 2.87Å; Y127-S129 VanDerWaalsContact O-N 3.13Å; Y127-E130 PolarHBondContact O-N 3.34Å; Y127-M131 WeakPolarHBondContact O-CG 3.27Å; Y127-M131 PolarHBondContact O-N 3.26Å
128	M	83.1	Confident	79.8	Confident	39 Å²	39	65.7 Å²	65.7	19%	0.192	34%	0.337	C	S	.	.	H	α-helix	trans	-53.4	-37.1	179	-172.8	179.8	-78.6	0	0	112	L124 E130 M131 I132 S146	L124-M128 WeakPolarHBondContact O-CB 3.47Å; L124-M128 PolarHBondContact O-N 3.26Å; M128-E130 PolarHBondContact O-N 2.87Å; M128-M131 PolarHBondContact O-N 2.83Å; M128-I132 HydrophobicContact CG-CD1 3.95Å; M128-I132 HydrophobicContact CG-CG1 4.49Å; M128-I132 WeakPolarHBondContact O-CD1 3.42Å; M128-I132 VanDerWaalsContact O-CG1 3.25Å; M128-I132 WeakPolarHBondContact O-CG1 3.26Å; M128-I132 PolarHBondContact O-N 2.96Å; M128-S146 VanDerWaalsContact CE-O 3.26Å; M128-S146 WeakPolarHBondContact CE-O 3.38Å
129	S	80.4	Confident	79.3	Confident	69 Å²	69	66.7 Å²	66.7	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-69.7	-27.3	177.4	68.5	0	0	0	0	114.9	D126 Y127 K133	D126-S129 PolarHBondContact O-OG 3.08Å; Y127-S129 PolarHBondContact O-N 2.87Å; Y127-S129 VanDerWaalsContact O-N 3.13Å; S129-K133 WeakPolarHBondContact O-CE 3.43Å; S129-K133 WeakPolarHBondContact O-CG 3.35Å
130	E	76.2	Confident	79.1	Confident	91 Å²	91	75.5 Å²	75.5	43%	0.425	39%	0.386	S	S	.	.	H	α-helix	trans	-86	-26.1	172.6	-70.7	-61.1	124.7	0	0	111.9	Y127 M128 K133	Y127-E130 PolarHBondContact O-N 3.34Å; M128-E130 PolarHBondContact O-N 2.87Å; E130-K133 IonicContact OE1-NZ 2.77Å; E130-K133 PolarHBondContact OE1-NZ 3.19Å
131	M	70.4	Confident	78.9	Confident	21 Å²	21	78.9 Å²	78.9	10%	0.103	40%	0.403	C	S	.	.	H	α-helix	trans	-73.8	-41.5	175.9	-73.3	-175.8	97	0	0	112.2	Y102 Y127 M128 K133 K134 F137	Y102-M131 HydrophobicContact CD1-CE 4.18Å; Y102-M131 HydrophobicContact CD2-CE 3.41Å; Y102-M131 VanDerWaalsContact CD2-CE 3.41Å; Y102-M131 HydrophobicContact CD2-SD 3.86Å; Y102-M131 HydrophobicContact CE2-CE 4.06Å; Y102-M131 HydrophobicContact CG-CE 3.5Å; Y102-M131 VanDerWaalsContact CG-CE 3.5Å; Y102-M131 HydrophobicContact CG-SD 4.4Å; Y127-M131 WeakPolarHBondContact O-CG 3.27Å; Y127-M131 PolarHBondContact O-N 3.26Å; M128-M131 PolarHBondContact O-N 2.83Å; M131-K133 PolarHBondContact O-N 3.34Å; M131-K134 PolarHBondContact O-N 2.97Å; M131-F137 HydrophobicContact CB-CD2 3.83Å; M131-F137 HydrophobicContact CB-CE1 4.45Å; M131-F137 HydrophobicContact CB-CE2 3.5Å; M131-F137 HydrophobicContact CB-CZ 3.82Å; M131-F137 HydrophobicContact CE-CE2 3.48Å; M131-F137 VanDerWaalsContact CE-CE2 3.48Å; M131-F137 HydrophobicContact CE-CZ 3.75Å; M131-F137 HydrophobicContact CG-CE2 4.1Å; M131-F137 HydrophobicContact CG-CZ 4.42Å; M131-F137 WeakPolarHBondContact O-CD2 3.39Å; M131-F137 HydrophobicContact SD-CE2 4.03Å; M131-F137 HydrophobicContact SD-CZ 3.95Å
132	I	74.4	Confident	78.6	Confident	112 Å²	112	76.4 Å²	76.4	57%	0.574	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-24.1	175.2	-69.1	161.9	0	0	0	112.5	M128 K134 F137	M128-I132 HydrophobicContact CG-CD1 3.95Å; M128-I132 HydrophobicContact CG-CG1 4.49Å; M128-I132 WeakPolarHBondContact O-CD1 3.42Å; M128-I132 VanDerWaalsContact O-CG1 3.25Å; M128-I132 WeakPolarHBondContact O-CG1 3.26Å; M128-I132 PolarHBondContact O-N 2.96Å; I132-K134 VanDerWaalsContact C-N 3.27Å; I132-K134 PolarHBondContact O-N 2.86Å; I132-F137 HydrophobicContact CG1-CD1 4.36Å
133	K	74.2	Confident	78.5	Confident	150 Å²	150	77.7 Å²	77.7	65%	0.652	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.4	175.8	-65	172.1	-169.7	170.5	0	113.8	S129 E130 M131	S129-K133 WeakPolarHBondContact O-CE 3.43Å; S129-K133 WeakPolarHBondContact O-CG 3.35Å; E130-K133 IonicContact OE1-NZ 2.77Å; E130-K133 PolarHBondContact OE1-NZ 3.19Å; M131-K133 PolarHBondContact O-N 3.34Å
134	K	67.3	Low	78.5	Confident	64 Å²	64	79.5 Å²	79.5	28%	0.278	42%	0.418	S	S	.	.	S	Bend	trans	-104.6	144.5	177.6	-62.3	175.3	-175	171.1	0	109.5	M131 I132 D136 F137	M131-K134 PolarHBondContact O-N 2.97Å; I132-K134 VanDerWaalsContact C-N 3.27Å; I132-K134 PolarHBondContact O-N 2.86Å; K134-D136 HydrophobicContact CB-CB 4.45Å; K134-D136 PolarHBondContact O-N 3.48Å; K134-F137 PolarHBondContact O-N 3.12Å
135	E	64.8	Low	78.5	Confident	186 Å²	186	81.4 Å²	81.4	87%	0.869	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-60.9	-16.4	-179.8	-64.2	-175.6	150.9	0	0	113.3	F137 A138	E135-F137 PolarHBondContact O-N 3.42Å; E135-A138 VanDerWaalsContact O-CB 3.24Å; E135-A138 WeakPolarHBondContact O-CB 3.42Å; E135-A138 PolarHBondContact O-N 3.18Å
136	D	60.6	Low	78.4	Confident	112 Å²	112	78.7 Å²	78.7	60%	0.599	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-51.9	-24.6	173.4	-54.6	-37.5	0	0	0	113.6	K134	K134-D136 HydrophobicContact CB-CB 4.45Å; K134-D136 PolarHBondContact O-N 3.48Å
137	F	64	Low	78.6	Confident	30 Å²	30	82 Å²	82	13%	0.132	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-92.4	4.6	179.3	-88.3	-108.1	0	0	0	114.9	Y102 M131 I132 K134 E135 S139 I142 A143 S146	Y102-F137 HydrophobicContact CE2-CZ 4.12Å; M131-F137 HydrophobicContact CB-CD2 3.83Å; M131-F137 HydrophobicContact CB-CE1 4.45Å; M131-F137 HydrophobicContact CB-CE2 3.5Å; M131-F137 HydrophobicContact CB-CZ 3.82Å; M131-F137 HydrophobicContact CE-CE2 3.48Å; M131-F137 VanDerWaalsContact CE-CE2 3.48Å; M131-F137 HydrophobicContact CE-CZ 3.75Å; M131-F137 HydrophobicContact CG-CE2 4.1Å; M131-F137 HydrophobicContact CG-CZ 4.42Å; M131-F137 WeakPolarHBondContact O-CD2 3.39Å; M131-F137 HydrophobicContact SD-CE2 4.03Å; M131-F137 HydrophobicContact SD-CZ 3.95Å; I132-F137 HydrophobicContact CG1-CD1 4.36Å; K134-F137 PolarHBondContact O-N 3.12Å; E135-F137 PolarHBondContact O-N 3.42Å; F137-S139 PolarHBondContact O-N 2.73Å; F137-I142 HydrophobicContact CE1-CG2 4.35Å; F137-I142 HydrophobicContact CE2-CG2 4.21Å; F137-I142 HydrophobicContact CZ-CG2 4.06Å; F137-A143 HydrophobicContact CD1-CB 4.47Å; F137-S146 VanDerWaalsContact CE1-OG 3.26Å; F137-S146 WeakPolarHBondContact CE1-OG 3.36Å; F137-S146 WeakPolarHBondContact CZ-OG 3.47Å
138	A	66.5	Low	79.1	Confident	80 Å²	80	84.7 Å²	84.7	66%	0.661	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-62.4	-20.1	174.2	0	0	0	0	0	113.4	E135 F140	E135-A138 VanDerWaalsContact O-CB 3.24Å; E135-A138 WeakPolarHBondContact O-CB 3.42Å; E135-A138 PolarHBondContact O-N 3.18Å; A138-F140 PolarHBondContact O-N 2.93Å
139	S	81	Confident	79.6	Confident	63 Å²	63	82.9 Å²	82.9	44%	0.441	44%	0.442	S	S	.	.			trans	-82	106.5	175.8	-69.2	0	0	0	0	111.6	F137 Q141 I142 A143	F137-S139 PolarHBondContact O-N 2.73Å; S139-Q141 PolarHBondContact O-N 3.36Å; S139-I142 WeakPolarHBondContact O-CB 3.46Å; S139-I142 PolarHBondContact O-N 3.4Å; S139-A143 PolarHBondContact O-N 3.47Å; S139-A143 VanDerWaalsContact O-N 3.12Å
140	F	86.4	Confident	80.2	Confident	185 Å²	185	80 Å²	80	81%	0.811	42%	0.423	S	S	*	.	H	α-helix	trans	-52.3	-28.9	177.6	-75.1	-78	0	0	0	114.7	A138 A143 S144	A138-F140 PolarHBondContact O-N 2.93Å; F140-A143 PolarHBondContact O-N 3.41Å; F140-S144 WeakPolarHBondContact O-CB 3.43Å; F140-S144 PolarHBondContact O-N 2.93Å; F140-S144 PolarHBondContact O-OG 3.44Å
141	Q	87.7	Confident	81.1	Confident	164 Å²	164	78.3 Å²	78.3	77%	0.766	43%	0.425	S	S	*	.	H	α-helix	trans	-68	-35.7	174.5	-67.6	178.9	-20.5	0	0	113.3	S139 S144 S145	S139-Q141 PolarHBondContact O-N 3.36Å; Q141-S144 PolarHBondContact O-OG 3.3Å; Q141-S145 WeakPolarHBondContact O-CB 3.26Å; Q141-S145 PolarHBondContact O-N 2.89Å; Q141-S145 VanDerWaalsContact O-N 3.14Å; Q141-S145 PolarHBondContact O-OG 3.48Å
142	I	84	Confident	82.2	Confident	62 Å²	62	80.1 Å²	80.1	32%	0.318	43%	0.432	S	S	.	.	H	α-helix	trans	-72.8	-42.6	175.6	-60.1	-177.6	0	0	0	108.5	Y102 F137 S139 S145 S146	Y102-I142 HydrophobicContact CE1-CG2 4.49Å; Y102-I142 WeakPolarHBondContact OH-CG2 3.36Å; Y102-I142 PolarHBondContact OH-O 3.22Å; F137-I142 HydrophobicContact CE1-CG2 4.35Å; F137-I142 HydrophobicContact CE2-CG2 4.21Å; F137-I142 HydrophobicContact CZ-CG2 4.06Å; S139-I142 WeakPolarHBondContact O-CB 3.46Å; S139-I142 PolarHBondContact O-N 3.4Å; I142-S145 PolarHBondContact O-OG 2.87Å; I142-S145 VanDerWaalsContact O-OG 3.13Å; I142-S146 VanDerWaalsContact O-CB 3.27Å; I142-S146 WeakPolarHBondContact O-CB 3.4Å; I142-S146 PolarHBondContact O-N 3.18Å; I142-S146 PolarHBondContact O-OG 2.89Å
143	A	87	Confident	83.2	Confident	36 Å²	36	74.8 Å²	74.8	30%	0.298	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-43.2	174.8	0	0	0	0	0	113	F137 S139 F140 S146 L147	F137-A143 HydrophobicContact CD1-CB 4.47Å; S139-A143 PolarHBondContact O-N 3.47Å; S139-A143 VanDerWaalsContact O-N 3.12Å; F140-A143 PolarHBondContact O-N 3.41Å; A143-S146 WeakPolarHBondContact O-CB 3.26Å; A143-S146 PolarHBondContact O-N 2.89Å; A143-L147 WeakPolarHBondContact O-CB 3.17Å; A143-L147 PolarHBondContact O-N 3.35Å
144	S	89.4	Confident	84.2	Confident	72 Å²	72	75 Å²	75	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-69.5	-43	-179.9	64.9	0	0	0	0	112.8	F140 Q141 S146 L147 D148	F140-S144 WeakPolarHBondContact O-CB 3.43Å; F140-S144 PolarHBondContact O-N 2.93Å; F140-S144 PolarHBondContact O-OG 3.44Å; Q141-S144 PolarHBondContact O-OG 3.3Å; S144-S146 VanDerWaalsContact C-N 3.34Å; S144-L147 PolarHBondContact O-N 3.46Å; S144-D148 PolarHBondContact O-N 2.69Å
145	S	89.5	Confident	85.5	Confident	44 Å²	44	74.2 Å²	74.2	31%	0.308	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-35.5	174.1	52	0	0	0	0	112.6	I106 Q141 I142 L147 A149	I106-S145 WeakPolarHBondContact CD1-O 3.24Å; Q141-S145 WeakPolarHBondContact O-CB 3.26Å; Q141-S145 PolarHBondContact O-N 2.89Å; Q141-S145 VanDerWaalsContact O-N 3.14Å; Q141-S145 PolarHBondContact O-OG 3.48Å; I142-S145 PolarHBondContact O-OG 2.87Å; I142-S145 VanDerWaalsContact O-OG 3.13Å; S145-L147 VanDerWaalsContact C-N 3.33Å; S145-A149 WeakPolarHBondContact O-CB 3.39Å; S145-A149 PolarHBondContact O-N 3.42Å
146	S	89.7	Confident	86.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	37%	0.369	C	S	.	.	H	α-helix	trans	-61.8	-40.2	170.4	-59.1	0	0	0	0	112.4	Y102 M128 F137 I142 A143 S144 G150	Y102-S146 WeakPolarHBondContact CE2-OG 3.22Å; Y102-S146 PolarHBondContact OH-OG 3.16Å; M128-S146 VanDerWaalsContact CE-O 3.26Å; M128-S146 WeakPolarHBondContact CE-O 3.38Å; F137-S146 VanDerWaalsContact CE1-OG 3.26Å; F137-S146 WeakPolarHBondContact CE1-OG 3.36Å; F137-S146 WeakPolarHBondContact CZ-OG 3.47Å; I142-S146 VanDerWaalsContact O-CB 3.27Å; I142-S146 WeakPolarHBondContact O-CB 3.4Å; I142-S146 PolarHBondContact O-N 3.18Å; I142-S146 PolarHBondContact O-OG 2.89Å; A143-S146 WeakPolarHBondContact O-CB 3.26Å; A143-S146 PolarHBondContact O-N 2.89Å; S144-S146 VanDerWaalsContact C-N 3.34Å; S146-G150 PolarHBondContact O-N 3.47Å
147	L	91.7	Very high	88.5	Confident	117 Å²	117	62.5 Å²	62.5	61%	0.613	35%	0.349	S	S	*	.	H	α-helix	trans	-70.7	-41.3	-179.9	-174.5	63.2	0	0	0	111.8	A143 S144 S145 G150 A151	A143-L147 WeakPolarHBondContact O-CB 3.17Å; A143-L147 PolarHBondContact O-N 3.35Å; S144-L147 PolarHBondContact O-N 3.46Å; S145-L147 VanDerWaalsContact C-N 3.33Å; L147-G150 PolarHBondContact O-N 2.84Å; L147-A151 WeakPolarHBondContact O-CB 3.2Å; L147-A151 PolarHBondContact O-N 2.93Å
148	D	93.1	Very high	90	Very high	80 Å²	80	64.3 Å²	64.3	43%	0.428	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-50.2	172.7	177.8	62.3	0	0	0	111.3	S144 G150 A151 K152	S144-D148 PolarHBondContact O-N 2.69Å; D148-G150 VanDerWaalsContact C-N 3.31Å; D148-G150 PolarHBondContact O-N 3.33Å; D148-A151 PolarHBondContact O-N 3.11Å; D148-A151 VanDerWaalsContact O-N 3.16Å; D148-K152 WeakPolarHBondContact O-CG 3.35Å; D148-K152 PolarHBondContact O-N 2.97Å; D148-K152 WeakPolarHBondContact OD1-CE 3.27Å; D148-K152 VanDerWaalsContact OD2-CE 3.23Å; D148-K152 WeakPolarHBondContact OD2-CE 3.39Å; D148-K152 IonicContact OD2-NZ 2.74Å; D148-K152 PolarHBondContact OD2-NZ 3.01Å
149	A	93.4	Very high	91.3	Very high	1 Å²	1	64.6 Å²	64.6	1%	0.008	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-41.1	176.1	0	0	0	0	0	112.1	I106 A109 L124 S145 K152 I153	I106-A149 HydrophobicContact CD1-CB 3.71Å; A109-A149 HydrophobicContact CB-CB 3.5Å; L124-A149 HydrophobicContact CD2-CB 3.54Å; S145-A149 WeakPolarHBondContact O-CB 3.39Å; S145-A149 PolarHBondContact O-N 3.42Å; A149-K152 PolarHBondContact O-N 2.9Å; A149-I153 VanDerWaalsContact O-CG1 3.26Å; A149-I153 WeakPolarHBondContact O-CG1 3.45Å; A149-I153 PolarHBondContact O-N 2.96Å
150	G	93.1	Very high	91.9	Very high	9 Å²	9	62 Å²	62	9%	0.093	34%	0.335	C	S	.	.	H	α-helix	trans	-62	-41	174.1	0	0	0	0	0	113.1	S146 L147 D148 I153 Y154	S146-G150 PolarHBondContact O-N 3.47Å; L147-G150 PolarHBondContact O-N 2.84Å; D148-G150 VanDerWaalsContact C-N 3.31Å; D148-G150 PolarHBondContact O-N 3.33Å; G150-I153 PolarHBondContact O-N 3.04Å; G150-Y154 WeakPolarHBondContact O-CB 3.27Å; G150-Y154 PolarHBondContact O-N 3.45Å
151	A	94.2	Very high	92.3	Very high	56 Å²	56	56.6 Å²	56.6	46%	0.463	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-42.1	176.2	0	0	0	0	0	111.9	L147 D148 Y154 A155	L147-A151 WeakPolarHBondContact O-CB 3.2Å; L147-A151 PolarHBondContact O-N 2.93Å; D148-A151 PolarHBondContact O-N 3.11Å; D148-A151 VanDerWaalsContact O-N 3.16Å; A151-Y154 PolarHBondContact O-N 3.18Å; A151-A155 WeakPolarHBondContact O-CB 3.33Å; A151-A155 PolarHBondContact O-N 3.26Å
152	K	94.1	Very high	92.6	Very high	59 Å²	59	53.6 Å²	53.6	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-63.6	-39.6	174.3	-68.1	-177.1	-171.2	-174.5	0	112.4	A109 N112 I114 D148 A149 G156	A109-K152 HydrophobicContact CB-CD 4.14Å; A109-K152 PolarHBondContact O-NZ 2.87Å; N112-K152 PolarHBondContact OD1-NZ 3.23Å; I114-K152 HydrophobicContact CD1-CB 4.01Å; D148-K152 WeakPolarHBondContact O-CG 3.35Å; D148-K152 PolarHBondContact O-N 2.97Å; D148-K152 WeakPolarHBondContact OD1-CE 3.27Å; D148-K152 VanDerWaalsContact OD2-CE 3.23Å; D148-K152 WeakPolarHBondContact OD2-CE 3.39Å; D148-K152 IonicContact OD2-NZ 2.74Å; D148-K152 PolarHBondContact OD2-NZ 3.01Å; A149-K152 PolarHBondContact O-N 2.9Å; K152-G156 PolarHBondContact O-N 3.48Å
153	I	94.8	Very high	93	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-44.7	173.2	-67.1	165.7	0	0	0	110.6	I114 A119 L122 L124 I125 A149 G150 G156 R157	I114-I153 HydrophobicContact CD1-CG1 3.93Å; I114-I153 HydrophobicContact CG2-CG1 4.23Å; A119-I153 WeakPolarHBondContact O-CG2 3.36Å; L122-I153 HydrophobicContact CB-CD1 3.72Å; L122-I153 HydrophobicContact CB-CG1 4.03Å; L122-I153 HydrophobicContact CB-CG2 4.44Å; L122-I153 HydrophobicContact CD1-CD1 4.29Å; L122-I153 HydrophobicContact CD1-CG1 4.03Å; L124-I153 HydrophobicContact CB-CD1 3.6Å; L124-I153 HydrophobicContact CD2-CD1 4.05Å; L124-I153 HydrophobicContact CG-CD1 4.42Å; I125-I153 HydrophobicContact CD1-CB 4.12Å; I125-I153 HydrophobicContact CD1-CG2 3.73Å; I125-I153 HydrophobicContact CG1-CG2 4.25Å; A149-I153 VanDerWaalsContact O-CG1 3.26Å; A149-I153 WeakPolarHBondContact O-CG1 3.45Å; A149-I153 PolarHBondContact O-N 2.96Å; G150-I153 PolarHBondContact O-N 3.04Å; I153-G156 PolarHBondContact O-N 3.04Å; I153-R157 WeakPolarHBondContact O-CG 3.47Å; I153-R157 PolarHBondContact O-N 2.91Å
154	Y	96.1	Very high	93.1	Very high	155 Å²	155	59.3 Å²	59.3	61%	0.608	32%	0.322	S	S	*	.	H	α-helix	trans	-61.6	-45.8	177.7	-178.1	-98.3	0	0	0	111.9	G150 A151 G156 R157 V158	G150-Y154 WeakPolarHBondContact O-CB 3.27Å; G150-Y154 PolarHBondContact O-N 3.45Å; A151-Y154 PolarHBondContact O-N 3.18Å; Y154-G156 PolarHBondContact O-N 3.22Å; Y154-R157 PolarHBondContact O-N 3.34Å; Y154-V158 HydrophobicContact CD1-CG2 4.14Å; Y154-V158 HydrophobicContact CE1-CG2 3.7Å; Y154-V158 HydrophobicContact CE2-CG2 4.4Å; Y154-V158 WeakPolarHBondContact O-CG2 3.33Å; Y154-V158 PolarHBondContact O-N 2.9Å
155	A	94.2	Very high	93.3	Very high	47 Å²	47	59.9 Å²	59.9	39%	0.388	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-48.8	174.8	0	0	0	0	0	111.6	A151 R157 V158 D159	A151-A155 WeakPolarHBondContact O-CB 3.33Å; A151-A155 PolarHBondContact O-N 3.26Å; A155-R157 VanDerWaalsContact C-N 3.33Å; A155-R157 PolarHBondContact O-N 3.04Å; A155-V158 WeakPolarHBondContact O-CB 3.24Å; A155-V158 PolarHBondContact O-N 3.31Å; A155-V158 VanDerWaalsContact O-N 3.08Å; A155-D159 PolarHBondContact O-N 3.17Å
156	G	93	Very high	93.3	Very high	5 Å²	5	64.1 Å²	64.1	5%	0.052	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-38.1	175.9	0	0	0	0	0	113.7	A116 K152 I153 Y154 D159 A160	A116-G156 WeakPolarHBondContact CA-O 3.44Å; K152-G156 PolarHBondContact O-N 3.48Å; I153-G156 PolarHBondContact O-N 3.04Å; Y154-G156 PolarHBondContact O-N 3.22Å; G156-D159 PolarHBondContact O-N 2.82Å; G156-A160 PolarHBondContact O-N 2.86Å
157	R	95.1	Very high	93.3	Very high	47 Å²	47	70.4 Å²	70.4	18%	0.177	36%	0.362	C	S	.	.	H	α-helix	trans	-66.6	-38.1	174	-69.2	179.1	-174.2	-169.3	1.4	111.7	A119 F120 L122 D126 I153 Y154 A155 A160 V161	A119-R157 HydrophobicContact CB-CG 3.83Å; A119-R157 PolarHBondContact O-NE 3.35Å; F120-R157 HydrophobicContact CD1-CG 3.97Å; F120-R157 HydrophobicContact CE1-CB 4.16Å; F120-R157 HydrophobicContact CE1-CG 3.85Å; F120-R157 HydrophobicContact CG-CG 4.35Å; F120-R157 HydrophobicContact CZ-CB 4.1Å; F120-R157 HydrophobicContact CZ-CG 4.14Å; L122-R157 PolarHBondContact O-NH2 3.32Å; D126-R157 IonicContact OD2-NH2 3.45Å; I153-R157 WeakPolarHBondContact O-CG 3.47Å; I153-R157 PolarHBondContact O-N 2.91Å; Y154-R157 PolarHBondContact O-N 3.34Å; A155-R157 VanDerWaalsContact C-N 3.33Å; A155-R157 PolarHBondContact O-N 3.04Å; R157-A160 PolarHBondContact O-N 3.4Å; R157-V161 WeakPolarHBondContact O-CG2 3.25Å; R157-V161 PolarHBondContact O-N 3.02Å; R157-V161 VanDerWaalsContact O-N 3.11Å
158	V	95.7	Very high	93.3	Very high	68 Å²	68	69.1 Å²	69.1	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-65.9	-43.2	174.8	171.6	0	0	0	0	111.2	Y154 A155 A160 V161 H162	Y154-V158 HydrophobicContact CD1-CG2 4.14Å; Y154-V158 HydrophobicContact CE1-CG2 3.7Å; Y154-V158 HydrophobicContact CE2-CG2 4.4Å; Y154-V158 WeakPolarHBondContact O-CG2 3.33Å; Y154-V158 PolarHBondContact O-N 2.9Å; A155-V158 WeakPolarHBondContact O-CB 3.24Å; A155-V158 PolarHBondContact O-N 3.31Å; A155-V158 VanDerWaalsContact O-N 3.08Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.38Å; V158-V161 PolarHBondContact O-N 2.91Å; V158-H162 VanDerWaalsContact O-CB 3.28Å; V158-H162 WeakPolarHBondContact O-CB 3.45Å; V158-H162 PolarHBondContact O-N 3.19Å
159	D	94.7	Very high	93	Very high	85 Å²	85	70.7 Å²	70.7	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-39.9	176.1	-73.1	-25.2	0	0	0	112.2	A116 A155 G156 H162 Q163	A116-D159 HydrophobicContact CB-CB 4.25Å; A155-D159 PolarHBondContact O-N 3.17Å; G156-D159 PolarHBondContact O-N 2.82Å; D159-H162 PolarHBondContact O-N 3.1Å; D159-Q163 WeakPolarHBondContact O-CB 3.33Å; D159-Q163 VanDerWaalsContact O-CG 3.24Å; D159-Q163 WeakPolarHBondContact O-CG 3.21Å; D159-Q163 PolarHBondContact O-N 3.18Å
160	A	93.2	Very high	92.6	Very high	8 Å²	8	74.7 Å²	74.7	7%	0.066	39%	0.391	C	S	.	.	H	α-helix	trans	-62.3	-51.6	175	0	0	0	0	0	111.6	A116 F120 G156 R157 V158 H162 Q163 E164	A116-A160 HydrophobicContact CB-CB 3.88Å; F120-A160 HydrophobicContact CD2-CB 4.49Å; F120-A160 HydrophobicContact CE2-CB 3.64Å; F120-A160 HydrophobicContact CZ-CB 4.43Å; G156-A160 PolarHBondContact O-N 2.86Å; R157-A160 PolarHBondContact O-N 3.4Å; V158-A160 VanDerWaalsContact C-N 3.32Å; V158-A160 PolarHBondContact O-N 3.38Å; A160-H162 VanDerWaalsContact C-N 3.28Å; A160-H162 PolarHBondContact O-N 3.11Å; A160-Q163 PolarHBondContact O-N 2.99Å; A160-E164 WeakPolarHBondContact O-CG 3.44Å; A160-E164 PolarHBondContact O-N 3.12Å
161	V	94.8	Very high	92.3	Very high	73 Å²	73	75.7 Å²	75.7	44%	0.442	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-36.8	178	172.9	0	0	0	0	111.4	F120 R157 V158 T165	F120-V161 HydrophobicContact CZ-CG2 4.31Å; R157-V161 WeakPolarHBondContact O-CG2 3.25Å; R157-V161 PolarHBondContact O-N 3.02Å; R157-V161 VanDerWaalsContact O-N 3.11Å; V158-V161 PolarHBondContact O-N 2.91Å; V161-T165 VanDerWaalsContact O-CB 3.26Å; V161-T165 WeakPolarHBondContact O-CB 3.35Å; V161-T165 PolarHBondContact O-N 2.81Å; V161-T165 PolarHBondContact O-OG1 3.01Å
162	H	94	Very high	91.7	Very high	101 Å²	101	78.8 Å²	78.8	47%	0.468	41%	0.41	S	S	.	.	H	α-helix	trans	-63.2	-49.8	173.9	-179.4	-87.9	0	0	0	111.1	V158 D159 A160 E164 T165 Y166	V158-H162 VanDerWaalsContact O-CB 3.28Å; V158-H162 WeakPolarHBondContact O-CB 3.45Å; V158-H162 PolarHBondContact O-N 3.19Å; D159-H162 PolarHBondContact O-N 3.1Å; A160-H162 VanDerWaalsContact C-N 3.28Å; A160-H162 PolarHBondContact O-N 3.11Å; H162-E164 PolarHBondContact O-N 3.2Å; H162-T165 PolarHBondContact O-N 3.01Å; H162-Y166 AromaticContact CD2-CE2 3.79Å; H162-Y166 AromaticContact CE1-CD2 3.58Å; H162-Y166 AromaticContact CE1-CE2 3.4Å; H162-Y166 WeakPolarHBondContact CE1-CE2 3.35Å; H162-Y166 AromaticContact ND1-CD2 3.83Å; H162-Y166 AromaticContact NE2-CD2 3.74Å; H162-Y166 AromaticContact NE2-CE2 3.18Å; H162-Y166 WeakPolarHBondContact NE2-CE2 3.4Å; H162-Y166 WeakPolarHBondContact O-CD2 3.48Å; H162-Y166 PolarHBondContact O-N 3.26Å
163	Q	91.3	Very high	90.6	Very high	101 Å²	101	79.3 Å²	79.3	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-60.3	-44.7	177	-73.2	172.3	36.9	0	0	112.2	D159 A160 Y166 Q167	D159-Q163 WeakPolarHBondContact O-CB 3.33Å; D159-Q163 VanDerWaalsContact O-CG 3.24Å; D159-Q163 WeakPolarHBondContact O-CG 3.21Å; D159-Q163 PolarHBondContact O-N 3.18Å; A160-Q163 PolarHBondContact O-N 2.99Å; Q163-Y166 PolarHBondContact O-N 3.46Å; Q163-Q167 WeakPolarHBondContact O-CB 3.43Å; Q163-Q167 VanDerWaalsContact O-CG 3.27Å; Q163-Q167 WeakPolarHBondContact O-CG 3.35Å; Q163-Q167 PolarHBondContact O-N 2.82Å
164	E	90.2	Very high	89.4	Confident	117 Å²	117	89.1 Å²	89.1	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-45.1	175.4	-73.1	175.8	-175.1	0	0	111.8	A160 H162 Y166 Q167 V168	A160-E164 WeakPolarHBondContact O-CG 3.44Å; A160-E164 PolarHBondContact O-N 3.12Å; H162-E164 PolarHBondContact O-N 3.2Å; E164-Y166 VanDerWaalsContact C-N 3.35Å; E164-Y166 PolarHBondContact O-N 2.89Å; E164-Q167 PolarHBondContact O-N 3.14Å; E164-V168 WeakPolarHBondContact O-CG2 3.34Å; E164-V168 PolarHBondContact O-N 3.16Å
165	T	92.7	Very high	87.6	Confident	84 Å²	84	86.6 Å²	86.6	52%	0.515	47%	0.474	S	S	.	.	H	α-helix	trans	-62.5	-41.3	178.2	-57.8	0	0	0	0	111.4	V161 H162 V168 L169	V161-T165 VanDerWaalsContact O-CB 3.26Å; V161-T165 WeakPolarHBondContact O-CB 3.35Å; V161-T165 PolarHBondContact O-N 2.81Å; V161-T165 PolarHBondContact O-OG1 3.01Å; H162-T165 PolarHBondContact O-N 3.01Å; T165-V168 PolarHBondContact O-N 3.48Å; T165-L169 WeakPolarHBondContact O-CB 3.36Å; T165-L169 PolarHBondContact O-N 2.95Å
166	Y	89.7	Confident	85.5	Confident	132 Å²	132	87.8 Å²	87.8	52%	0.518	49%	0.491	S	S	.	.	H	α-helix	trans	-69.2	-36.1	174.8	-92	-93.6	0	0	0	112.9	H162 Q163 E164 L169 T170	H162-Y166 AromaticContact CD2-CE2 3.79Å; H162-Y166 AromaticContact CE1-CD2 3.58Å; H162-Y166 AromaticContact CE1-CE2 3.4Å; H162-Y166 WeakPolarHBondContact CE1-CE2 3.35Å; H162-Y166 AromaticContact ND1-CD2 3.83Å; H162-Y166 AromaticContact NE2-CD2 3.74Å; H162-Y166 AromaticContact NE2-CE2 3.18Å; H162-Y166 WeakPolarHBondContact NE2-CE2 3.4Å; H162-Y166 WeakPolarHBondContact O-CD2 3.48Å; H162-Y166 PolarHBondContact O-N 3.26Å; Q163-Y166 PolarHBondContact O-N 3.46Å; E164-Y166 VanDerWaalsContact C-N 3.35Å; E164-Y166 PolarHBondContact O-N 2.89Å; Y166-L169 PolarHBondContact O-N 2.91Å; Y166-T170 WeakPolarHBondContact O-CB 3.4Å; Y166-T170 PolarHBondContact O-N 3.47Å; Y166-T170 PolarHBondContact O-OG1 3.02Å
167	Q	90.1	Very high	83.3	Confident	133 Å²	133	92.6 Å²	92.6	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-43.2	172.8	-76.5	174.5	49.5	0	0	111.5	Q163 E164 T170 G171	Q163-Q167 WeakPolarHBondContact O-CB 3.43Å; Q163-Q167 VanDerWaalsContact O-CG 3.27Å; Q163-Q167 WeakPolarHBondContact O-CG 3.35Å; Q163-Q167 PolarHBondContact O-N 2.82Å; E164-Q167 PolarHBondContact O-N 3.14Å; Q167-T170 PolarHBondContact O-N 2.89Å; Q167-G171 PolarHBondContact O-N 3.39Å
168	V	92.3	Very high	80.8	Confident	91 Å²	91	96.2 Å²	96.2	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-64.4	-46.1	174.8	170.6	0	0	0	0	111	E164 T165 T170 G171 L172	E164-V168 WeakPolarHBondContact O-CG2 3.34Å; E164-V168 PolarHBondContact O-N 3.16Å; T165-V168 PolarHBondContact O-N 3.48Å; V168-T170 VanDerWaalsContact C-N 3.31Å; V168-T170 PolarHBondContact O-N 3.46Å; V168-G171 PolarHBondContact O-N 2.91Å; V168-L172 HydrophobicContact CG1-CD1 3.82Å; V168-L172 HydrophobicContact CG1-CG 4.22Å; V168-L172 WeakPolarHBondContact O-CB 3.33Å; V168-L172 VanDerWaalsContact O-CG 3.24Å; V168-L172 WeakPolarHBondContact O-CG 3.14Å; V168-L172 PolarHBondContact O-N 3.38Å
169	L	86.2	Confident	78.4	Confident	113 Å²	113	100.1 Å²	100.1	59%	0.592	56%	0.558	S	S	*	*	H	α-helix	trans	-56.6	-44	175.8	-179.7	62.5	0	0	0	111.9	T165 Y166	T165-L169 WeakPolarHBondContact O-CB 3.36Å; T165-L169 PolarHBondContact O-N 2.95Å; Y166-L169 PolarHBondContact O-N 2.91Å
170	T	85.4	Confident	75.6	Confident	84 Å²	84	103.7 Å²	103.7	52%	0.515	58%	0.577	S	S	.	*	H	α-helix	trans	-73.2	-34.5	179.2	-50.1	0	0	0	0	112.2	Y166 Q167 V168	Y166-T170 WeakPolarHBondContact O-CB 3.4Å; Y166-T170 PolarHBondContact O-N 3.47Å; Y166-T170 PolarHBondContact O-OG1 3.02Å; Q167-T170 PolarHBondContact O-N 2.89Å; V168-T170 VanDerWaalsContact C-N 3.31Å; V168-T170 PolarHBondContact O-N 3.46Å
171	G	86.9	Confident	73.1	Confident	30 Å²	30	112.5 Å²	112.5	31%	0.309	62%	0.617	S	S	.	*	H	α-helix	trans	-73.5	-33.5	178.2	0	0	0	0	0	114	Q167 V168 G173 R174 S175	Q167-G171 PolarHBondContact O-N 3.39Å; V168-G171 PolarHBondContact O-N 2.91Å; G171-G173 VanDerWaalsContact C-N 3.32Å; G171-G173 PolarHBondContact O-N 3.49Å; G171-R174 PolarHBondContact O-N 2.91Å; G171-S175 PolarHBondContact O-N 3.46Å; G171-S175 PolarHBondContact O-OG 3.37Å
172	L	81.5	Confident	70.4	Confident	122 Å²	122	116.1 Å²	116.1	64%	0.639	63%	0.634	S	S	*	*	H	α-helix	trans	-62	-40.5	173.7	-74.8	167.8	0	0	0	111.2	V168 R174 S175	V168-L172 HydrophobicContact CG1-CD1 3.82Å; V168-L172 HydrophobicContact CG1-CG 4.22Å; V168-L172 WeakPolarHBondContact O-CB 3.33Å; V168-L172 VanDerWaalsContact O-CG 3.24Å; V168-L172 WeakPolarHBondContact O-CG 3.14Å; V168-L172 PolarHBondContact O-N 3.38Å; L172-R174 VanDerWaalsContact C-N 3.25Å; L172-R174 PolarHBondContact O-N 2.79Å; L172-S175 PolarHBondContact O-N 3.47Å
173	G	69.7	Low	67.5	Low	70 Å²	70	118.5 Å²	118.5	72%	0.722	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-19	175.5	0	0	0	0	0	114.9	G171	G171-G173 VanDerWaalsContact C-N 3.32Å; G171-G173 PolarHBondContact O-N 3.49Å
174	R	71.2	Confident	64.9	Low	206 Å²	206	123 Å²	123	78%	0.777	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-16.8	179.2	-73.3	-177.6	168	-168	-4.4	114.3	G171 L172 G176	G171-R174 PolarHBondContact O-N 2.91Å; L172-R174 VanDerWaalsContact C-N 3.25Å; L172-R174 PolarHBondContact O-N 2.79Å; R174-G176 PolarHBondContact O-N 2.89Å
175	S	56.6	Low	62.5	Low	102 Å²	102	122.5 Å²	122.5	71%	0.713	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	7.1	-176.3	-62.2	0	0	0	0	115.2	G171 L172	G171-S175 PolarHBondContact O-N 3.46Å; G171-S175 PolarHBondContact O-OG 3.37Å; L172-S175 PolarHBondContact O-N 3.47Å
176	G	52.1	Low	59.7	Low	72 Å²	72	126.6 Å²	126.6	74%	0.742	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-10.2	-176.8	0	0	0	0	0	116.5	R174	R174-G176 PolarHBondContact O-N 2.89Å
177	N	44.9	Very low	57.2	Low	106 Å²	106	124.9 Å²	124.9	57%	0.567	71%	0.712	S	S	*	*			trans	-126.9	105.8	-178.2	-169.1	28.1	0	0	0	111.9	Q179	N177-Q179 VanDerWaalsContact C-N 3.34Å; N177-Q179 PolarHBondContact ND2-OE1 2.87Å; N177-Q179 PolarHBondContact O-N 3.23Å
178	P	44.4	Very low	54.7	Low	122 Å²	122	125.6 Å²	125.6	79%	0.792	72%	0.72	S	S	*	*			trans	-80.1	80.8	175.2	33	-33.2	0	0	0	110.5
179	Q	45.1	Very low	52.4	Low	150 Å²	150	128.1 Å²	128.1	70%	0.701	73%	0.731	S	S	*	*			trans	-117.2	109.5	165.7	-75	-168.1	-92.9	0	0	111.2	N177 E181	N177-Q179 VanDerWaalsContact C-N 3.34Å; N177-Q179 PolarHBondContact ND2-OE1 2.87Å; N177-Q179 PolarHBondContact O-N 3.23Å; Q179-E181 PolarHBondContact O-N 3.21Å
180	N	34.9	Very low	50.4	Low	160 Å²	160	127.9 Å²	127.9	86%	0.856	73%	0.734	S	S	*	*			trans	0.6	98.7	151.3	-55.2	-17.8	0	0	0	116.9
181	E	40.1	Very low	48.2	Very low	194 Å²	194	130.7 Å²	130.7	91%	0.907	75%	0.746	S	S	*	*			trans	-130.6	61.1	151.3	-73.3	-168.1	170.5	0	0	109.8	Q179	Q179-E181 PolarHBondContact O-N 3.21Å
182	D	38.3	Very low	46	Very low	148 Å²	148	136.3 Å²	136.3	79%	0.791	77%	0.769	S	S	*	*			trans	-85.7	126.4	151.2	-78.9	-39.2	0	0	0	107.8
183	N	34.6	Very low	44.2	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	78%	0.775	S	S	*	*			trans	75.1	90.5	175	-41	-73.2	0	0	0	117.5
184	E	35.4	Very low	42.9	Very low	197 Å²	197	139.1 Å²	139.1	92%	0.921	77%	0.768	S	S	*	*				-151.3	80.5	123	-122.7	170	-162.3	0	0	110.6
185	S	39.9	Very low	41.4	Very low	106 Å²	106	136.6 Å²	136.6	74%	0.741	76%	0.763	S	S	*	*			trans	-72.9	124.1	166.1	52.6	0	0	0	0	109.5	A187	S185-A187 PolarHBondContact O-N 3.13Å
186	N	35.1	Very low	40.3	Very low	170 Å²	170	137 Å²	137	91%	0.909	76%	0.761	S	S	*	*			trans	-46.9	121.8	171.4	-70.3	-69.3	0	0	0	111.7
187	A	37.4	Very low	39.8	Very low	95 Å²	95	141.4 Å²	141.4	79%	0.785	76%	0.762	S	S	*	*			trans	-156.1	82.4	168.4	0	0	0	0	0	109.4	S185	S185-A187 PolarHBondContact O-N 3.13Å
188	D	37.8	Very low	39.2	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	76%	0.76	S	S	*	*			trans	-148.4	131.2	166.6	-139.9	-3.8	0	0	0	109.5
189	N	42.2	Very low	39.1	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	76%	0.759	S	S	*	*			trans	75.2	137.1	-166	-48.5	-82.6	0	0	0	114.9
190	V	44.8	Very low	38.7	Very low	108 Å²	108	139.5 Å²	139.5	66%	0.655	76%	0.757	S	S	*	*			cis	-161.4	151.9	-2.9	115.2	0	0	0	0	109.6
191	D	39.7	Very low	38.9	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	76%	0.757	S	S	*	*			trans	58.9	160.4	171	-57.6	-17.5	0	0	0	116.9
192	D	41.1	Very low	38.6	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	74%	0.744	S	S	*	*			cis	-144.4	-179.7	10.5	-151.7	-13.9	0	0	0	112.1
193	D	43.1	Very low	38.4	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	74%	0.742	S	S	*	*			trans	-60.8	159.1	-165.8	-96.2	-38.2	0	0	0	119.1
194	D	41.4	Very low	38.6	Very low	108 Å²	108	139.2 Å²	139.2	58%	0.578	75%	0.747	S	S	*	*				118.4	126.8	124	-118.4	-17.4	0	0	0	121.9
195	K	40.5	Very low	38.7	Very low	153 Å²	153	138.4 Å²	138.4	67%	0.665	74%	0.74	S	S	*	*			trans	62.7	103.9	146.5	-83	151.1	-161.9	138.4	0	123.3
196	T	34.5	Very low	38.2	Very low	109 Å²	109	143.4 Å²	143.4	67%	0.669	75%	0.749	S	S	*	*				55.6	124.2	122.4	62.1	0	0	0	0	119.2
197	H	40.8	Very low	38.5	Very low	166 Å²	166	144.7 Å²	144.7	77%	0.769	75%	0.746	S	S	*	*				-164.4	145.9	64.4	-106.8	-79.9	0	0	0	114.3
198	S	32.8	Very low	38.6	Very low	74 Å²	74	146.4 Å²	146.4	52%	0.517	75%	0.747	S	S	.	*			trans	-1	136.3	147.4	49.6	0	0	0	0	118.9
199	H	42.2	Very low	38.4	Very low	168 Å²	168	144.5 Å²	144.5	78%	0.778	75%	0.752	S	S	*	*				-165.6	134	68.6	-94.8	-79.5	0	0	0	115.6
200	S	36.4	Very low	38.4	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	75%	0.75	S	S	*	*			trans	29.7	147	137.7	61.3	0	0	0	0	122.2
201	K	39	Very low	38.5	Very low	195 Å²	195	144.9 Å²	144.9	85%	0.848	76%	0.757	S	S	*	*			cis	176.7	179.1	3.9	-109.1	-173.8	171.7	177.6	0	106.4
202	P	34.8	Very low	39.1	Very low	97 Å²	97	149.2 Å²	149.2	63%	0.63	76%	0.762	S	S	*	*			cis	-135.5	159.5	-42.9	38.1	-20.8	0	0	0	115
203	E	33.3	Very low	39.7	Very low	160 Å²	160	146.4 Å²	146.4	75%	0.748	75%	0.747	S	S	*	*			trans	18.9	134	141.5	-53	176.4	94.5	0	0	123.1
204	Q	38.2	Very low	40.4	Very low	195 Å²	195	147.6 Å²	147.6	91%	0.911	75%	0.752	S	S	*	*				-151.9	89.8	125.4	-118.8	173.3	78.3	0	0	116
205	K	36.9	Very low	41.5	Very low	180 Å²	180	148.8 Å²	148.8	78%	0.783	76%	0.757	S	S	*	*			trans	47	112.7	138.7	-62.2	-179.4	-179.9	176.7	0	121.6
206	K	31.4	Very low	42.3	Very low	211 Å²	211	147.3 Å²	147.3	92%	0.917	75%	0.752	S	S	*	*			trans	-49.6	145.1	156.1	-76.7	173.2	171.3	171.3	0	113.2
207	K	39.5	Very low	44	Very low	197 Å²	197	150.3 Å²	150.3	86%	0.857	76%	0.756	S	S	*	*			trans	-130.8	116	148.7	-77	-172.3	178	179.4	0	110.9
208	T	39.9	Very low	45	Very low	130 Å²	130	148.3 Å²	148.3	80%	0.798	75%	0.747	S	S	*	*			trans	19.4	131.1	149.8	50.5	0	0	0	0	120.7
209	A	34.1	Very low	46.8	Very low	109 Å²	109	151 Å²	151	90%	0.901	76%	0.755	S	S	*	*			trans	-63.1	145.6	174.7	0	0	0	0	0	114.1
210	A	42.8	Very low	48.2	Very low	90 Å²	90	147.6 Å²	147.6	74%	0.744	74%	0.742	S	S	*	*			trans	-129.1	121.8	162.5	0	0	0	0	0	109.4	R212	A210-R212 PolarHBondContact O-N 2.96Å
211	H	46.6	Very low	49.6	Very low	171 Å²	171	150 Å²	150	79%	0.792	74%	0.741	S	S	*	*			trans	4	106.5	159.2	-161.6	-86.5	0	0	0	117.2	D213	H211-D213 IonicContact CE1-OD1 3.67Å; H211-D213 IonicContact ND1-OD1 3.75Å
212	R	51.5	Low	51.1	Low	232 Å²	232	146 Å²	146	88%	0.875	73%	0.728	S	S	*	*			trans	-103.8	125.9	165.2	-67.6	-176.9	-176.7	159.4	0.7	109.3	A210 I214	A210-R212 PolarHBondContact O-N 2.96Å; R212-I214 PolarHBondContact O-N 2.89Å
213	D	54	Low	52.5	Low	89 Å²	89	149.3 Å²	149.3	48%	0.476	73%	0.728	S	S	.	*			trans	-54.1	122	179.7	-79.5	-2.5	0	0	0	111.5	H211 I215 K217	H211-D213 IonicContact CE1-OD1 3.67Å; H211-D213 IonicContact ND1-OD1 3.75Å; D213-I215 PolarHBondContact O-N 3.48Å; D213-K217 IonicContact OD2-NZ 2.88Å; D213-K217 PolarHBondContact OD2-NZ 3.31Å
214	I	58.3	Low	53.7	Low	170 Å²	170	146.9 Å²	146.9	87%	0.872	72%	0.718	S	S	*	*	S	Bend	trans	-73.9	-12.4	-179.2	-66.2	173.1	0	0	0	112.1	R212	R212-I214 PolarHBondContact O-N 2.89Å
215	I	64.8	Low	54.7	Low	132 Å²	132	147.1 Å²	147.1	68%	0.677	72%	0.716	S	S	*	*	S	Bend	trans	-109.7	112.6	-177.9	-58.6	177	0	0	0	110.2	D213 K217	D213-I215 PolarHBondContact O-N 3.48Å; I215-K217 PolarHBondContact O-N 2.95Å
216	H	56.9	Low	55.6	Low	123 Å²	123	143.5 Å²	143.5	57%	0.569	71%	0.709	S	S	*	*			trans	-69.3	107.2	170.8	-94.3	43.2	0	0	0	110.8	Q218	H216-Q218 PolarHBondContact O-N 3.45Å
217	K	69.8	Low	56.6	Low	171 Å²	171	138.8 Å²	138.8	74%	0.743	69%	0.694	S	S	*	*	S	Bend	trans	-69.9	10.1	-178.1	-65.8	166.1	178.1	155.4	0	115	D213 I215	D213-K217 IonicContact OD2-NZ 2.88Å; D213-K217 PolarHBondContact OD2-NZ 3.31Å; I215-K217 PolarHBondContact O-N 2.95Å
218	Q	62.4	Low	57	Low	124 Å²	124	133.2 Å²	133.2	58%	0.579	69%	0.685	S	S	*	*			trans	-126.3	103.2	179.1	-74.3	-174.6	-29.9	0	0	111.2	H216 N220 K221	H216-Q218 PolarHBondContact O-N 3.45Å; Q218-N220 PolarHBondContact O-N 3.17Å; Q218-N220 VanDerWaalsContact O-N 3.1Å; Q218-K221 PolarHBondContact O-N 3Å; Q218-K221 VanDerWaalsContact O-N 3.11Å
219	L	70.2	Confident	57.7	Low	131 Å²	131	133.3 Å²	133.3	69%	0.686	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-54.5	-30	178.5	-74.2	166.5	0	0	0	113.7	K221 I222 R223	L219-K221 PolarHBondContact O-N 3.38Å; L219-K221 VanDerWaalsContact O-N 3.12Å; L219-I222 PolarHBondContact O-N 3.25Å; L219-R223 PolarHBondContact O-N 3.11Å
220	N	70.8	Confident	58.8	Low	96 Å²	96	136.4 Å²	136.4	51%	0.513	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-65.7	-11.5	179.9	-69.8	-18.9	0	0	0	114.6	Q218 R223	Q218-N220 PolarHBondContact O-N 3.17Å; Q218-N220 VanDerWaalsContact O-N 3.1Å; N220-R223 PolarHBondContact OD1-NH1 3.15Å
221	K	65.6	Low	59.7	Low	148 Å²	148	138.5 Å²	138.5	64%	0.643	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-95.4	-12.7	170.6	-76.3	-176.4	174.4	180	0	114.1	Q218 L219	Q218-K221 PolarHBondContact O-N 3Å; Q218-K221 VanDerWaalsContact O-N 3.11Å; L219-K221 PolarHBondContact O-N 3.38Å; L219-K221 VanDerWaalsContact O-N 3.12Å
222	I	71.4	Confident	60.8	Low	110 Å²	110	138.2 Å²	138.2	56%	0.564	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-22.9	175.2	-54	175.2	0	0	0	110.2	L219 I224	L219-I222 PolarHBondContact O-N 3.25Å; I222-I224 PolarHBondContact O-N 3Å
223	R	63.8	Low	61.7	Low	167 Å²	167	130 Å²	130	63%	0.63	65%	0.651	S	S	*	*	S	Bend	trans	-65.8	91.3	167.3	-73.4	179.4	171.9	149.5	-8.3	110.8	L219 N220 K225	L219-R223 PolarHBondContact O-N 3.11Å; N220-R223 PolarHBondContact OD1-NH1 3.15Å; R223-K225 PolarHBondContact O-N 2.75Å; R223-K225 VanDerWaalsContact O-N 3.11Å
224	I	59.2	Low	62.9	Low	108 Å²	108	127.1 Å²	127.1	55%	0.554	64%	0.635	S	S	*	*			trans	-59.6	108	168.7	-60.8	173.9	0	0	0	107.9	I222 T226 L227	I222-I224 PolarHBondContact O-N 3Å; I224-T226 WeakPolarHBondContact CG2-OG1 3.48Å; I224-T226 PolarHBondContact O-N 3.22Å; I224-L227 PolarHBondContact O-N 3.46Å
225	K	59.5	Low	64.1	Low	200 Å²	200	123.3 Å²	123.3	87%	0.87	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-63.9	-21	175.9	-71.1	-174.3	174.6	-174.8	0	112.8	R223	R223-K225 PolarHBondContact O-N 2.75Å; R223-K225 VanDerWaalsContact O-N 3.11Å
226	T	55.6	Low	64.9	Low	104 Å²	104	119.5 Å²	119.5	64%	0.638	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-84.6	7.8	-179.7	19.3	0	0	0	0	115.1	I224	I224-T226 WeakPolarHBondContact CG2-OG1 3.48Å; I224-T226 PolarHBondContact O-N 3.22Å
227	L	51.6	Low	66.2	Low	113 Å²	113	118.3 Å²	118.3	59%	0.592	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-84.1	-11.3	169.5	-104.8	168.5	0	0	0	113.3	I224 D229	I224-L227 PolarHBondContact O-N 3.46Å; L227-D229 VanDerWaalsContact C-N 3.28Å; L227-D229 PolarHBondContact O-N 3.23Å
228	A	49	Very low	66.8	Low	80 Å²	80	116.2 Å²	116.2	66%	0.661	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-14.7	176.6	0	0	0	0	0	113.9	K230	A228-K230 VanDerWaalsContact C-N 3.28Å; A228-K230 PolarHBondContact O-N 2.93Å
229	D	53.7	Low	67.7	Low	131 Å²	131	116.4 Å²	116.4	70%	0.701	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-2.2	179	-65	-33.6	0	0	0	113.2	L227 I231	L227-D229 VanDerWaalsContact C-N 3.28Å; L227-D229 PolarHBondContact O-N 3.23Å; D229-I231 PolarHBondContact O-N 3.42Å; D229-I231 VanDerWaalsContact O-N 3.07Å
230	K	56.8	Low	68.1	Low	174 Å²	174	110.5 Å²	110.5	76%	0.757	56%	0.558	S	S	*	*	S	Bend	trans	-76.7	85.6	152.2	-71.5	-166.4	177.1	-166.9	0	107.2	A228 D232	A228-K230 VanDerWaalsContact C-N 3.28Å; A228-K230 PolarHBondContact O-N 2.93Å; K230-D232 PolarHBondContact O-N 3.35Å
231	I	61.9	Low	68.6	Low	135 Å²	135	108.4 Å²	108.4	69%	0.692	55%	0.549	S	S	*	.			trans	-46.5	127.3	163.7	-58.7	170.7	0	0	0	106.4	D229 V233	D229-I231 PolarHBondContact O-N 3.42Å; D229-I231 VanDerWaalsContact O-N 3.07Å; I231-V233 HydrophobicContact CB-CG2 3.97Å; I231-V233 HydrophobicContact CG2-CG2 3.74Å; I231-V233 PolarHBondContact O-N 3.42Å
232	D	69.4	Low	69.3	Low	165 Å²	165	104.3 Å²	104.3	88%	0.882	54%	0.542	S	S	*	.			trans	-74.7	75.9	176.2	-159.1	14.1	0	0	0	107.7	K230 D234	K230-D232 PolarHBondContact O-N 3.35Å; D232-D234 PolarHBondContact O-N 2.86Å
233	V	71.3	Confident	69.5	Low	60 Å²	60	99.8 Å²	99.8	36%	0.364	52%	0.521	S	S	.	.			trans	-73.8	113.8	-178	-179.4	0	0	0	0	107.1	I231 F237 Q238	I231-V233 HydrophobicContact CB-CG2 3.97Å; I231-V233 HydrophobicContact CG2-CG2 3.74Å; I231-V233 PolarHBondContact O-N 3.42Å; V233-F237 HydrophobicContact CG1-CB 4.49Å; V233-F237 HydrophobicContact CG1-CD1 3.65Å; V233-F237 HydrophobicContact CG1-CE1 4.42Å; V233-F237 HydrophobicContact CG1-CG 4.5Å; V233-Q238 HydrophobicContact CG1-CB 4.14Å
234	D	80	Confident	70.2	Confident	28 Å²	28	96.7 Å²	96.7	15%	0.15	51%	0.51	C	S	.	.			trans	-43.3	124.4	173.7	165.4	29.2	0	0	0	110.8	D232 L236 F237 Q238 S270	D232-D234 PolarHBondContact O-N 2.86Å; D234-L236 PolarHBondContact O-N 3.09Å; D234-L236 VanDerWaalsContact O-N 3.16Å; D234-L236 PolarHBondContact OD1-N 2.8Å; D234-L236 WeakPolarHBondContact OD2-CB 3.17Å; D234-F237 HydrophobicContact CB-CB 3.93Å; D234-F237 CarbonylContact O-C 3.59Å; D234-F237 WeakPolarHBondContact O-CA 3.32Å; D234-F237 WeakPolarHBondContact O-CB 3.31Å; D234-F237 PolarHBondContact O-N 3.47Å; D234-F237 PolarHBondContact OD2-N 3.03Å; D234-Q238 PolarHBondContact O-N 2.88Å; D234-S270 WeakPolarHBondContact OD1-CB 3.46Å; D234-S270 PolarHBondContact OD1-N 3.11Å; D234-S270 PolarHBondContact OD1-OG 2.82Å
235	P	82	Confident	71	Confident	89 Å²	89	98 Å²	98	58%	0.578	52%	0.518	S	S	*	.	H	α-helix	trans	-54.2	-32.2	177	-28.4	35.6	0	0	0	113.8	H239	P235-H239 WeakPolarHBondContact O-CB 3.45Å; P235-H239 PolarHBondContact O-N 3.18Å
236	L	82.4	Confident	71.4	Confident	52 Å²	52	93.1 Å²	93.1	27%	0.272	50%	0.499	S	S	.	.	H	α-helix	trans	-70.3	-42.5	174.9	176	65.5	0	0	0	110.9	D234 H239 Q240 I267	D234-L236 PolarHBondContact O-N 3.09Å; D234-L236 VanDerWaalsContact O-N 3.16Å; D234-L236 PolarHBondContact OD1-N 2.8Å; D234-L236 WeakPolarHBondContact OD2-CB 3.17Å; L236-H239 PolarHBondContact O-N 3.09Å; L236-Q240 WeakPolarHBondContact O-CB 3.09Å; L236-Q240 VanDerWaalsContact O-CG 3.31Å; L236-Q240 WeakPolarHBondContact O-CG 3.42Å; L236-Q240 PolarHBondContact O-N 2.75Å; L236-I267 HydrophobicContact CD2-CG2 4.16Å
237	F	83.1	Confident	71.8	Confident	98 Å²	98	91.1 Å²	91.1	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-47.4	169.7	-175	-87.9	0	0	0	112.2	V233 D234 H239 Q240 T241	V233-F237 HydrophobicContact CG1-CB 4.49Å; V233-F237 HydrophobicContact CG1-CD1 3.65Å; V233-F237 HydrophobicContact CG1-CE1 4.42Å; V233-F237 HydrophobicContact CG1-CG 4.5Å; D234-F237 HydrophobicContact CB-CB 3.93Å; D234-F237 CarbonylContact O-C 3.59Å; D234-F237 WeakPolarHBondContact O-CA 3.32Å; D234-F237 WeakPolarHBondContact O-CB 3.31Å; D234-F237 PolarHBondContact O-N 3.47Å; D234-F237 PolarHBondContact OD2-N 3.03Å; F237-H239 VanDerWaalsContact C-N 3.31Å; F237-H239 PolarHBondContact O-N 3.45Å; F237-Q240 PolarHBondContact O-N 3.33Å; F237-Q240 VanDerWaalsContact O-N 3.13Å; F237-T241 WeakPolarHBondContact CE1-OG1 3.38Å; F237-T241 PolarHBondContact O-N 2.77Å; F237-T241 PolarHBondContact O-OG1 3.49Å
238	Q	83.5	Confident	72.6	Confident	128 Å²	128	87.7 Å²	87.7	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-60.6	-40.9	178.6	-169.5	177.9	17.6	0	0	111.7	V233 D234 A242	V233-Q238 HydrophobicContact CG1-CB 4.14Å; D234-Q238 PolarHBondContact O-N 2.88Å; Q238-A242 WeakPolarHBondContact O-CB 3.42Å; Q238-A242 PolarHBondContact O-N 2.9Å
239	H	80.6	Confident	73.5	Confident	128 Å²	128	88.9 Å²	88.9	59%	0.593	49%	0.49	S	S	*	.	H	α-helix	trans	-64.7	-42.9	173.6	-176.1	-75	0	0	0	112.1	P235 L236 F237 A242 A243	P235-H239 WeakPolarHBondContact O-CB 3.45Å; P235-H239 PolarHBondContact O-N 3.18Å; L236-H239 PolarHBondContact O-N 3.09Å; F237-H239 VanDerWaalsContact C-N 3.31Å; F237-H239 PolarHBondContact O-N 3.45Å; H239-A242 PolarHBondContact O-N 2.94Å; H239-A243 WeakPolarHBondContact O-CB 3.32Å; H239-A243 PolarHBondContact O-N 3.31Å
240	Q	78.4	Confident	74.1	Confident	7 Å²	7	86 Å²	86	3%	0.033	48%	0.484	C	S	.	.	H	α-helix	trans	-63.5	-43.9	176.1	-75.7	177.5	25.1	0	0	111.9	L236 F237 A243 Y244	L236-Q240 WeakPolarHBondContact O-CB 3.09Å; L236-Q240 VanDerWaalsContact O-CG 3.31Å; L236-Q240 WeakPolarHBondContact O-CG 3.42Å; L236-Q240 PolarHBondContact O-N 2.75Å; F237-Q240 PolarHBondContact O-N 3.33Å; F237-Q240 VanDerWaalsContact O-N 3.13Å; Q240-A243 PolarHBondContact O-N 3.24Å; Q240-Y244 WeakPolarHBondContact O-CD2 3.19Å; Q240-Y244 PolarHBondContact O-N 2.69Å
241	T	82.1	Confident	74.6	Confident	52 Å²	52	78.7 Å²	78.7	32%	0.319	45%	0.453	S	S	.	.	H	α-helix	trans	-62.4	-46.4	176.3	-60	0	0	0	0	111.2	F237 A243 Y244 D245	F237-T241 WeakPolarHBondContact CE1-OG1 3.38Å; F237-T241 PolarHBondContact O-N 2.77Å; F237-T241 PolarHBondContact O-OG1 3.49Å; T241-A243 VanDerWaalsContact C-N 3.28Å; T241-A243 PolarHBondContact O-N 2.8Å; T241-Y244 WeakPolarHBondContact O-CB 3.44Å; T241-Y244 PolarHBondContact O-N 3.07Å; T241-Y244 VanDerWaalsContact O-N 3.11Å; T241-D245 PolarHBondContact O-N 3.5Å; T241-D245 VanDerWaalsContact O-N 3.1Å
242	A	80.6	Confident	75	Confident	62 Å²	62	77 Å²	77	51%	0.512	44%	0.444	S	S	.	.	H	α-helix	trans	-62.7	-33.8	175.7	0	0	0	0	0	112.8	Q238 H239	Q238-A242 WeakPolarHBondContact O-CB 3.42Å; Q238-A242 PolarHBondContact O-N 2.9Å; H239-A242 PolarHBondContact O-N 2.94Å
243	A	75.4	Confident	75.2	Confident	15 Å²	15	73.1 Å²	73.1	12%	0.124	42%	0.417	C	S	.	.	H	α-helix	trans	-69.8	-37.8	172.8	0	0	0	0	0	112.1	H239 Q240 T241 D245 E246 E251	H239-A243 WeakPolarHBondContact O-CB 3.32Å; H239-A243 PolarHBondContact O-N 3.31Å; Q240-A243 PolarHBondContact O-N 3.24Å; T241-A243 VanDerWaalsContact C-N 3.28Å; T241-A243 PolarHBondContact O-N 2.8Å; A243-D245 VanDerWaalsContact C-N 3.32Å; A243-D245 PolarHBondContact O-N 2.64Å; A243-E246 WeakPolarHBondContact O-CB 3.43Å; A243-E246 PolarHBondContact O-N 3.3Å; A243-E251 WeakPolarHBondContact O-CG 3.4Å; A243-E251 VanDerWaalsContact O-OE2 3.07Å
244	Y	77.6	Confident	75.5	Confident	102 Å²	102	76.5 Å²	76.5	40%	0.4	43%	0.433	S	S	.	.	H	α-helix	trans	-64.6	-32.9	176.4	-91.8	-63.7	0	0	0	113.9	Q240 T241 E246 R253	Q240-Y244 WeakPolarHBondContact O-CD2 3.19Å; Q240-Y244 PolarHBondContact O-N 2.69Å; T241-Y244 WeakPolarHBondContact O-CB 3.44Å; T241-Y244 PolarHBondContact O-N 3.07Å; T241-Y244 VanDerWaalsContact O-N 3.11Å; Y244-E246 PolarHBondContact O-N 2.81Å; Y244-R253 HydrophobicContact CE2-CG 3.81Å; Y244-R253 WeakPolarHBondContact OH-CB 3.35Å; Y244-R253 VanDerWaalsContact OH-CD 3.29Å; Y244-R253 WeakPolarHBondContact OH-CD 3.41Å; Y244-R253 WeakPolarHBondContact OH-CG 3.41Å
245	D	75.6	Confident	75.3	Confident	135 Å²	135	80.5 Å²	80.5	72%	0.722	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-12	177.9	-70.1	-26	0	0	0	112.8	T241 A243	T241-D245 PolarHBondContact O-N 3.5Å; T241-D245 VanDerWaalsContact O-N 3.1Å; A243-D245 VanDerWaalsContact C-N 3.32Å; A243-D245 PolarHBondContact O-N 2.64Å
246	E	67.8	Low	74.8	Confident	97 Å²	97	80 Å²	80	45%	0.453	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-21	-174.9	-169.8	163.3	-104.5	0	0	114.2	A243 Y244 R536	A243-E246 WeakPolarHBondContact O-CB 3.43Å; A243-E246 PolarHBondContact O-N 3.3Å; Y244-E246 PolarHBondContact O-N 2.81Å; E246-R536 WeakPolarHBondContact OE1-CD 3.32Å; E246-R536 IonicContact OE1-CZ 3.11Å; E246-R536 IonicContact OE1-NE 3.62Å; E246-R536 PolarHBondContact OE1-NE 2.86Å; E246-R536 IonicContact OE1-NH1 3.23Å; E246-R536 PolarHBondContact OE1-NH1 2.74Å; E246-R536 IonicContact OE1-NH2 2.69Å; E246-R536 IonicContact OE2-CZ 3.21Å; E246-R536 IonicContact OE2-NH1 2.75Å; E246-R536 PolarHBondContact OE2-NH1 3.33Å; E246-R536 IonicContact OE2-NH2 2.75Å; E246-R536 PolarHBondContact OE2-NH2 3.12Å
247	G	64.7	Low	74.5	Confident	63 Å²	63	78.7 Å²	78.7	65%	0.649	44%	0.437	S	S	*	.			trans	76.9	82.7	171.6	0	0	0	0	0	117.2	E251	G247-E251 WeakPolarHBondContact CA-OE2 3.44Å; G247-E251 PolarHBondContact N-OE2 3.05Å
248	G	68.4	Low	74.2	Confident	40 Å²	40	77.7 Å²	77.7	41%	0.412	44%	0.443	S	S	.	.	S	Bend	trans	-172.3	163.9	173.4	0	0	0	0	0	117.3	A250 E251	G248-A250 PolarHBondContact O-N 3.07Å; G248-E251 PolarHBondContact N-OE1 3.22Å; G248-E251 PolarHBondContact N-OE2 3.01Å; G248-E251 PolarHBondContact O-N 2.85Å
249	T	68.9	Low	74	Confident	106 Å²	106	75.1 Å²	75.1	65%	0.65	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.3	173.3	50.4	0	0	0	0	113.5	E251 L252 N255	T249-E251 PolarHBondContact O-N 3.14Å; T249-L252 WeakPolarHBondContact O-CD1 3.42Å; T249-L252 WeakPolarHBondContact O-CG 3.22Å; T249-N255 PolarHBondContact O-ND2 3.06Å
250	A	66	Low	73.7	Confident	70 Å²	70	71 Å²	71	58%	0.579	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-70.7	-15.2	171.2	0	0	0	0	0	113.2	G248 Q256	G248-A250 PolarHBondContact O-N 3.07Å; A250-Q256 PolarHBondContact O-NE2 3.47Å
251	E	66.9	Low	73.4	Confident	20 Å²	20	73.6 Å²	73.6	9%	0.093	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-105	4.3	-176.3	-57.8	141.9	-149.1	0	0	112.8	A243 G247 G248 T249 R253	A243-E251 WeakPolarHBondContact O-CG 3.4Å; A243-E251 VanDerWaalsContact O-OE2 3.07Å; G247-E251 WeakPolarHBondContact CA-OE2 3.44Å; G247-E251 PolarHBondContact N-OE2 3.05Å; G248-E251 PolarHBondContact N-OE1 3.22Å; G248-E251 PolarHBondContact N-OE2 3.01Å; G248-E251 PolarHBondContact O-N 2.85Å; T249-E251 PolarHBondContact O-N 3.14Å; E251-R253 PolarHBondContact O-N 3.12Å; E251-R253 VanDerWaalsContact O-N 3.12Å
252	L	71.2	Confident	73	Confident	99 Å²	99	76.5 Å²	76.5	52%	0.518	47%	0.467	S	S	.	.			trans	-55.6	119.3	166.1	-65.2	171.7	0	0	0	108.7	T249 L254 N255	T249-L252 WeakPolarHBondContact O-CD1 3.42Å; T249-L252 WeakPolarHBondContact O-CG 3.22Å; L252-L254 PolarHBondContact O-N 2.74Å; L252-N255 WeakPolarHBondContact O-CB 3.38Å; L252-N255 PolarHBondContact O-N 2.68Å
253	R	71.7	Confident	72.9	Confident	84 Å²	84	77.6 Å²	77.6	32%	0.317	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-41.5	-47	-171.8	-123.6	175.5	-177.2	141.8	2.6	114.4	Y244 E251 N255 Q256 L257	Y244-R253 HydrophobicContact CE2-CG 3.81Å; Y244-R253 WeakPolarHBondContact OH-CB 3.35Å; Y244-R253 VanDerWaalsContact OH-CD 3.29Å; Y244-R253 WeakPolarHBondContact OH-CD 3.41Å; Y244-R253 WeakPolarHBondContact OH-CG 3.41Å; E251-R253 PolarHBondContact O-N 3.12Å; E251-R253 VanDerWaalsContact O-N 3.12Å; R253-N255 PolarHBondContact O-N 3.29Å; R253-N255 VanDerWaalsContact O-N 3.1Å; R253-Q256 PolarHBondContact O-N 2.56Å; R253-L257 HydrophobicContact CB-CD1 3.9Å; R253-L257 HydrophobicContact CB-CG 4.45Å; R253-L257 HydrophobicContact CG-CD1 3.88Å; R253-L257 HydrophobicContact CG-CG 4.22Å; R253-L257 VanDerWaalsContact O-CG 3.27Å; R253-L257 WeakPolarHBondContact O-CG 3.23Å; R253-L257 PolarHBondContact O-N 2.96Å
254	L	79.1	Confident	72.8	Confident	132 Å²	132	81.1 Å²	81.1	69%	0.691	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-59.3	-21.6	-177.6	-76.2	155.5	0	0	0	114.1	L252 L266	L252-L254 PolarHBondContact O-N 2.74Å; L254-L266 HydrophobicContact CD2-CD1 4.02Å; L254-L266 HydrophobicContact CD2-CD2 4.47Å
255	N	74.8	Confident	72.9	Confident	112 Å²	112	81.8 Å²	81.8	60%	0.599	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-81.7	-16.4	175	-64.2	-21	0	0	0	113.4	T249 L252 R253	T249-N255 PolarHBondContact O-ND2 3.06Å; L252-N255 WeakPolarHBondContact O-CB 3.38Å; L252-N255 PolarHBondContact O-N 2.68Å; R253-N255 PolarHBondContact O-N 3.29Å; R253-N255 VanDerWaalsContact O-N 3.1Å
256	Q	71.1	Confident	73.3	Confident	78 Å²	78	79.1 Å²	79.1	36%	0.364	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-20.9	-177.4	-60	-171.3	7.3	0	0	113.5	A250 R253	A250-Q256 PolarHBondContact O-NE2 3.47Å; R253-Q256 PolarHBondContact O-N 2.56Å
257	L	77.5	Confident	74	Confident	24 Å²	24	75.4 Å²	75.4	13%	0.126	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-73.6	132.3	177.3	-67.3	167.6	0	0	0	111	R253 L266 I267 L268	R253-L257 HydrophobicContact CB-CD1 3.9Å; R253-L257 HydrophobicContact CB-CG 4.45Å; R253-L257 HydrophobicContact CG-CD1 3.88Å; R253-L257 HydrophobicContact CG-CG 4.22Å; R253-L257 VanDerWaalsContact O-CG 3.27Å; R253-L257 WeakPolarHBondContact O-CG 3.23Å; R253-L257 PolarHBondContact O-N 2.96Å; L257-L266 HydrophobicContact CB-CD2 3.98Å; L257-L266 HydrophobicContact CD1-CB 4.47Å; L257-L266 HydrophobicContact CD1-CD1 4.18Å; L257-L266 HydrophobicContact CD1-CD2 4.46Å; L257-I267 WeakPolarHBondContact CD2-O 3.47Å; L257-L268 HydrophobicContact CD1-CD2 4.17Å; L257-L268 HydrophobicContact CD2-CD2 3.6Å; L257-L268 HydrophobicContact CD2-CG 4.33Å
258	S	75.5	Confident	74.7	Confident	78 Å²	78	76.9 Å²	76.9	55%	0.545	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-90	152.2	169.4	-64.2	0	0	0	0	110.6	I267	S258-I267 WeakPolarHBondContact O-CB 3.24Å; S258-I267 PolarHBondContact O-N 3.35Å
259	T	80.3	Confident	75.2	Confident	73 Å²	73	78.1 Å²	78.1	45%	0.448	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-94.5	139.4	170.3	51.1	0	0	0	0	111.1	C264 E265 L266	T259-C264 HydrophobicContact CG2-CB 4.31Å; T259-E265 CarbonylContact C-O 3.56Å; T259-E265 WeakPolarHBondContact CA-O 3.34Å; T259-L266 HydrophobicContact CG2-CD2 3.95Å
260	A	73.3	Confident	75.6	Confident	42 Å²	42	76.4 Å²	76.4	35%	0.347	45%	0.451	S	S	.	.	S	Bend	trans	-75	-28	-178.1	0	0	0	0	0	113.3	E265 I267	A260-E265 PolarHBondContact N-O 3.27Å; A260-I267 HydrophobicContact CB-CD1 4.1Å; A260-I267 HydrophobicContact CB-CG1 3.92Å
261	N	72.7	Confident	76	Confident	62 Å²	62	77.2 Å²	77.2	33%	0.332	45%	0.452	S	S	.	.	S	Bend	trans	-159.7	175.1	-167.5	52.2	31.6	0	0	0	112.3	S263 C264 E265	N261-S263 PolarHBondContact ND2-OG 3.42Å; N261-S263 PolarHBondContact O-N 3.16Å; N261-S263 VanDerWaalsContact O-N 3.12Å; N261-S263 PolarHBondContact OD1-N 3.07Å; N261-S263 PolarHBondContact OD1-OG 3.37Å; N261-C264 PolarHBondContact O-N 3.3Å; N261-E265 PolarHBondContact ND2-OE2 2.95Å; N261-E265 PolarHBondContact OD1-N 2.99Å
262	A	74.5	Confident	76.2	Confident	112 Å²	112	78.9 Å²	78.9	93%	0.926	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.8	178.2	0	0	0	0	0	114.5	C264	A262-C264 VanDerWaalsContact C-N 3.32Å
263	S	77.4	Confident	75.8	Confident	85 Å²	85	80.1 Å²	80.1	59%	0.594	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	6.2	170.6	26.4	0	0	0	0	113.3	N261 E265	N261-S263 PolarHBondContact ND2-OG 3.42Å; N261-S263 PolarHBondContact O-N 3.16Å; N261-S263 VanDerWaalsContact O-N 3.12Å; N261-S263 PolarHBondContact OD1-N 3.07Å; N261-S263 PolarHBondContact OD1-OG 3.37Å; S263-E265 VanDerWaalsContact C-N 3.28Å; S263-E265 PolarHBondContact O-N 2.87Å
264	C	74.4	Confident	75.3	Confident	90 Å²	90	80 Å²	80	61%	0.608	49%	0.486	S	S	*	.			trans	61.6	27.4	175.9	-60.7	0	0	0	0	115.1	T259 N261 A262 L266	T259-C264 HydrophobicContact CG2-CB 4.31Å; N261-C264 PolarHBondContact O-N 3.3Å; A262-C264 VanDerWaalsContact C-N 3.32Å; C264-L266 PolarHBondContact O-N 2.89Å
265	E	80.3	Confident	74	Confident	116 Å²	116	81 Å²	81	54%	0.542	49%	0.489	S	S	.	.			trans	-67	120.3	173.7	-66.6	179.6	157.4	0	0	110.5	T259 A260 N261 S263	T259-E265 CarbonylContact C-O 3.56Å; T259-E265 WeakPolarHBondContact CA-O 3.34Å; A260-E265 PolarHBondContact N-O 3.27Å; N261-E265 PolarHBondContact ND2-OE2 2.95Å; N261-E265 PolarHBondContact OD1-N 2.99Å; S263-E265 VanDerWaalsContact C-N 3.28Å; S263-E265 PolarHBondContact O-N 2.87Å
266	L	82.1	Confident	72.8	Confident	79 Å²	79	82 Å²	82	41%	0.414	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-78.8	128.2	-177.5	-64.5	169.1	0	0	0	111.5	L254 L257 T259 C264 L268	L254-L266 HydrophobicContact CD2-CD1 4.02Å; L254-L266 HydrophobicContact CD2-CD2 4.47Å; L257-L266 HydrophobicContact CB-CD2 3.98Å; L257-L266 HydrophobicContact CD1-CB 4.47Å; L257-L266 HydrophobicContact CD1-CD1 4.18Å; L257-L266 HydrophobicContact CD1-CD2 4.46Å; T259-L266 HydrophobicContact CG2-CD2 3.95Å; C264-L266 PolarHBondContact O-N 2.89Å; L266-L268 PolarHBondContact O-N 3.47Å
267	I	82.3	Confident	71.3	Confident	18 Å²	18	89.1 Å²	89.1	9%	0.092	52%	0.518	C	S	.	.			trans	-77.6	110.1	177	-68.8	154.9	0	0	0	109.7	L236 L257 S258 A260 T272 V274	L236-I267 HydrophobicContact CD2-CG2 4.16Å; L257-I267 WeakPolarHBondContact CD2-O 3.47Å; S258-I267 WeakPolarHBondContact O-CB 3.24Å; S258-I267 PolarHBondContact O-N 3.35Å; A260-I267 HydrophobicContact CB-CD1 4.1Å; A260-I267 HydrophobicContact CB-CG1 3.92Å; I267-T272 WeakPolarHBondContact CG2-OG1 3.25Å; I267-V274 HydrophobicContact CD1-CG1 4.46Å; I267-V274 HydrophobicContact CD1-CG2 3.76Å
268	L	79.8	Confident	69.3	Low	94 Å²	94	91.7 Å²	91.7	49%	0.492	53%	0.534	S	S	.	.			trans	-112.4	-9.2	-178.6	-75.2	167.2	0	0	0	114.5	L257 L266	L257-L268 HydrophobicContact CD1-CD2 4.17Å; L257-L268 HydrophobicContact CD2-CD2 3.6Å; L257-L268 HydrophobicContact CD2-CG 4.33Å; L266-L268 PolarHBondContact O-N 3.47Å
269	D	78.6	Confident	67.6	Low	66 Å²	66	96.4 Å²	96.4	35%	0.353	55%	0.553	S	S	.	*			trans	-132.4	130.8	-175.7	173.6	8.1	0	0	0	109.6	S271 T272	D269-S271 PolarHBondContact O-N 2.87Å; D269-S271 WeakPolarHBondContact OD1-CB 3.06Å; D269-S271 PolarHBondContact OD1-N 3.13Å; D269-S271 PolarHBondContact OD1-OG 3.38Å; D269-S271 WeakPolarHBondContact OD2-CB 3.36Å; D269-S271 PolarHBondContact OD2-OG 3.25Å; D269-T272 HydrophobicContact CB-CG2 4.35Å; D269-T272 PolarHBondContact O-N 3.46Å; D269-T272 VanDerWaalsContact O-N 3.14Å; D269-T272 PolarHBondContact O-OG1 2.97Å
270	S	77.6	Confident	65.7	Low	71 Å²	71	97.8 Å²	97.8	50%	0.497	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	-16.4	175.7	63.7	0	0	0	0	114.4	D234 T272	D234-S270 WeakPolarHBondContact OD1-CB 3.46Å; D234-S270 PolarHBondContact OD1-N 3.11Å; D234-S270 PolarHBondContact OD1-OG 2.82Å; S270-T272 PolarHBondContact O-N 3.1Å
271	S	74.5	Confident	64	Low	86 Å²	86	102 Å²	102	60%	0.601	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-20.1	173.2	89.1	0	0	0	0	113.4	D269 P273	D269-S271 PolarHBondContact O-N 2.87Å; D269-S271 WeakPolarHBondContact OD1-CB 3.06Å; D269-S271 PolarHBondContact OD1-N 3.13Å; D269-S271 PolarHBondContact OD1-OG 3.38Å; D269-S271 WeakPolarHBondContact OD2-CB 3.36Å; D269-S271 PolarHBondContact OD2-OG 3.25Å; S271-P273 WeakPolarHBondContact O-CD 3.36Å
272	T	71.9	Confident	62.1	Low	56 Å²	56	105.9 Å²	105.9	34%	0.344	61%	0.608	S	S	.	*	S	Bend	trans	-71.6	119.8	-176.9	57.7	0	0	0	0	111.1	I267 D269 S270 V274	I267-T272 WeakPolarHBondContact CG2-OG1 3.25Å; D269-T272 HydrophobicContact CB-CG2 4.35Å; D269-T272 PolarHBondContact O-N 3.46Å; D269-T272 VanDerWaalsContact O-N 3.14Å; D269-T272 PolarHBondContact O-OG1 2.97Å; S270-T272 PolarHBondContact O-N 3.1Å; T272-V274 PolarHBondContact O-N 3.11Å
273	P	63.3	Low	60.3	Low	124 Å²	124	108 Å²	108	81%	0.805	60%	0.599	S	S	*	*			trans	-72.2	99.6	179.7	28.9	-33.5	0	0	0	109.1	S271 M275	S271-P273 WeakPolarHBondContact O-CD 3.36Å; P273-M275 PolarHBondContact O-N 2.84Å
274	V	61.1	Low	58.4	Low	81 Å²	81	110.2 Å²	110.2	49%	0.491	61%	0.612	S	S	.	*			trans	-57	113.2	168	-173.3	0	0	0	0	107.2	I267 T272 L276	I267-V274 HydrophobicContact CD1-CG1 4.46Å; I267-V274 HydrophobicContact CD1-CG2 3.76Å; T272-V274 PolarHBondContact O-N 3.11Å; V274-L276 PolarHBondContact O-N 3.28Å
275	M	51.8	Low	56.8	Low	153 Å²	153	113.2 Å²	113.2	75%	0.754	62%	0.62	S	S	*	*			trans	-67.7	77.6	166	-97.7	-163.3	68.7	0	0	108.2	P273 R277	P273-M275 PolarHBondContact O-N 2.84Å; M275-R277 PolarHBondContact O-N 3.16Å
276	L	48.5	Very low	55	Low	133 Å²	133	113.1 Å²	113.1	70%	0.696	63%	0.627	S	S	*	*			trans	-55.8	113.4	161	-146.7	86.3	0	0	0	104.9	V274 T278	V274-L276 PolarHBondContact O-N 3.28Å; L276-T278 PolarHBondContact O-N 3.24Å; L276-T278 PolarHBondContact O-OG1 3.37Å
277	R	40	Very low	53.1	Low	229 Å²	229	115.7 Å²	115.7	86%	0.864	65%	0.649	S	S	*	*			trans	-77.5	47.3	-178.8	-145.4	179.2	-166.1	175.5	4.7	110.2	M275 L279	M275-R277 PolarHBondContact O-N 3.16Å; R277-L279 PolarHBondContact O-N 3.39Å
278	T	35.7	Very low	51	Low	77 Å²	77	122.8 Å²	122.8	47%	0.472	68%	0.684	S	S	.	*			trans	-53.4	126.5	164.6	-36.8	0	0	0	0	106.8	L276 T280	L276-T278 PolarHBondContact O-N 3.24Å; L276-T278 PolarHBondContact O-OG1 3.37Å; T278-T280 HydrophobicContact CG2-CG2 3.99Å; T278-T280 WeakPolarHBondContact CG2-OG1 3.45Å; T278-T280 PolarHBondContact O-N 2.87Å
279	L	40.1	Very low	49.1	Very low	178 Å²	178	123.9 Å²	123.9	93%	0.932	69%	0.69	S	S	*	*	S	Bend	trans	-75.5	56.9	-177.1	-70.4	156.9	0	0	0	110.5	R277	R277-L279 PolarHBondContact O-N 3.39Å
280	T	39	Very low	47.8	Very low	102 Å²	102	125.6 Å²	125.6	63%	0.626	70%	0.703	S	S	*	*			trans	-142.4	46.3	-170.5	57.3	0	0	0	0	112.4	T278	T278-T280 HydrophobicContact CG2-CG2 3.99Å; T278-T280 WeakPolarHBondContact CG2-OG1 3.45Å; T278-T280 PolarHBondContact O-N 2.87Å
281	T	37.6	Very low	46.7	Very low	130 Å²	130	125.6 Å²	125.6	80%	0.798	70%	0.7	S	S	*	*			trans	-121.8	91.6	156.9	-60.1	0	0	0	0	108.4	Q283	T281-Q283 PolarHBondContact O-N 3.44Å
282	T	32.6	Very low	45.7	Very low	143 Å²	143	126.9 Å²	126.9	88%	0.877	70%	0.7	S	S	*	*			trans	-73.1	90.2	175.8	49.4	0	0	0	0	110.3
283	Q	37	Very low	45	Very low	157 Å²	157	127.8 Å²	127.8	73%	0.734	71%	0.706	S	S	*	*			trans	-100.1	136.7	147.2	-71.3	-156.2	8.8	0	0	109	T281 I285	T281-Q283 PolarHBondContact O-N 3.44Å; Q283-I285 PolarHBondContact O-N 2.98Å
284	P	38.7	Very low	44.7	Very low	132 Å²	132	126.1 Å²	126.1	86%	0.857	69%	0.693	S	S	*	*			trans	-75	88.7	-176.3	30.3	-34.3	0	0	0	110.6	T286	P284-T286 PolarHBondContact O-N 3.16Å
285	I	40.3	Very low	44.5	Very low	152 Å²	152	128.8 Å²	128.8	78%	0.779	70%	0.7	S	S	*	*			trans	-74.5	114.1	169.3	-59.5	176.2	0	0	0	107.9	Q283	Q283-I285 PolarHBondContact O-N 2.98Å
286	T	41.9	Very low	44.7	Very low	114 Å²	114	127.8 Å²	127.8	70%	0.699	69%	0.692	S	S	*	*			trans	-50.2	130.9	167.9	48.1	0	0	0	0	109.9	P284 M288	P284-T286 PolarHBondContact O-N 3.16Å; T286-M288 PolarHBondContact O-N 3.31Å
287	P	43.5	Very low	45.1	Very low	134 Å²	134	125.4 Å²	125.4	87%	0.87	68%	0.679	S	S	*	*			trans	-63.8	98.4	-175.4	25.5	-34.3	0	0	0	110.6	N289	P287-N289 PolarHBondContact O-N 3.44Å
288	M	36.5	Very low	46.2	Very low	167 Å²	167	118 Å²	118	82%	0.823	66%	0.663	S	S	*	*			trans	-75.6	120.1	174.2	-169.5	172.5	-173	0	0	107.9	T286 V290	T286-M288 PolarHBondContact O-N 3.31Å; M288-V290 WeakPolarHBondContact O-CG2 3.19Å; M288-V290 PolarHBondContact O-N 2.94Å
289	N	41.4	Very low	47.2	Very low	117 Å²	117	117.2 Å²	117.2	63%	0.626	66%	0.66	S	S	*	*			trans	-58.7	112.8	-173.2	-171.9	9.4	0	0	0	111.5	P287 T291	P287-N289 PolarHBondContact O-N 3.44Å; N289-T291 VanDerWaalsContact C-N 3.27Å; N289-T291 PolarHBondContact ND2-OG1 3.27Å; N289-T291 PolarHBondContact O-N 3.01Å; N289-T291 WeakPolarHBondContact OD1-CG2 3.27Å; N289-T291 PolarHBondContact OD1-OG1 3.04Å
290	V	49.9	Very low	47.4	Very low	101 Å²	101	113.4 Å²	113.4	61%	0.612	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-6.7	-168.1	-146.2	0	0	0	0	113.1	M288 N292 V293 T294	M288-V290 WeakPolarHBondContact O-CG2 3.19Å; M288-V290 PolarHBondContact O-N 2.94Å; V290-N292 PolarHBondContact O-N 2.96Å; V290-V293 HydrophobicContact CG1-CB 4.13Å; V290-V293 HydrophobicContact CG1-CG2 4Å; V290-V293 WeakPolarHBondContact O-CB 3.19Å; V290-V293 PolarHBondContact O-N 3.3Å; V290-T294 PolarHBondContact O-N 3.09Å
291	T	56.4	Low	48.2	Very low	72 Å²	72	112.9 Å²	112.9	44%	0.442	63%	0.632	S	S	.	*	H	α-helix	trans	-55.8	-35.6	-178.6	54.1	0	0	0	0	113.5	N289 V293 T294 E295	N289-T291 VanDerWaalsContact C-N 3.27Å; N289-T291 PolarHBondContact ND2-OG1 3.27Å; N289-T291 PolarHBondContact O-N 3.01Å; N289-T291 WeakPolarHBondContact OD1-CG2 3.27Å; N289-T291 PolarHBondContact OD1-OG1 3.04Å; T291-V293 VanDerWaalsContact C-N 3.28Å; T291-V293 PolarHBondContact O-N 2.9Å; T291-T294 PolarHBondContact O-N 3.17Å; T291-T294 PolarHBondContact O-OG1 3.05Å; T291-E295 PolarHBondContact O-N 2.77Å
292	N	53.5	Low	49.1	Very low	113 Å²	113	110 Å²	110	60%	0.604	62%	0.622	S	S	*	*	H	α-helix	trans	-74.2	-21.4	-179.8	-67.7	9.9	0	0	0	112.3	V290 F296	V290-N292 PolarHBondContact O-N 2.96Å; N292-F296 WeakPolarHBondContact O-CB 3.29Å; N292-F296 PolarHBondContact O-N 3.47Å
293	V	55.6	Low	50.1	Low	75 Å²	75	112.7 Å²	112.7	46%	0.455	62%	0.615	S	S	.	*	H	α-helix	trans	-75.9	-38.3	177	-169.5	0	0	0	0	109.8	V290 T291 F296 L297	V290-V293 HydrophobicContact CG1-CB 4.13Å; V290-V293 HydrophobicContact CG1-CG2 4Å; V290-V293 WeakPolarHBondContact O-CB 3.19Å; V290-V293 PolarHBondContact O-N 3.3Å; T291-V293 VanDerWaalsContact C-N 3.28Å; T291-V293 PolarHBondContact O-N 2.9Å; V293-F296 PolarHBondContact O-N 3.24Å; V293-L297 HydrophobicContact CG1-CD1 3.85Å; V293-L297 HydrophobicContact CG1-CG 4.19Å; V293-L297 WeakPolarHBondContact O-CB 3.22Å; V293-L297 VanDerWaalsContact O-CG 3.23Å; V293-L297 WeakPolarHBondContact O-CG 3.46Å; V293-L297 PolarHBondContact O-N 2.9Å
294	T	57.6	Low	50.8	Low	89 Å²	89	107.1 Å²	107.1	55%	0.546	59%	0.594	S	S	.	*	H	α-helix	trans	-67.5	-39.1	173.1	31	0	0	0	0	112.5	V290 T291 S298	V290-T294 PolarHBondContact O-N 3.09Å; T291-T294 PolarHBondContact O-N 3.17Å; T291-T294 PolarHBondContact O-OG1 3.05Å; T294-S298 WeakPolarHBondContact O-CB 3.2Å; T294-S298 PolarHBondContact O-N 2.73Å; T294-S298 PolarHBondContact O-OG 3.35Å
295	E	57.8	Low	51.5	Low	137 Å²	137	105.8 Å²	105.8	64%	0.64	58%	0.579	S	S	*	*	H	α-helix	trans	-67.4	-41.2	172.8	-80.1	-163.6	145	0	0	112.8	T291 S299	T291-E295 PolarHBondContact O-N 2.77Å; E295-S299 VanDerWaalsContact O-CB 3.22Å; E295-S299 WeakPolarHBondContact O-CB 3.27Å; E295-S299 PolarHBondContact O-N 3.42Å; E295-S299 PolarHBondContact O-OG 3.14Å
296	F	55.6	Low	52.2	Low	132 Å²	132	105.6 Å²	105.6	58%	0.579	58%	0.58	S	S	*	*	H	α-helix	trans	-66.3	-45.9	177.7	-178.2	-97.6	0	0	0	111.9	N292 V293 S299 M300	N292-F296 WeakPolarHBondContact O-CB 3.29Å; N292-F296 PolarHBondContact O-N 3.47Å; V293-F296 PolarHBondContact O-N 3.24Å; F296-S299 PolarHBondContact O-N 3.04Å; F296-M300 HydrophobicContact CE1-CG 4.37Å; F296-M300 HydrophobicContact CE1-SD 4.16Å; F296-M300 HydrophobicContact CZ-CG 4.37Å; F296-M300 HydrophobicContact CZ-SD 4.26Å; F296-M300 PolarHBondContact O-N 3.35Å
297	L	56.9	Low	53.1	Low	82 Å²	82	108.3 Å²	108.3	43%	0.429	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-44.9	174.7	-72.6	176.2	0	0	0	111	V293 S299 M300 L301	V293-L297 HydrophobicContact CG1-CD1 3.85Å; V293-L297 HydrophobicContact CG1-CG 4.19Å; V293-L297 WeakPolarHBondContact O-CB 3.22Å; V293-L297 VanDerWaalsContact O-CG 3.23Å; V293-L297 WeakPolarHBondContact O-CG 3.46Å; V293-L297 PolarHBondContact O-N 2.9Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 3.41Å; L297-M300 PolarHBondContact O-N 2.92Å; L297-L301 HydrophobicContact CB-CD1 3.95Å; L297-L301 HydrophobicContact CD2-CD1 4.18Å; L297-L301 WeakPolarHBondContact O-CB 3.39Å; L297-L301 WeakPolarHBondContact O-CD1 3.4Å; L297-L301 PolarHBondContact O-N 2.92Å
298	S	61.9	Low	53.5	Low	75 Å²	75	107.8 Å²	107.8	52%	0.524	57%	0.574	S	S	.	*	H	α-helix	trans	-58.9	-39.7	174.7	-61.1	0	0	0	0	111.7	T294 A302	T294-S298 WeakPolarHBondContact O-CB 3.2Å; T294-S298 PolarHBondContact O-N 2.73Å; T294-S298 PolarHBondContact O-OG 3.35Å; S298-A302 WeakPolarHBondContact O-CB 3.25Å; S298-A302 PolarHBondContact O-N 3.12Å
299	S	57.8	Low	54.5	Low	59 Å²	59	102.5 Å²	102.5	41%	0.413	55%	0.553	S	S	.	*	H	α-helix	trans	-70.9	-31.1	178.2	-62.4	0	0	0	0	113.8	E295 F296 L297 R303	E295-S299 VanDerWaalsContact O-CB 3.22Å; E295-S299 WeakPolarHBondContact O-CB 3.27Å; E295-S299 PolarHBondContact O-N 3.42Å; E295-S299 PolarHBondContact O-OG 3.14Å; F296-S299 PolarHBondContact O-N 3.04Å; L297-S299 VanDerWaalsContact C-N 3.26Å; L297-S299 PolarHBondContact O-N 3.41Å; S299-R303 WeakPolarHBondContact O-CB 3.34Å; S299-R303 WeakPolarHBondContact O-CD 3.4Å; S299-R303 WeakPolarHBondContact O-CG 3.5Å
300	M	44.4	Very low	55.7	Low	99 Å²	99	105.7 Å²	105.7	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-76	-56.1	170.4	-91.5	-152.3	71.5	0	0	111.6	F296 L297 A302 R303 S304	F296-M300 HydrophobicContact CE1-CG 4.37Å; F296-M300 HydrophobicContact CE1-SD 4.16Å; F296-M300 HydrophobicContact CZ-CG 4.37Å; F296-M300 HydrophobicContact CZ-SD 4.26Å; F296-M300 PolarHBondContact O-N 3.35Å; L297-M300 PolarHBondContact O-N 2.92Å; M300-A302 VanDerWaalsContact C-N 3.28Å; M300-A302 PolarHBondContact O-N 2.58Å; M300-R303 PolarHBondContact O-N 2.85Å; M300-S304 PolarHBondContact O-N 3.22Å; M300-S304 PolarHBondContact O-OG 2.75Å; M300-S304 VanDerWaalsContact O-OG 3.1Å
301	L	54.4	Low	55.6	Low	90 Å²	90	103.4 Å²	103.4	47%	0.471	56%	0.556	S	S	.	*	H	α-helix	trans	-56.6	-41.2	-177.5	-84.6	90.1	0	0	0	111.7	L297 R303 L305	L297-L301 HydrophobicContact CB-CD1 3.95Å; L297-L301 HydrophobicContact CD2-CD1 4.18Å; L297-L301 WeakPolarHBondContact O-CB 3.39Å; L297-L301 WeakPolarHBondContact O-CD1 3.4Å; L297-L301 PolarHBondContact O-N 2.92Å; L301-R303 VanDerWaalsContact C-N 3.28Å; L301-R303 PolarHBondContact O-N 3.43Å; L301-L305 HydrophobicContact CB-CD1 3.93Å; L301-L305 HydrophobicContact CD2-CD1 3.65Å; L301-L305 HydrophobicContact CG-CD1 3.56Å; L301-L305 PolarHBondContact O-N 3.27Å
302	A	57.3	Low	56.1	Low	71 Å²	71	104.4 Å²	104.4	59%	0.587	57%	0.566	S	S	*	*	H	α-helix	trans	-70.3	-18.8	178.6	0	0	0	0	0	114.4	S298 M300	S298-A302 WeakPolarHBondContact O-CB 3.25Å; S298-A302 PolarHBondContact O-N 3.12Å; M300-A302 VanDerWaalsContact C-N 3.28Å; M300-A302 PolarHBondContact O-N 2.58Å
303	R	54.5	Low	56.5	Low	198 Å²	198	105 Å²	105	75%	0.747	57%	0.574	S	S	*	*	H	α-helix	trans	-107.1	-27.2	-174.4	-70.3	-176.9	178.1	166.3	2.5	114.7	S299 M300 L301	S299-R303 WeakPolarHBondContact O-CB 3.34Å; S299-R303 WeakPolarHBondContact O-CD 3.4Å; S299-R303 WeakPolarHBondContact O-CG 3.5Å; M300-R303 PolarHBondContact O-N 2.85Å; L301-R303 VanDerWaalsContact C-N 3.28Å; L301-R303 PolarHBondContact O-N 3.43Å
304	S	51.9	Low	56.9	Low	40 Å²	40	106.7 Å²	106.7	28%	0.28	58%	0.58	S	S	.	*	H	α-helix	trans	-109.4	-34.5	-178	58.9	0	0	0	0	114.9	M300 N306 Q307 L308	M300-S304 PolarHBondContact O-N 3.22Å; M300-S304 PolarHBondContact O-OG 2.75Å; M300-S304 VanDerWaalsContact O-OG 3.1Å; S304-N306 VanDerWaalsContact C-N 3.33Å; S304-N306 PolarHBondContact O-N 3.41Å; S304-Q307 PolarHBondContact O-N 3.15Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; S304-L308 WeakPolarHBondContact O-CD1 3.44Å; S304-L308 PolarHBondContact O-N 2.85Å
305	L	51.6	Low	57.4	Low	104 Å²	104	108.8 Å²	108.8	55%	0.545	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-30.1	-171.9	-76.4	172.8	0	0	0	114.3	L301 Q307	L301-L305 HydrophobicContact CB-CD1 3.93Å; L301-L305 HydrophobicContact CD2-CD1 3.65Å; L301-L305 HydrophobicContact CG-CD1 3.56Å; L301-L305 PolarHBondContact O-N 3.27Å; L305-Q307 PolarHBondContact O-N 2.97Å
306	N	56.6	Low	57.7	Low	149 Å²	149	110.1 Å²	110.1	80%	0.797	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-4.8	177.7	-68.7	-19.6	0	0	0	114	S304	S304-N306 VanDerWaalsContact C-N 3.33Å; S304-N306 PolarHBondContact O-N 3.41Å
307	Q	59.4	Low	58.1	Low	170 Å²	170	110.5 Å²	110.5	79%	0.794	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	-10.7	179	-68.3	-174.2	-9.7	0	0	113.7	S304 L305	S304-Q307 PolarHBondContact O-N 3.15Å; S304-Q307 VanDerWaalsContact O-N 3.13Å; L305-Q307 PolarHBondContact O-N 2.97Å
308	L	52.1	Low	58.5	Low	124 Å²	124	114.8 Å²	114.8	65%	0.649	61%	0.607	S	S	*	*			trans	-97.3	107.2	174.7	-82.3	83.9	0	0	0	110.2	S304	S304-L308 WeakPolarHBondContact O-CD1 3.44Å; S304-L308 PolarHBondContact O-N 2.85Å
309	S	58.6	Low	58.1	Low	55 Å²	55	118.3 Å²	118.3	39%	0.385	61%	0.613	S	S	.	*			trans	-73.3	134.8	160.5	51.4	0	0	0	0	109.5	C311	S309-C311 PolarHBondContact O-N 3.29Å
310	I	66.5	Low	58.2	Low	184 Å²	184	120.7 Å²	120.7	94%	0.944	63%	0.625	S	S	*	*	S	Bend	trans	-62.6	-31.2	179.3	-66.1	167.7	0	0	0	110.6
311	C	46.8	Very low	58.7	Low	53 Å²	53	120.9 Å²	120.9	36%	0.358	63%	0.628	S	S	.	*			trans	-157	132.7	168.4	-171.4	0	0	0	0	107.8	S309 T313 L314 Q315	S309-C311 PolarHBondContact O-N 3.29Å; C311-T313 PolarHBondContact O-N 3.08Å; C311-T313 PolarHBondContact SG-OG1 3.25Å; C311-L314 HydrophobicContact CB-CB 4.25Å; C311-L314 HydrophobicContact CB-CD1 4.31Å; C311-L314 HydrophobicContact CB-CG 4.38Å; C311-L314 PolarHBondContact O-N 3.27Å; C311-Q315 PolarHBondContact O-N 3.32Å
312	S	67	Low	58.7	Low	93 Å²	93	125.9 Å²	125.9	65%	0.65	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-63.7	-39.3	-178.2	49.4	0	0	0	0	112.5	L314 Q315	S312-L314 PolarHBondContact O-N 3.11Å; S312-Q315 WeakPolarHBondContact O-CB 3.41Å; S312-Q315 PolarHBondContact O-N 3.27Å
313	T	62.2	Low	58.4	Low	125 Å²	125	125.4 Å²	125.4	77%	0.767	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-68.1	-17	177.2	23.1	0	0	0	0	114.3	C311	C311-T313 PolarHBondContact O-N 3.08Å; C311-T313 PolarHBondContact SG-OG1 3.25Å
314	L	65.1	Low	58.3	Low	111 Å²	111	122.1 Å²	122.1	58%	0.581	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-106.8	5.2	177.7	-64.2	176.9	0	0	0	113.5	C311 S312 N316 F317	C311-L314 HydrophobicContact CB-CB 4.25Å; C311-L314 HydrophobicContact CB-CD1 4.31Å; C311-L314 HydrophobicContact CB-CG 4.38Å; C311-L314 PolarHBondContact O-N 3.27Å; S312-L314 PolarHBondContact O-N 3.11Å; L314-N316 PolarHBondContact O-N 3.31Å; L314-N316 VanDerWaalsContact O-N 3.12Å; L314-F317 HydrophobicContact CD2-CB 4.46Å; L314-F317 WeakPolarHBondContact O-CB 3.45Å; L314-F317 PolarHBondContact O-N 3.23Å
315	Q	66.5	Low	58.3	Low	134 Å²	134	127.1 Å²	127.1	63%	0.626	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-23.5	-176.2	-168.9	162.9	3.6	0	0	113.6	C311 S312	C311-Q315 PolarHBondContact O-N 3.32Å; S312-Q315 WeakPolarHBondContact O-CB 3.41Å; S312-Q315 PolarHBondContact O-N 3.27Å
316	N	64.5	Low	58.4	Low	165 Å²	165	129.2 Å²	129.2	88%	0.882	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-3.1	176.2	-65.9	-10.4	0	0	0	113.9	L314 R318	L314-N316 PolarHBondContact O-N 3.31Å; L314-N316 VanDerWaalsContact O-N 3.12Å; N316-R318 PolarHBondContact O-N 3.18Å
317	F	64.1	Low	57.7	Low	140 Å²	140	128.6 Å²	128.6	61%	0.614	65%	0.651	S	S	*	*			trans	-84.1	113.8	-177.3	-175.1	-99.1	0	0	0	111.4	L314 F319	L314-F317 HydrophobicContact CD2-CB 4.46Å; L314-F317 WeakPolarHBondContact O-CB 3.45Å; L314-F317 PolarHBondContact O-N 3.23Å; F317-F319 AromaticContact CE1-CD2 3.66Å; F317-F319 HydrophobicContact CE1-CD2 3.66Å; F317-F319 AromaticContact CE1-CE2 3.87Å; F317-F319 HydrophobicContact CE1-CE2 3.87Å; F317-F319 HydrophobicContact CE1-CG 4.45Å; F317-F319 HydrophobicContact CZ-CD2 4.25Å; F317-F319 HydrophobicContact CZ-CE2 4.28Å
318	R	65.4	Low	56.8	Low	171 Å²	171	125.4 Å²	125.4	65%	0.645	65%	0.647	S	S	*	*			trans	-123.8	119	177.1	-120.3	-173.7	-178.5	-170.5	-0.6	111.1	N316 T320 D321	N316-R318 PolarHBondContact O-N 3.18Å; R318-T320 PolarHBondContact O-N 3.36Å; R318-T320 VanDerWaalsContact O-N 3.12Å; R318-D321 HydrophobicContact CB-CB 4.4Å; R318-D321 WeakPolarHBondContact CD-OD2 3.35Å; R318-D321 IonicContact NH1-OD2 2.64Å; R318-D321 PolarHBondContact O-N 3.33Å
319	F	52.7	Low	55.9	Low	149 Å²	149	128.2 Å²	128.2	65%	0.654	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-19.8	178.2	-115.3	-77.6	0	0	0	114.2	F317 Y594	F317-F319 AromaticContact CE1-CD2 3.66Å; F317-F319 HydrophobicContact CE1-CD2 3.66Å; F317-F319 AromaticContact CE1-CE2 3.87Å; F317-F319 HydrophobicContact CE1-CE2 3.87Å; F317-F319 HydrophobicContact CE1-CG 4.45Å; F317-F319 HydrophobicContact CZ-CD2 4.25Å; F317-F319 HydrophobicContact CZ-CE2 4.28Å; F319-Y594 HydrophobicContact CE2-CE1 4.41Å
320	T	60.7	Low	54.9	Low	109 Å²	109	132 Å²	132	67%	0.669	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-17.8	-175.3	54.3	0	0	0	0	114.5	R318	R318-T320 PolarHBondContact O-N 3.36Å; R318-T320 VanDerWaalsContact O-N 3.12Å
321	D	55.2	Low	53.6	Low	103 Å²	103	127 Å²	127	55%	0.551	65%	0.651	S	S	*	*			trans	-103.2	18	-167.3	-57.5	-14	0	0	0	111.6	R318 D323	R318-D321 HydrophobicContact CB-CB 4.4Å; R318-D321 WeakPolarHBondContact CD-OD2 3.35Å; R318-D321 IonicContact NH1-OD2 2.64Å; R318-D321 PolarHBondContact O-N 3.33Å; D321-D323 PolarHBondContact O-N 2.75Å
322	W	54	Low	53.2	Low	195 Å²	195	131.6 Å²	131.6	74%	0.739	67%	0.672	S	S	*	*			trans	-80.4	91.8	176.4	-172.6	39.5	0	0	0	111.3	L324	W322-L324 HydrophobicContact CH2-CD1 4.41Å; W322-L324 HydrophobicContact CZ2-CD1 3.93Å
323	D	51.3	Low	51.8	Low	61 Å²	61	132.1 Å²	132.1	33%	0.326	68%	0.676	S	S	.	*			trans	-95.9	104.6	177.7	-166.9	-17.7	0	0	0	110.5	D321 N325 K326	D321-D323 PolarHBondContact O-N 2.75Å; D323-N325 PolarHBondContact O-N 3.17Å; D323-N325 PolarHBondContact OD1-N 3.45Å; D323-K326 HydrophobicContact CB-CB 4.16Å; D323-K326 HydrophobicContact CB-CD 3.99Å; D323-K326 HydrophobicContact CB-CG 3.97Å; D323-K326 PolarHBondContact O-N 3.31Å; D323-K326 WeakPolarHBondContact OD2-CE 3.21Å; D323-K326 IonicContact OD2-NZ 2.8Å; D323-K326 PolarHBondContact OD2-NZ 2.97Å
324	L	51.6	Low	50.3	Low	130 Å²	130	133.3 Å²	133.3	68%	0.681	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-20.6	-175.8	-158.6	73.5	0	0	0	113.2	W322	W322-L324 HydrophobicContact CH2-CD1 4.41Å; W322-L324 HydrophobicContact CZ2-CD1 3.93Å
325	N	52.2	Low	48.6	Very low	145 Å²	145	135.2 Å²	135.2	78%	0.775	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	0.4	-177.9	-64	-35.1	0	0	0	114.2	D323	D323-N325 PolarHBondContact O-N 3.17Å; D323-N325 PolarHBondContact OD1-N 3.45Å
326	K	54.8	Low	46.8	Very low	148 Å²	148	134 Å²	134	64%	0.643	68%	0.679	S	S	*	*			trans	-97.7	-4.1	179.1	-76	-170.9	179.1	112.1	0	115.3	D323 S328	D323-K326 HydrophobicContact CB-CB 4.16Å; D323-K326 HydrophobicContact CB-CD 3.99Å; D323-K326 HydrophobicContact CB-CG 3.97Å; D323-K326 PolarHBondContact O-N 3.31Å; D323-K326 WeakPolarHBondContact OD2-CE 3.21Å; D323-K326 IonicContact OD2-NZ 2.8Å; D323-K326 PolarHBondContact OD2-NZ 2.97Å; K326-S328 PolarHBondContact O-N 3.45Å
327	N	40.5	Very low	45.4	Very low	136 Å²	136	136.2 Å²	136.2	73%	0.727	68%	0.675	S	S	*	*			trans	-80.8	33.6	-177.1	-76.6	6.8	0	0	0	114.4	F329	N327-F329 PolarHBondContact O-N 2.81Å
328	S	41.6	Very low	43.9	Very low	102 Å²	102	135 Å²	135	71%	0.713	68%	0.675	S	S	*	*	S	Bend	trans	-84.1	79.6	165.8	61.7	0	0	0	0	110.6	K326	K326-S328 PolarHBondContact O-N 3.45Å
329	F	33.2	Very low	42.2	Very low	184 Å²	184	131.3 Å²	131.3	81%	0.807	68%	0.681	S	S	*	*			trans	44.7	74.9	149.7	-142.6	-107.6	0	0	0	117.3	N327 S331	N327-F329 PolarHBondContact O-N 2.81Å; F329-S331 WeakPolarHBondContact CD1-OG 3.42Å; F329-S331 WeakPolarHBondContact CE1-OG 3.42Å
330	D	36.3	Very low	41.1	Very low	134 Å²	134	130.8 Å²	130.8	72%	0.717	69%	0.685	S	S	*	*			trans	-95.3	93.8	155.9	-115.7	-28.4	0	0	0	108.9	N332	D330-N332 PolarHBondContact O-N 3.2Å
331	S	39.5	Very low	39.7	Very low	79 Å²	79	131 Å²	131	55%	0.552	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	5.5	-178	-42.9	0	0	0	0	115	F329	F329-S331 WeakPolarHBondContact CD1-OG 3.42Å; F329-S331 WeakPolarHBondContact CE1-OG 3.42Å
332	N	39.5	Very low	38.6	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-0.4	-170.8	-69.9	-31.4	0	0	0	113.7	D330 Q334	D330-N332 PolarHBondContact O-N 3.2Å; N332-Q334 VanDerWaalsContact C-N 3.32Å; N332-Q334 PolarHBondContact O-N 3.2Å
333	S	35.9	Very low	37.3	Very low	103 Å²	103	129 Å²	129	72%	0.72	69%	0.694	S	S	*	*			trans	-96.7	58.7	162.1	67.7	0	0	0	0	110.6	M335	S333-M335 PolarHBondContact O-N 3.24Å
334	Q	30.7	Very low	36.3	Very low	150 Å²	150	133.7 Å²	133.7	70%	0.701	72%	0.718	S	S	*	*			trans	-60.7	104.9	165.4	-174	175.7	8.2	0	0	107.2	N332 N336	N332-Q334 VanDerWaalsContact C-N 3.32Å; N332-Q334 PolarHBondContact O-N 3.2Å; Q334-N336 PolarHBondContact O-N 2.89Å
335	M	31	Very low	35.3	Very low	151 Å²	151	132.5 Å²	132.5	74%	0.744	72%	0.72	S	S	*	*			trans	-60	111	162.8	-85.8	-169.8	165.6	0	0	106.2	S333 W337	S333-M335 PolarHBondContact O-N 3.24Å; M335-W337 VanDerWaalsContact C-N 3.26Å; M335-W337 VanDerWaalsContact CB-NE1 3.33Å; M335-W337 VanDerWaalsContact O-CD1 3.29Å; M335-W337 PolarHBondContact O-N 2.88Å; M335-W337 PolarHBondContact O-NE1 3.03Å
336	N	27.5	Very low	34.2	Very low	110 Å²	110	133 Å²	133	59%	0.588	72%	0.722	S	S	*	*			trans	-77.9	78.9	-173.3	-170.5	51.6	0	0	0	109.9	Q334 D338	Q334-N336 PolarHBondContact O-N 2.89Å; N336-D338 PolarHBondContact ND2-O 2.78Å; N336-D338 PolarHBondContact O-N 3.28Å
337	W	34.8	Very low	33.2	Very low	211 Å²	211	133.1 Å²	133.1	80%	0.799	73%	0.729	S	S	*	*			trans	-85.8	47	166.7	14.3	-93.7	0	0	0	111	M335	M335-W337 VanDerWaalsContact C-N 3.26Å; M335-W337 VanDerWaalsContact CB-NE1 3.33Å; M335-W337 VanDerWaalsContact O-CD1 3.29Å; M335-W337 PolarHBondContact O-N 2.88Å; M335-W337 PolarHBondContact O-NE1 3.03Å
338	D	32.6	Very low	32.8	Very low	115 Å²	115	132.9 Å²	132.9	62%	0.615	73%	0.728	S	S	*	*	S	Bend	trans	-142.8	141.5	170.6	-91.3	-49.2	0	0	0	110.9	N336 N340	N336-D338 PolarHBondContact ND2-O 2.78Å; N336-D338 PolarHBondContact O-N 3.28Å; D338-N340 PolarHBondContact O-N 2.97Å
339	A	29.8	Very low	32.6	Very low	93 Å²	93	135.7 Å²	135.7	77%	0.769	73%	0.73	S	S	*	*			trans	-49.7	122.3	-167.5	0	0	0	0	0	116.1
340	N	30.8	Very low	32.7	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	73%	0.726	S	S	*	*			trans	-173.6	99.3	146.8	-103.2	-36.2	0	0	0	114.2	D338	D338-N340 PolarHBondContact O-N 2.97Å
341	S	31.3	Very low	32.7	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	72%	0.724	S	S	*	*			trans	164.6	71.9	147.7	56.5	0	0	0	0	108.7
342	Q	31.1	Very low	32.6	Very low	158 Å²	158	136.4 Å²	136.4	74%	0.738	74%	0.736	S	S	*	*				71.1	132	90.7	-67.7	-69.5	-10.5	0	0	113.5
343	P	28.4	Very low	32.5	Very low	98 Å²	98	136.1 Å²	136.1	64%	0.636	73%	0.734	S	S	*	*			trans	-76	147.4	-168.5	32.1	-35.5	0	0	0	112.6	S345	P343-S345 VanDerWaalsContact C-N 3.27Å; P343-S345 PolarHBondContact O-N 2.99Å
344	I	29.7	Very low	32.6	Very low	160 Å²	160	138.8 Å²	138.8	82%	0.821	74%	0.74	S	S	*	*			trans	-79.6	78.4	174.6	-57.1	178	0	0	0	109.4	L346	I344-L346 HydrophobicContact CG2-CD1 4.39Å; I344-L346 HydrophobicContact CG2-CG 4.29Å; I344-L346 PolarHBondContact O-N 3.09Å
345	S	31.2	Very low	32.9	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	74%	0.743	S	S	*	*			trans	-80.8	91.8	170.6	-61.3	0	0	0	0	110.3	P343 L347	P343-S345 VanDerWaalsContact C-N 3.27Å; P343-S345 PolarHBondContact O-N 2.99Å; S345-L347 PolarHBondContact O-N 3.47Å; S345-L347 VanDerWaalsContact O-N 3.11Å
346	L	28	Very low	33.3	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	75%	0.749	S	S	*	*			trans	-73.2	89.7	175.2	-91.6	156.3	0	0	0	111.9	I344	I344-L346 HydrophobicContact CG2-CD1 4.39Å; I344-L346 HydrophobicContact CG2-CG 4.29Å; I344-L346 PolarHBondContact O-N 3.09Å
347	L	33.4	Very low	33.7	Very low	151 Å²	151	136 Å²	136	79%	0.791	75%	0.751	S	S	*	*			trans	-158.8	112.9	151.7	-147.4	61	0	0	0	115.7	S345	S345-L347 PolarHBondContact O-N 3.47Å; S345-L347 VanDerWaalsContact O-N 3.11Å
348	N	33.5	Very low	33.6	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	75%	0.75	S	S	*	*			trans	35.1	137.4	143.4	-64.3	-7.4	0	0	0	124.5
349	Q	36.5	Very low	33.6	Very low	160 Å²	160	130.9 Å²	130.9	75%	0.748	76%	0.756	S	S	*	*			trans	84	94.6	136.4	-78.6	174.5	-42.6	0	0	120.5
350	D	34.6	Very low	33.8	Very low	136 Å²	136	135.4 Å²	135.4	73%	0.727	76%	0.759	S	S	*	*				52.1	128.7	108.2	-63.5	-7.7	0	0	0	121.6
351	N	38	Very low	33.9	Very low	129 Å²	129	134.8 Å²	134.8	69%	0.69	76%	0.756	S	S	*	*			trans	89.6	96.1	151.4	-54.9	-45.7	0	0	0	119.3
352	N	36.1	Very low	34.2	Very low	147 Å²	147	134.6 Å²	134.6	79%	0.786	75%	0.752	S	S	*	*				62.8	151.3	116.7	-52.8	-23.9	0	0	0	122.5
353	D	37.6	Very low	34.6	Very low	145 Å²	145	136 Å²	136	78%	0.775	76%	0.756	S	S	*	*			trans	86.7	89.9	152.8	-113.6	31.1	0	0	0	118.5
354	D	38.3	Very low	34.9	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	76%	0.762	S	S	*	*				36.2	137	116.7	-61.3	2.5	0	0	0	121
355	G	37.9	Very low	35.2	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	76%	0.755	S	S	*	*			trans	117.2	77.2	170.6	0	0	0	0	0	112.6
356	D	38.7	Very low	35.4	Very low	161 Å²	161	137.9 Å²	137.9	86%	0.861	76%	0.759	S	S	*	*				77.3	132.9	70.6	-155.6	25.1	0	0	0	114.6
357	D	36.3	Very low	35.4	Very low	119 Å²	119	136.8 Å²	136.8	64%	0.636	75%	0.754	S	S	*	*			trans	67.9	117	164.6	-133.9	49.3	0	0	0	124.5
358	N	31.5	Very low	35.7	Very low	144 Å²	144	137.4 Å²	137.4	77%	0.77	76%	0.758	S	S	*	*			trans	44.9	123.1	137.9	-67.9	-32.6	0	0	0	122.8
359	G	33	Very low	35.6	Very low	73 Å²	73	136 Å²	136	75%	0.753	76%	0.759	S	S	*	*			trans	-163.4	48.1	175.2	0	0	0	0	0	118.8
360	F	35	Very low	35.5	Very low	189 Å²	189	136.3 Å²	136.3	83%	0.829	76%	0.758	S	S	*	*			trans	57.1	110.3	154.3	-103.2	-113.6	0	0	0	121
361	N	31.1	Very low	35.3	Very low	124 Å²	124	135.1 Å²	135.1	66%	0.663	76%	0.759	S	S	*	*				45.3	157.6	107.2	-57.9	-25.7	0	0	0	121.9
362	P	38.1	Very low	35.1	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	76%	0.756	S	S	*	*				-144.2	-168.2	-50	42.3	-23.3	0	0	0	113.5
363	F	39.3	Very low	34.9	Very low	186 Å²	186	134.8 Å²	134.8	82%	0.816	76%	0.757	S	S	*	*			trans	-33.9	154.9	157	-71.7	-85.4	0	0	0	116.8
364	P	35.9	Very low	34.9	Very low	117 Å²	117	135.3 Å²	135.3	76%	0.76	76%	0.758	S	S	*	*				-143.7	154.6	73.9	27.3	-3.4	0	0	0	115.8
365	V	34.7	Very low	34.6	Very low	112 Å²	112	134.8 Å²	134.8	68%	0.679	75%	0.75	S	S	*	*				62.2	114.2	70.1	-172.7	0	0	0	0	115.7
366	Q	35.3	Very low	34.5	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	75%	0.75	S	S	*	*			trans	-174	123.4	142.6	-101	158.6	-9.1	0	0	107.3
367	D	29	Very low	34.4	Very low	133 Å²	133	136.4 Å²	136.4	71%	0.711	74%	0.736	S	S	*	*				59.5	124.5	92.1	-61.7	-39.2	0	0	0	111.3
368	D	38.7	Very low	34.4	Very low	164 Å²	164	136.9 Å²	136.9	88%	0.877	74%	0.737	S	S	*	*				-142.4	160.8	60.9	-79.9	-47.7	0	0	0	116.3
369	S	32.3	Very low	34.5	Very low	102 Å²	102	136.1 Å²	136.1	71%	0.713	73%	0.733	S	S	*	*			trans	-73.3	153.6	175	60.1	0	0	0	0	114.7
370	F	34.2	Very low	34.5	Very low	166 Å²	166	139.2 Å²	139.2	73%	0.728	73%	0.732	S	S	*	*				-156.8	112.1	122.9	-149.9	-121.6	0	0	0	112.1	D372	F370-D372 HydrophobicContact CD1-CB 4.03Å; F370-D372 HydrophobicContact CE1-CB 3.73Å; F370-D372 WeakPolarHBondContact CE1-OD2 3.38Å
371	C	30.4	Very low	34.4	Very low	111 Å²	111	136.8 Å²	136.8	75%	0.75	73%	0.727	S	S	*	*			trans	-90.7	132.5	159.3	-53.8	0	0	0	0	106.8
372	D	34.3	Very low	34.6	Very low	118 Å²	118	136 Å²	136	63%	0.631	73%	0.729	S	S	*	*			trans	-127	103.3	166.2	-133.7	12.8	0	0	0	110.3	F370	F370-D372 HydrophobicContact CD1-CB 4.03Å; F370-D372 HydrophobicContact CE1-CB 3.73Å; F370-D372 WeakPolarHBondContact CE1-OD2 3.38Å
373	N	30.9	Very low	34.5	Very low	151 Å²	151	137.5 Å²	137.5	81%	0.807	74%	0.736	S	S	*	*			trans	-77.4	129.8	165	-69.7	-73.1	0	0	0	107.4
374	I	38.9	Very low	34	Very low	156 Å²	156	136.9 Å²	136.9	80%	0.8	73%	0.733	S	S	*	*			trans	-117.2	108.2	159.8	-56.1	-175.5	0	0	0	108.7
375	H	30.6	Very low	33.8	Very low	147 Å²	147	138.7 Å²	138.7	68%	0.681	73%	0.732	S	S	*	*			trans	-63.5	156.6	171.1	-173.1	68.8	0	0	0	110.9	D377	H375-D377 IonicContact NE2-OD1 3.81Å
376	E	36.3	Very low	33.8	Very low	164 Å²	164	140 Å²	140	77%	0.766	74%	0.74	S	S	*	*				167.4	116.3	122.1	-88.7	173.8	-167.3	0	0	112.2
377	D	36.4	Very low	33.5	Very low	105 Å²	105	135 Å²	135	56%	0.561	74%	0.735	S	S	*	*				94.6	104.1	120.7	-70.2	9.1	0	0	0	125.6	H375	H375-D377 IonicContact NE2-OD1 3.81Å
378	I	36.2	Very low	33.7	Very low	129 Å²	129	135.7 Å²	135.7	66%	0.662	74%	0.744	S	S	*	*				113.8	130.8	107.4	-78.7	172.7	0	0	0	120.5
379	N	33.1	Very low	33.3	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	74%	0.739	S	S	*	*			trans	73.8	111.7	165	-68.5	-18.7	0	0	0	119.3
380	L	33	Very low	33.4	Very low	138 Å²	138	137.7 Å²	137.7	72%	0.723	75%	0.746	S	S	*	*				69.6	131.4	70.2	-80.6	90.9	0	0	0	111.9
381	D	34.6	Very low	33.2	Very low	137 Å²	137	137 Å²	137	73%	0.733	75%	0.745	S	S	*	*			cis	-141	155.4	27.6	-75.4	-60.8	0	0	0	115
382	P	34	Very low	33.5	Very low	107 Å²	107	137.1 Å²	137.1	70%	0.695	74%	0.742	S	S	*	*			trans	-104.1	150.1	159.9	37.6	-29	0	0	0	112.7
383	V	37.2	Very low	33.4	Very low	142 Å²	142	138.6 Å²	138.6	86%	0.861	75%	0.75	S	S	*	*			trans	-131.5	115.2	176	-177.4	0	0	0	0	112.2
384	F	28.4	Very low	33.5	Very low	174 Å²	174	134.9 Å²	134.9	76%	0.763	75%	0.747	S	S	*	*			trans	-56.4	175.1	162.9	-81.3	-117	0	0	0	111.9
385	E	32	Very low	33.3	Very low	155 Å²	155	133.3 Å²	133.3	72%	0.724	75%	0.75	S	S	*	*			cis	-161.4	178.9	11.1	-151.9	160	-164.5	0	0	110.1
386	T	34.5	Very low	33.4	Very low	138 Å²	138	131.1 Å²	131.1	85%	0.847	75%	0.751	S	S	*	*			trans	72	134.5	169.1	74.9	0	0	0	0	116.4
387	G	29.7	Very low	33.1	Very low	69 Å²	69	126.5 Å²	126.5	71%	0.711	74%	0.741	S	S	*	*			cis	147	121.2	-7.4	0	0	0	0	0	111.9
388	V	32.9	Very low	32.7	Very low	149 Å²	149	130.4 Å²	130.4	90%	0.903	76%	0.756	S	S	*	*			trans	165.6	135	144.9	153.9	0	0	0	0	108.3
389	Q	29.7	Very low	32.4	Very low	165 Å²	165	128.4 Å²	128.4	77%	0.771	76%	0.759	S	S	*	*			trans	-87.8	164.1	-175.2	-54.8	170.6	-8.3	0	0	111.5
390	V	34.3	Very low	32.3	Very low	142 Å²	142	128.4 Å²	128.4	86%	0.861	76%	0.763	S	S	*	*				-153.4	144.9	116.1	164.7	0	0	0	0	108.5
391	E	29.6	Very low	32.2	Very low	152 Å²	152	127.9 Å²	127.9	71%	0.71	76%	0.761	S	S	*	*			trans	-71	-178.6	-178.4	-54.6	167.4	130.7	0	0	111.6
392	V	38.1	Very low	31.9	Very low	114 Å²	114	127.3 Å²	127.3	69%	0.691	76%	0.758	S	S	*	*				-164.9	116.5	57.8	175.1	0	0	0	0	111.6
393	N	31.1	Very low	31.7	Very low	149 Å²	149	128.7 Å²	128.7	80%	0.797	76%	0.76	S	S	*	*			trans	49.1	138	138.2	-49.7	-16.2	0	0	0	124.7
394	G	34.1	Very low	31.5	Very low	72 Å²	72	128.7 Å²	128.7	74%	0.742	75%	0.753	S	S	*	*			trans	135.1	69	151.6	0	0	0	0	0	115.4
395	S	33.6	Very low	31.5	Very low	123 Å²	123	131.3 Å²	131.3	86%	0.86	76%	0.758	S	S	*	*				68.9	132.2	79.4	-169.7	0	0	0	0	114.2
396	S	32.3	Very low	31.5	Very low	102 Å²	102	127.8 Å²	127.8	71%	0.713	75%	0.751	S	S	*	*			cis	-170.4	153.6	-13.7	-175.6	0	0	0	0	110.2
397	A	30.2	Very low	31.4	Very low	67 Å²	67	128.9 Å²	128.9	55%	0.554	75%	0.751	S	S	*	*			trans	30.1	124.7	143.2	0	0	0	0	0	121.1
398	E	29.1	Very low	31.5	Very low	186 Å²	186	133.1 Å²	133.1	87%	0.869	76%	0.758	S	S	*	*				87.2	112.8	103.8	-74.2	170.2	-167	0	0	113.7
399	A	28.4	Very low	31.7	Very low	88 Å²	88	134.6 Å²	134.6	73%	0.727	76%	0.76	S	S	*	*				100.3	167.2	69.2	0	0	0	0	0	111.7
400	V	31.9	Very low	31.8	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	76%	0.761	S	S	*	*			trans	89.4	104.5	168.5	-171.3	0	0	0	0	118.2
401	N	30.5	Very low	31.8	Very low	127 Å²	127	130.6 Å²	130.6	68%	0.679	75%	0.748	S	S	*	*			trans	74.7	115.9	141.6	-78.9	-7.4	0	0	0	123.7
402	N	29.1	Very low	32	Very low	124 Å²	124	130 Å²	130	66%	0.663	75%	0.749	S	S	*	*				72.4	114.3	115.6	-60.1	-11.7	0	0	0	120.7
403	N	29.2	Very low	31.9	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	75%	0.753	S	S	*	*				92.7	143.9	120.8	-92.6	-13.9	0	0	0	120.5
404	I	33.1	Very low	32	Very low	142 Å²	142	129.8 Å²	129.8	73%	0.728	75%	0.748	S	S	*	*			trans	78.1	87.1	155.6	-60.2	150.4	0	0	0	116
405	R	27.3	Very low	31.9	Very low	229 Å²	229	132 Å²	132	86%	0.864	75%	0.747	S	S	*	*				61.1	144.2	106.9	-150.2	-176	-170.1	161.4	2.5	119.4
406	S	32.4	Very low	32	Very low	81 Å²	81	132.2 Å²	132.2	57%	0.566	74%	0.744	S	S	*	*			trans	78	108.4	150.6	24.5	0	0	0	0	119.9
407	D	33.4	Very low	32.1	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	74%	0.744	S	S	*	*				111.4	129.6	118.5	-61.3	-10.1	0	0	0	120.7
408	N	32	Very low	32.2	Very low	159 Å²	159	137.2 Å²	137.2	85%	0.85	75%	0.748	S	S	*	*			trans	-69.4	149	177.2	-64.9	-54.9	0	0	0	112.2
409	L	37.1	Very low	32.3	Very low	180 Å²	180	134.2 Å²	134.2	94%	0.942	74%	0.743	S	S	*	*			trans	-148.2	153.1	151.5	-116.7	163.8	0	0	0	112.4
410	L	31.2	Very low	32.4	Very low	154 Å²	154	136.4 Å²	136.4	81%	0.806	75%	0.747	S	S	*	*			trans	-98.5	153.6	-151.1	-135.8	82.3	0	0	0	114.7
411	A	33.4	Very low	32.4	Very low	69 Å²	69	134.3 Å²	134.3	57%	0.57	74%	0.744	S	S	*	*			trans	63.3	136.3	139.1	0	0	0	0	0	122.1
412	N	34.9	Very low	32.4	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	75%	0.753	S	S	*	*				176.7	127	105.1	-90.1	-32.7	0	0	0	116.3
413	I	36.6	Very low	32.4	Very low	150 Å²	150	135.7 Å²	135.7	77%	0.769	76%	0.756	S	S	*	*				82.4	144.9	128.7	-67.4	172.2	0	0	0	117.8
414	P	33.4	Very low	32.5	Very low	109 Å²	109	135.7 Å²	135.7	71%	0.708	76%	0.761	S	S	*	*				-142.1	178.9	-106.9	41.3	-19.3	0	0	0	119.5
415	V	30.4	Very low	32.4	Very low	118 Å²	118	135.6 Å²	135.6	72%	0.715	76%	0.762	S	S	*	*			trans	32.4	125	145.3	-179.5	0	0	0	0	123.1
416	T	35.7	Very low	32.5	Very low	129 Å²	129	131 Å²	131	79%	0.791	76%	0.76	S	S	*	*			trans	-156	113	130.4	44.4	0	0	0	0	107.9
417	E	35	Very low	32.5	Very low	154 Å²	154	133 Å²	133	72%	0.72	77%	0.769	S	S	*	*				55.5	129.1	89.9	-73.1	-162.3	-141	0	0	114.6
418	N	32.8	Very low	32.4	Very low	120 Å²	120	131.7 Å²	131.7	64%	0.642	77%	0.767	S	S	*	*			cis	-156.1	134.6	6.2	-91.8	-37.5	0	0	0	109.7
419	T	31.1	Very low	32.4	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	76%	0.764	S	S	*	*				68.4	121.4	95.6	-49.7	0	0	0	0	113.4
420	T	30.7	Very low	32.7	Very low	133 Å²	133	127.4 Å²	127.4	82%	0.816	75%	0.754	S	S	*	*			cis	-134	139.2	29.7	49.9	0	0	0	0	114.3
421	A	30.6	Very low	33.5	Very low	85 Å²	85	122.7 Å²	122.7	70%	0.702	74%	0.737	S	S	*	*			trans	-132.1	127.6	167.1	0	0	0	0	0	111.1	N423	A421-N423 PolarHBondContact O-N 3.23Å; A421-N423 VanDerWaalsContact O-N 3.09Å
422	T	30.9	Very low	34.1	Very low	143 Å²	143	125.9 Å²	125.9	88%	0.877	75%	0.745	S	S	*	*			trans	-83.4	76.4	178.1	48.7	0	0	0	0	111.3
423	N	30	Very low	34.8	Very low	136 Å²	136	121.7 Å²	121.7	73%	0.727	73%	0.734	S	S	*	*			trans	-82.1	115.4	166.4	-80.6	-11.8	0	0	0	109.8	A421 N425	A421-N423 PolarHBondContact O-N 3.23Å; A421-N423 VanDerWaalsContact O-N 3.09Å; N423-N425 PolarHBondContact O-N 3.46Å
424	T	31.1	Very low	35.7	Very low	138 Å²	138	120.6 Å²	120.6	85%	0.847	73%	0.726	S	S	*	*			trans	-83.5	97.8	169.8	39.3	0	0	0	0	109.8	T426	T424-T426 PolarHBondContact O-N 3.42Å; T424-T426 VanDerWaalsContact O-N 3.17Å
425	N	31.6	Very low	37.2	Very low	139 Å²	139	121.2 Å²	121.2	74%	0.743	72%	0.723	S	S	*	*			trans	-58.7	116.5	-174.4	-73.2	-22.2	0	0	0	113.3	N423 T427	N423-N425 PolarHBondContact O-N 3.46Å; N425-T427 PolarHBondContact O-N 3.02Å
426	T	28.5	Very low	38.7	Very low	132 Å²	132	121.7 Å²	121.7	81%	0.81	72%	0.715	S	S	*	*			trans	-69.6	104.6	159.9	48.4	0	0	0	0	109.4	T424 T428	T424-T426 PolarHBondContact O-N 3.42Å; T424-T426 VanDerWaalsContact O-N 3.17Å; T426-T428 PolarHBondContact O-N 2.88Å
427	T	33	Very low	40	Very low	124 Å²	124	118.4 Å²	118.4	76%	0.761	70%	0.695	S	S	*	*			trans	-73.4	114.9	179	49.3	0	0	0	0	111.5	N425	N425-T427 PolarHBondContact O-N 3.02Å
428	T	30.3	Very low	41.5	Very low	133 Å²	133	114.3 Å²	114.3	82%	0.816	68%	0.683	S	S	*	*			trans	-62	121.6	176.1	47.7	0	0	0	0	112.8	T426	T426-T428 PolarHBondContact O-N 2.88Å
429	T	32.5	Very low	43.2	Very low	128 Å²	128	112.8 Å²	112.8	79%	0.785	68%	0.681	S	S	*	*			trans	-152.7	61.1	171.5	34.5	0	0	0	0	110.6
430	T	43.7	Very low	44.5	Very low	120 Å²	120	110 Å²	110	74%	0.736	66%	0.661	S	S	*	*			trans	-158.9	89.5	177.9	8.7	0	0	0	0	110.2
431	A	48.1	Very low	46	Very low	55 Å²	55	109.1 Å²	109.1	46%	0.455	65%	0.646	S	S	.	*	S	Bend	trans	-152	-50.4	169.4	0	0	0	0	0	110.6	G433 E434 L435	A431-G433 VanDerWaalsContact C-N 3.33Å; A431-G433 PolarHBondContact O-N 2.84Å; A431-E434 PolarHBondContact O-N 3.31Å; A431-E434 VanDerWaalsContact O-N 3.15Å; A431-L435 PolarHBondContact O-N 2.95Å; A431-L435 VanDerWaalsContact O-N 3.1Å
432	D	45.7	Very low	47.6	Very low	136 Å²	136	110 Å²	110	73%	0.727	64%	0.639	S	S	*	*	H	α-helix	trans	-63.7	-34.4	-174.3	-52.8	-18.5	0	0	0	113.6	F436	D432-F436 PolarHBondContact O-N 3.1Å
433	G	49.4	Very low	49.2	Very low	50 Å²	50	108.6 Å²	108.6	52%	0.515	62%	0.624	S	S	.	*	H	α-helix	trans	-69.7	-34.5	176.8	0	0	0	0	0	113.4	A431 V437	A431-G433 VanDerWaalsContact C-N 3.33Å; A431-G433 PolarHBondContact O-N 2.84Å; G433-V437 WeakPolarHBondContact O-CG2 3.45Å; G433-V437 PolarHBondContact O-N 2.99Å; G433-V437 VanDerWaalsContact O-N 3.11Å
434	E	56	Low	50.5	Low	128 Å²	128	106.6 Å²	106.6	60%	0.598	61%	0.613	S	S	*	*	H	α-helix	trans	-75	-36.6	178.4	-65.2	178.1	-172.7	0	0	110.8	A431 S438	A431-E434 PolarHBondContact O-N 3.31Å; A431-E434 VanDerWaalsContact O-N 3.15Å; E434-S438 VanDerWaalsContact O-CB 3.24Å; E434-S438 WeakPolarHBondContact O-CB 3.06Å; E434-S438 PolarHBondContact O-N 2.79Å; E434-S438 PolarHBondContact O-OG 3.43Å
435	L	64.8	Low	51.6	Low	122 Å²	122	104.3 Å²	104.3	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-60.5	-46.9	169.1	-90.8	162.3	0	0	0	112.1	A431 S438 C439	A431-L435 PolarHBondContact O-N 2.95Å; A431-L435 VanDerWaalsContact O-N 3.1Å; L435-S438 PolarHBondContact O-N 3.46Å; L435-C439 VanDerWaalsContact O-CB 3.32Å; L435-C439 WeakPolarHBondContact O-CB 3.45Å; L435-C439 PolarHBondContact O-N 3.08Å
436	F	61.3	Low	52.8	Low	127 Å²	127	106.1 Å²	106.1	56%	0.557	60%	0.597	S	S	*	*	H	α-helix	trans	-60.9	-49.3	178.7	178.8	-105.7	0	0	0	112.3	D432 S438 C439 L440	D432-F436 PolarHBondContact O-N 3.1Å; F436-S438 VanDerWaalsContact C-N 3.32Å; F436-S438 PolarHBondContact O-N 3.21Å; F436-C439 PolarHBondContact O-N 3.33Å; F436-L440 HydrophobicContact CD1-CD1 4.29Å; F436-L440 HydrophobicContact CE1-CD1 3.54Å; F436-L440 HydrophobicContact CE2-CD1 4.24Å; F436-L440 HydrophobicContact CZ-CD1 3.51Å; F436-L440 PolarHBondContact O-N 3.02Å
437	V	64	Low	53.8	Low	60 Å²	60	106.6 Å²	106.6	36%	0.364	59%	0.589	S	S	.	*	H	α-helix	trans	-62.8	-39.2	177.9	173.5	0	0	0	0	111.3	G433 L440 K441 L459	G433-V437 WeakPolarHBondContact O-CG2 3.45Å; G433-V437 PolarHBondContact O-N 2.99Å; G433-V437 VanDerWaalsContact O-N 3.11Å; V437-L440 PolarHBondContact O-N 3Å; V437-K441 VanDerWaalsContact O-CB 3.29Å; V437-K441 WeakPolarHBondContact O-CB 3.02Å; V437-K441 PolarHBondContact O-N 2.91Å; V437-L459 HydrophobicContact CG1-CD2 4.43Å
438	S	65.5	Low	54.3	Low	68 Å²	68	107.8 Å²	107.8	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-67.3	-35.9	176.3	-58.3	0	0	0	0	112.7	E434 L435 F436 N442	E434-S438 VanDerWaalsContact O-CB 3.24Å; E434-S438 WeakPolarHBondContact O-CB 3.06Å; E434-S438 PolarHBondContact O-N 2.79Å; E434-S438 PolarHBondContact O-OG 3.43Å; L435-S438 PolarHBondContact O-N 3.46Å; F436-S438 VanDerWaalsContact C-N 3.32Å; F436-S438 PolarHBondContact O-N 3.21Å; S438-N442 WeakPolarHBondContact O-CB 3.38Å; S438-N442 PolarHBondContact O-N 2.71Å
439	C	67.9	Low	55	Low	88 Å²	88	109.9 Å²	109.9	60%	0.595	58%	0.582	S	S	*	*	H	α-helix	trans	-71.2	-42	177	-154.4	0	0	0	0	111.5	L435 F436 N442 M443	L435-C439 VanDerWaalsContact O-CB 3.32Å; L435-C439 WeakPolarHBondContact O-CB 3.45Å; L435-C439 PolarHBondContact O-N 3.08Å; F436-C439 PolarHBondContact O-N 3.33Å; C439-N442 PolarHBondContact O-N 3.11Å; C439-M443 WeakPolarHBondContact O-CB 3.49Å; C439-M443 PolarHBondContact O-N 3.4Å
440	L	59.5	Low	55.7	Low	66 Å²	66	112.5 Å²	112.5	35%	0.346	58%	0.584	S	S	.	*	H	α-helix	trans	-62.1	-41.9	172.7	-116.4	165.2	0	0	0	111.7	F436 V437 M443 L444	F436-L440 HydrophobicContact CD1-CD1 4.29Å; F436-L440 HydrophobicContact CE1-CD1 3.54Å; F436-L440 HydrophobicContact CE2-CD1 4.24Å; F436-L440 HydrophobicContact CZ-CD1 3.51Å; F436-L440 PolarHBondContact O-N 3.02Å; V437-L440 PolarHBondContact O-N 3Å; L440-M443 HydrophobicContact CD2-CE 3.88Å; L440-M443 HydrophobicContact CG-CE 4.49Å; L440-M443 PolarHBondContact O-N 2.88Å; L440-L444 HydrophobicContact CD2-CD1 3.56Å; L440-L444 WeakPolarHBondContact O-CD1 3.48Å; L440-L444 PolarHBondContact O-N 2.9Å
441	K	61.7	Low	55.6	Low	114 Å²	114	113.1 Å²	113.1	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-60.8	-50.1	174.8	-175.9	173.1	-180	173.1	0	111.7	V437 M443 L444 D445	V437-K441 VanDerWaalsContact O-CB 3.29Å; V437-K441 WeakPolarHBondContact O-CB 3.02Å; V437-K441 PolarHBondContact O-N 2.91Å; K441-M443 PolarHBondContact O-N 3.33Å; K441-L444 PolarHBondContact O-N 2.83Å; K441-D445 WeakPolarHBondContact O-CB 3.37Å; K441-D445 PolarHBondContact O-N 2.97Å
442	N	65.3	Low	54.9	Low	103 Å²	103	113.8 Å²	113.8	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-61.6	-26.9	174.6	-88.9	-25.1	0	0	0	113.7	S438 C439 K446	S438-N442 WeakPolarHBondContact O-CB 3.38Å; S438-N442 PolarHBondContact O-N 2.71Å; C439-N442 PolarHBondContact O-N 3.11Å; N442-K446 VanDerWaalsContact O-CG 3.3Å; N442-K446 WeakPolarHBondContact O-CG 3.44Å
443	M	62.9	Low	55.3	Low	114 Å²	114	117.6 Å²	117.6	56%	0.562	60%	0.6	S	S	*	*	H	α-helix	trans	-77.6	-42.1	176.7	-170.4	173.1	70.1	0	0	111.7	C439 L440 K441 Q447	C439-M443 WeakPolarHBondContact O-CB 3.49Å; C439-M443 PolarHBondContact O-N 3.4Å; L440-M443 HydrophobicContact CD2-CE 3.88Å; L440-M443 HydrophobicContact CG-CE 4.49Å; L440-M443 PolarHBondContact O-N 2.88Å; K441-M443 PolarHBondContact O-N 3.33Å; M443-Q447 WeakPolarHBondContact O-CG 3.38Å
444	L	57.8	Low	54.6	Low	93 Å²	93	120.7 Å²	120.7	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-71.4	-41.9	175.7	-91.3	77.2	0	0	0	112.5	L440 K441 K446 Q447 Y448	L440-L444 HydrophobicContact CD2-CD1 3.56Å; L440-L444 WeakPolarHBondContact O-CD1 3.48Å; L440-L444 PolarHBondContact O-N 2.9Å; K441-L444 PolarHBondContact O-N 2.83Å; L444-K446 PolarHBondContact O-N 3.27Å; L444-Q447 PolarHBondContact O-N 3.12Å; L444-Q447 VanDerWaalsContact O-N 3.08Å; L444-Y448 PolarHBondContact O-N 3.39Å; L444-Y448 VanDerWaalsContact O-N 3.13Å
445	D	54.2	Low	54.3	Low	90 Å²	90	117.7 Å²	117.7	48%	0.481	59%	0.592	S	S	.	*	H	α-helix	trans	-59.1	-28.9	177.6	-82.8	-23.5	0	0	0	111.9	K441	K441-D445 WeakPolarHBondContact O-CB 3.37Å; K441-D445 PolarHBondContact O-N 2.97Å
446	K	56	Low	53.5	Low	178 Å²	178	119.1 Å²	119.1	77%	0.774	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-16	177.5	-78.2	-178.4	177.8	-174.8	0	115.3	N442 L444	N442-K446 VanDerWaalsContact O-CG 3.3Å; N442-K446 WeakPolarHBondContact O-CG 3.44Å; L444-K446 PolarHBondContact O-N 3.27Å
447	Q	50.3	Low	52.9	Low	141 Å²	141	121.6 Å²	121.6	66%	0.659	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-25.3	-174.9	-71.1	-99.8	-58.2	0	0	112.4	M443 L444	M443-Q447 WeakPolarHBondContact O-CG 3.38Å; L444-Q447 PolarHBondContact O-N 3.12Å; L444-Q447 VanDerWaalsContact O-N 3.08Å
448	Y	42.6	Very low	52.2	Low	149 Å²	149	122.4 Å²	122.4	58%	0.584	61%	0.609	S	S	*	*			trans	-143.7	76.4	-173.4	-62.1	-78.3	0	0	0	113.2	L444 H450 F451	L444-Y448 PolarHBondContact O-N 3.39Å; L444-Y448 VanDerWaalsContact O-N 3.13Å; Y448-H450 PolarHBondContact O-N 3.07Å; Y448-F451 PolarHBondContact O-N 3.12Å
449	E	45.5	Very low	51.4	Low	178 Å²	178	123.4 Å²	123.4	83%	0.832	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-9.5	-179.7	-65.2	-167.1	145.8	0	0	115.4
450	H	48	Very low	50.7	Low	182 Å²	182	121.9 Å²	121.9	84%	0.843	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-3.6	-177.4	-70.3	-59.3	0	0	0	115.9	Y448	Y448-H450 PolarHBondContact O-N 3.07Å
451	F	40.7	Very low	50.2	Low	133 Å²	133	123 Å²	123	58%	0.583	61%	0.612	S	S	*	*			trans	-100.3	10.3	-173.6	-91.2	-80.4	0	0	0	116.7	Y448 K453 L454	Y448-F451 PolarHBondContact O-N 3.12Å; F451-K453 PolarHBondContact O-N 2.76Å; F451-L454 HydrophobicContact CD1-CB 4.3Å; F451-L454 HydrophobicContact CD1-CD1 3.83Å; F451-L454 HydrophobicContact CE1-CD1 3.78Å; F451-L454 PolarHBondContact O-N 3.42Å; F451-L454 VanDerWaalsContact O-N 3.14Å
452	G	35.1	Very low	49.2	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	20.8	-168.5	0	0	0	0	0	119.9
453	K	52.1	Low	48.2	Very low	215 Å²	215	124.3 Å²	124.3	94%	0.935	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.1	4.4	171	-68.2	-170.2	179.8	173.8	0	115.1	F451	F451-K453 PolarHBondContact O-N 2.76Å
454	L	35.6	Very low	47.8	Very low	116 Å²	116	120.3 Å²	120.3	61%	0.607	61%	0.608	S	S	*	*	S	Bend	trans	-98.9	135.8	176.1	-98.2	158.1	0	0	0	110.9	F451	F451-L454 HydrophobicContact CD1-CB 4.3Å; F451-L454 HydrophobicContact CD1-CD1 3.83Å; F451-L454 HydrophobicContact CE1-CD1 3.78Å; F451-L454 PolarHBondContact O-N 3.42Å; F451-L454 VanDerWaalsContact O-N 3.14Å
455	N	49.7	Very low	47.5	Very low	65 Å²	65	120.3 Å²	120.3	35%	0.348	61%	0.614	S	S	.	*			trans	86.5	24.4	156.3	-64	-12.8	0	0	0	122	Y457 L458 L459	N455-Y457 PolarHBondContact O-N 3.37Å; N455-L458 HydrophobicContact CB-CB 3.56Å; N455-L458 WeakPolarHBondContact ND2-CD2 3.44Å; N455-L458 PolarHBondContact O-N 2.71Å; N455-L458 VanDerWaalsContact O-N 3.16Å; N455-L458 WeakPolarHBondContact OD1-CB 3.39Å; N455-L459 WeakPolarHBondContact O-CB 3.34Å; N455-L459 PolarHBondContact O-N 3.3Å
456	D	49	Very low	47.2	Very low	151 Å²	151	121.3 Å²	121.3	81%	0.807	62%	0.615	S	S	*	*	H	α-helix	trans	-55.7	-37.2	156.8	-108.4	11.7	0	0	0	111.2	G460	D456-G460 PolarHBondContact O-N 2.84Å; D456-G460 VanDerWaalsContact O-N 3.12Å
457	Y	46.9	Very low	47.4	Very low	179 Å²	179	117.3 Å²	117.3	70%	0.702	60%	0.599	S	S	*	*	H	α-helix	trans	-68.7	-40.3	173.6	177	-104.1	0	0	0	113.3	N455 M461	N455-Y457 PolarHBondContact O-N 3.37Å; Y457-M461 HydrophobicContact CD1-SD 4.19Å; Y457-M461 HydrophobicContact CE1-SD 3.64Å; Y457-M461 HydrophobicContact CE2-SD 4.49Å; Y457-M461 WeakPolarHBondContact O-CG 3.44Å; Y457-M461 PolarHBondContact O-N 3.31Å
458	L	50.3	Low	47.1	Very low	78 Å²	78	118.8 Å²	118.8	41%	0.408	60%	0.599	S	S	.	*	H	α-helix	trans	-81.6	-34.9	-175.9	-144.2	81.3	0	0	0	112.4	N455 G460 M461	N455-L458 HydrophobicContact CB-CB 3.56Å; N455-L458 WeakPolarHBondContact ND2-CD2 3.44Å; N455-L458 PolarHBondContact O-N 2.71Å; N455-L458 VanDerWaalsContact O-N 3.16Å; N455-L458 WeakPolarHBondContact OD1-CB 3.39Å; L458-G460 VanDerWaalsContact C-N 3.33Å; L458-M461 HydrophobicContact CD1-SD 4.43Å; L458-M461 PolarHBondContact O-N 2.87Å
459	L	49.2	Very low	47	Very low	89 Å²	89	117.3 Å²	117.3	47%	0.466	59%	0.592	S	S	.	*	H	α-helix	trans	-65.8	-37.3	168.4	-105.3	63.7	0	0	0	110.9	V437 N455 M461 W462	V437-L459 HydrophobicContact CG1-CD2 4.43Å; N455-L459 WeakPolarHBondContact O-CB 3.34Å; N455-L459 PolarHBondContact O-N 3.3Å; L459-M461 PolarHBondContact O-N 2.94Å; L459-W462 CarbonylContact O-C 3.58Å; L459-W462 PolarHBondContact O-N 3.18Å
460	G	51.4	Low	46.8	Very low	55 Å²	55	118.7 Å²	118.7	57%	0.567	60%	0.595	S	S	*	*	H	α-helix	trans	-59.8	-22.8	172.9	0	0	0	0	0	114.2	D456 L458	D456-G460 PolarHBondContact O-N 2.84Å; D456-G460 VanDerWaalsContact O-N 3.12Å; L458-G460 VanDerWaalsContact C-N 3.33Å
461	M	50.3	Low	46.3	Very low	89 Å²	89	118.3 Å²	118.3	44%	0.438	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.1	-1.9	173.8	-66.9	173.2	67.9	0	0	113.8	Y457 L458 L459 H467	Y457-M461 HydrophobicContact CD1-SD 4.19Å; Y457-M461 HydrophobicContact CE1-SD 3.64Å; Y457-M461 HydrophobicContact CE2-SD 4.49Å; Y457-M461 WeakPolarHBondContact O-CG 3.44Å; Y457-M461 PolarHBondContact O-N 3.31Å; L458-M461 HydrophobicContact CD1-SD 4.43Å; L458-M461 PolarHBondContact O-N 2.87Å; L459-M461 PolarHBondContact O-N 2.94Å; M461-H467 PolarHBondContact O-CD2 3.16Å; M461-H467 PolarHBondContact O-NE2 3.29Å
462	W	40.8	Very low	46.1	Very low	182 Å²	182	116.3 Å²	116.3	69%	0.689	60%	0.599	S	S	*	*			trans	-130.5	52.4	-176.1	-77.8	86.8	0	0	0	112.4	L459 G464 W468	L459-W462 CarbonylContact O-C 3.58Å; L459-W462 PolarHBondContact O-N 3.18Å; W462-G464 PolarHBondContact O-N 3.24Å; W462-W468 HydrophobicContact CZ3-CZ2 4.19Å
463	A	44.6	Very low	46	Very low	64 Å²	64	122.9 Å²	122.9	53%	0.529	61%	0.608	S	S	.	*			trans	-74.7	39.1	177.4	0	0	0	0	0	114.7	H467	A463-H467 HydrophobicContact CB-CB 4.27Å
464	G	54.5	Low	45	Very low	29 Å²	29	123.5 Å²	123.5	30%	0.299	61%	0.605	S	S	.	*			trans	68.6	-177	178.9	0	0	0	0	0	115.5	W462 E466 H467	W462-G464 PolarHBondContact O-N 3.24Å; G464-E466 PolarHBondContact O-N 3.36Å; G464-E466 VanDerWaalsContact O-N 3.12Å; G464-H467 WeakPolarHBondContact O-CB 3.31Å; G464-H467 PolarHBondContact O-N 3.12Å
465	P	49.9	Very low	44.8	Very low	94 Å²	94	123.9 Å²	123.9	61%	0.61	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-61.2	-24.2	-173.8	-25.1	35.1	0	0	0	114.9	H467 W468	P465-H467 VanDerWaalsContact C-N 3.26Å; P465-H467 PolarHBondContact O-N 2.82Å; P465-W468 PolarHBondContact O-N 2.87Å
466	E	49.3	Very low	43.9	Very low	110 Å²	110	129.6 Å²	129.6	51%	0.514	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-67.1	-24.6	175.9	-76.6	-69.7	113.6	0	0	112.8	G464 W468 R469	G464-E466 PolarHBondContact O-N 3.36Å; G464-E466 VanDerWaalsContact O-N 3.12Å; E466-W468 PolarHBondContact O-N 3.17Å; E466-R469 PolarHBondContact O-N 3.3Å; E466-R469 VanDerWaalsContact O-N 3.09Å; E466-R469 WeakPolarHBondContact OE1-CD 3.45Å
467	H	58.9	Low	43.1	Very low	94 Å²	94	130.4 Å²	130.4	44%	0.435	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-55.4	-36.8	176.4	179.2	4.6	0	0	0	112	M461 A463 G464 P465 R469	M461-H467 PolarHBondContact O-CD2 3.16Å; M461-H467 PolarHBondContact O-NE2 3.29Å; A463-H467 HydrophobicContact CB-CB 4.27Å; G464-H467 WeakPolarHBondContact O-CB 3.31Å; G464-H467 PolarHBondContact O-N 3.12Å; P465-H467 VanDerWaalsContact C-N 3.26Å; P465-H467 PolarHBondContact O-N 2.82Å; H467-R469 VanDerWaalsContact C-N 3.32Å; H467-R469 PolarHBondContact O-N 2.91Å
468	W	45	Very low	42.4	Very low	173 Å²	173	128.5 Å²	128.5	66%	0.655	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-82.9	-5.2	-176.8	-54.8	-27.8	0	0	0	113.5	W462 P465 E466 K470	W462-W468 HydrophobicContact CZ3-CZ2 4.19Å; P465-W468 PolarHBondContact O-N 2.87Å; E466-W468 PolarHBondContact O-N 3.17Å; W468-K470 PolarHBondContact O-N 3.3Å
469	R	40.5	Very low	41.6	Very low	117 Å²	117	128.3 Å²	128.3	44%	0.442	66%	0.658	S	S	.	*	S	Bend	trans	-77.4	112.6	172.6	-64	-172.5	78.6	111.4	4.3	109.8	E466 H467 K471 D588	E466-R469 PolarHBondContact O-N 3.3Å; E466-R469 VanDerWaalsContact O-N 3.09Å; E466-R469 WeakPolarHBondContact OE1-CD 3.45Å; H467-R469 VanDerWaalsContact C-N 3.32Å; H467-R469 PolarHBondContact O-N 2.91Å; R469-K471 PolarHBondContact O-N 3.35Å; R469-D588 IonicContact CZ-OD1 2.67Å; R469-D588 IonicContact NH1-OD1 3.94Å; R469-D588 PolarHBondContact NH1-OD1 2.79Å; R469-D588 IonicContact NH2-OD1 3.29Å; R469-D588 PolarHBondContact NH2-OD1 3.19Å
470	K	41.2	Very low	40.6	Very low	208 Å²	208	128.9 Å²	128.9	90%	0.904	68%	0.675	S	S	*	*			trans	-56.1	103	171.1	-71.3	-178.1	179.1	176.6	0	110.1	W468 A472	W468-K470 PolarHBondContact O-N 3.3Å; K470-A472 PolarHBondContact O-N 3.03Å
471	K	37.6	Very low	39.7	Very low	173 Å²	173	133.3 Å²	133.3	75%	0.752	69%	0.691	S	S	*	*			trans	-64.8	103.3	172.1	-62.2	-77.6	-177.1	-177.4	0	108.4	R469 K473	R469-K471 PolarHBondContact O-N 3.35Å; K471-K473 PolarHBondContact O-N 2.66Å
472	A	36.1	Very low	38.7	Very low	91 Å²	91	137 Å²	137	75%	0.752	71%	0.705	S	S	*	*			trans	-62.3	119.9	172.2	0	0	0	0	0	109.2	K470 R474	K470-A472 PolarHBondContact O-N 3.03Å; A472-R474 PolarHBondContact O-N 3.01Å
473	K	33.7	Very low	38.3	Very low	208 Å²	208	136.7 Å²	136.7	90%	0.904	72%	0.716	S	S	*	*			trans	-62	110.6	170.6	-77.7	-174.5	174.6	-176.5	0	108.2	K471	K471-K473 PolarHBondContact O-N 2.66Å
474	R	29.7	Very low	37.6	Very low	229 Å²	229	139.6 Å²	139.6	86%	0.864	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-63.7	139.8	164.2	-62.8	-174.9	-176.1	-175.3	2.3	107.9	A472 K476	A472-R474 PolarHBondContact O-N 3.01Å; R474-K476 PolarHBondContact O-N 2.94Å
475	P	31.9	Very low	36.7	Very low	124 Å²	124	147 Å²	147	81%	0.805	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55.9	136.9	164.6	-19.8	32	0	0	0	108.9	L477	P475-L477 PolarHBondContact O-N 2.88Å
476	K	32.1	Very low	36	Very low	184 Å²	184	149.3 Å²	149.3	80%	0.8	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-69.7	121.6	167.5	-82.8	-169.5	169.8	-165.5	0	108.2	R474	R474-K476 PolarHBondContact O-N 2.94Å
477	L	30.7	Very low	35.2	Very low	168 Å²	168	151.5 Å²	151.5	88%	0.88	77%	0.772	S	S	*	*			trans	-95.6	88.1	166.5	-175.9	84	0	0	0	106.8	P475 G479	P475-L477 PolarHBondContact O-N 2.88Å; L477-G479 PolarHBondContact O-N 3.05Å
478	D	33.7	Very low	34.3	Very low	140 Å²	140	151.6 Å²	151.6	75%	0.749	78%	0.781	S	S	*	*			trans	-86.3	105.4	170.7	-78.1	-41.3	0	0	0	108.3
479	G	32.1	Very low	33.9	Very low	73 Å²	73	150.8 Å²	150.8	75%	0.753	78%	0.784	S	S	*	*			trans	-83.8	133.2	179.2	0	0	0	0	0	111.9	L477	L477-G479 PolarHBondContact O-N 3.05Å
480	A	28.7	Very low	33.7	Very low	102 Å²	102	154 Å²	154	84%	0.843	80%	0.801	S	S	*	*			trans	-76.2	138.6	-179.2	0	0	0	0	0	113.2
481	V	32.4	Very low	33.1	Very low	147 Å²	147	151.3 Å²	151.3	89%	0.891	80%	0.797	S	S	*	*			trans	-135.2	124.2	151.6	-178.9	0	0	0	0	109.6
482	K	28.9	Very low	32.9	Very low	168 Å²	168	153.1 Å²	153.1	73%	0.73	81%	0.805	S	S	*	*			trans	-53.4	155.3	-177.9	-56.2	167.1	175.2	179.9	0	114.9
483	L	33.7	Very low	32.7	Very low	175 Å²	175	157 Å²	157	92%	0.916	81%	0.807	S	S	*	*				-144.3	152.7	112.3	-79.4	-169.8	0	0	0	109.7
484	N	28.5	Very low	32.9	Very low	125 Å²	125	154.8 Å²	154.8	67%	0.668	80%	0.8	S	S	*	*			trans	-104.7	163.4	-165.1	-34.3	-54.3	0	0	0	112.5
485	E	35.4	Very low	33.2	Very low	184 Å²	184	151.8 Å²	151.8	86%	0.86	80%	0.796	S	S	*	*			trans	-174.3	105.4	130.1	-103.7	170.2	-174.6	0	0	113.1
486	D	35.4	Very low	33	Very low	142 Å²	142	151.5 Å²	151.5	76%	0.759	80%	0.797	S	S	*	*			trans	47.8	104.5	135.1	-53.3	-11.5	0	0	0	125.2
487	N	33.6	Very low	33.2	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	80%	0.798	S	S	*	*				42.1	165	108.4	-109.3	14.7	0	0	0	123.3
488	P	40	Very low	33.3	Very low	96 Å²	96	147.1 Å²	147.1	62%	0.623	80%	0.796	S	S	*	*			cis	-141.1	-165.3	-43.2	31.9	-8.7	0	0	0	115.4
489	E	35.4	Very low	33.4	Very low	156 Å²	156	147.6 Å²	147.6	73%	0.729	80%	0.798	S	S	*	*			trans	96.7	117.1	153	-43.3	-167.6	162.6	0	0	120.8
490	K	36.9	Very low	33.7	Very low	183 Å²	183	151.7 Å²	151.7	80%	0.796	80%	0.798	S	S	*	*				172.6	136	90.6	-85.2	-172.5	-178	165.7	0	113.7
491	N	28.5	Very low	34	Very low	152 Å²	152	154.2 Å²	154.2	81%	0.813	79%	0.794	S	S	*	*			trans	-85.6	159.8	175	-56.8	-16.9	0	0	0	112.1
492	F	34.3	Very low	34.2	Very low	211 Å²	211	150.4 Å²	150.4	93%	0.925	79%	0.785	S	S	*	*			trans	-157.5	141.4	143.5	-120.8	-79.8	0	0	0	112
493	E	32	Very low	34.6	Very low	172 Å²	172	150.1 Å²	150.1	80%	0.804	79%	0.79	S	S	*	*			trans	-102.8	-173	-173.3	-56.8	171.4	135.3	0	0	113.1
494	H	36.3	Very low	34.7	Very low	162 Å²	162	147.6 Å²	147.6	75%	0.75	78%	0.781	S	S	*	*			trans	99.2	140.2	-179.9	-78.4	-110.6	0	0	0	115.4
495	E	36.5	Very low	34.9	Very low	167 Å²	167	147.3 Å²	147.3	78%	0.78	78%	0.78	S	S	*	*			cis	-152.5	169.2	7.2	-151.4	154.3	-129.8	0	0	112.6
496	S	28.8	Very low	35	Very low	118 Å²	118	146.5 Å²	146.5	83%	0.825	77%	0.773	S	S	*	*			trans	-98.2	166.7	-172.8	54.4	0	0	0	0	115.5
497	G	35	Very low	34.8	Very low	79 Å²	79	145.4 Å²	145.4	81%	0.814	77%	0.771	S	S	*	*			trans	-171.4	103.3	169.6	0	0	0	0	0	114.3
498	E	33.2	Very low	34.9	Very low	180 Å²	180	145.3 Å²	145.3	84%	0.841	77%	0.769	S	S	*	*			trans	-94.2	162.4	178.7	-57.4	177.2	140.6	0	0	112.4
499	N	36.9	Very low	34.6	Very low	150 Å²	150	147 Å²	147	80%	0.802	77%	0.772	S	S	*	*			trans	178.2	118.6	141	-88.6	-36.6	0	0	0	112.5
500	E	38.4	Very low	34.6	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.743	77%	0.769	S	S	*	*				23.6	155	129.2	-47.9	-164.6	124.3	0	0	121.5
501	M	34.8	Very low	34.5	Very low	156 Å²	156	145.4 Å²	145.4	77%	0.768	77%	0.769	S	S	*	*			cis	-166.3	154.9	13.4	-147.6	-176.2	-80.3	0	0	112.4
502	G	36.7	Very low	34.8	Very low	67 Å²	67	148.5 Å²	148.5	69%	0.691	78%	0.775	S	S	*	*			trans	83.2	134	147	0	0	0	0	0	119.3
503	I	36.9	Very low	34.7	Very low	162 Å²	162	146.7 Å²	146.7	83%	0.831	77%	0.771	S	S	*	*			cis	120.7	107.9	14.1	-77.1	175.6	0	0	0	112.7
504	V	35.2	Very low	35.1	Very low	121 Å²	121	144.5 Å²	144.5	73%	0.733	77%	0.77	S	S	*	*			trans	90.9	115.6	138.7	167.3	0	0	0	0	123.5
505	D	32.9	Very low	35.3	Very low	120 Å²	120	146.2 Å²	146.2	64%	0.642	78%	0.775	S	S	*	*			trans	67.1	140.5	136.2	-85.9	-2.4	0	0	0	127.7
506	K	37.7	Very low	35.1	Very low	167 Å²	167	143.6 Å²	143.6	73%	0.726	78%	0.775	S	S	*	*			trans	94	102.1	134	-83.2	163.9	-175.4	124.7	0	121.7
507	V	30.7	Very low	35.7	Very low	119 Å²	119	148 Å²	148	72%	0.721	78%	0.78	S	S	*	*				35.1	121.8	118.3	-165.7	0	0	0	0	117.8
508	I	35.9	Very low	35.7	Very low	154 Å²	154	154.8 Å²	154.8	79%	0.79	78%	0.781	S	S	*	*				-179.2	112.2	120.9	-88.5	154.5	0	0	0	111.5
509	I	34.3	Very low	35.9	Very low	133 Å²	133	152.1 Å²	152.1	68%	0.682	77%	0.772	S	S	*	*			trans	6.2	123.7	139.7	-51.9	160.1	0	0	0	117.6
510	S	35.1	Very low	36	Very low	95 Å²	95	153.1 Å²	153.1	66%	0.664	77%	0.769	S	S	*	*				-178.6	115.8	120.3	-85.6	0	0	0	0	117.4
511	R	34.5	Very low	35.7	Very low	210 Å²	210	150.4 Å²	150.4	79%	0.792	77%	0.774	S	S	*	*			trans	27.5	125.8	131.3	-70.2	175.9	-82.7	-165.7	-9	119.7
512	K	34	Very low	35.7	Very low	216 Å²	216	152.2 Å²	152.2	94%	0.939	78%	0.781	S	S	*	*				-151.5	142.5	120.6	-115.5	166.5	-173.7	173.5	0	113.2
513	M	33.2	Very low	35.5	Very low	173 Å²	173	160.9 Å²	160.9	85%	0.852	79%	0.792	S	S	*	*			trans	-108.3	148	-178.4	-60.7	170.5	167	0	0	110.9
514	T	40.7	Very low	35.3	Very low	126 Å²	126	159.1 Å²	159.1	77%	0.773	78%	0.784	S	S	*	*			trans	-177.4	145.8	141.7	42.1	0	0	0	0	108.2
515	K	39	Very low	35	Very low	198 Å²	198	158.4 Å²	158.4	86%	0.861	78%	0.784	S	S	*	*			cis	-159.1	143.1	-7.7	-109.6	167.7	-178.5	172.9	0	106.6
516	S	33.6	Very low	35	Very low	113 Å²	113	160.4 Å²	160.4	79%	0.79	78%	0.784	S	S	*	*			trans	-89	156.2	177.7	75.4	0	0	0	0	113.1
517	K	40.2	Very low	34.9	Very low	211 Å²	211	156.5 Å²	156.5	92%	0.917	78%	0.782	S	S	*	*			trans	-142.5	128.8	148.4	-150.5	171.3	-176.7	-177.9	0	110.8
518	R	36.6	Very low	35	Very low	221 Å²	221	159.6 Å²	159.6	83%	0.834	79%	0.789	S	S	*	*			trans	-83.2	152.5	177.9	-66.5	171.2	164.9	137.1	-6.5	110.1
519	D	37	Very low	34.9	Very low	124 Å²	124	157.2 Å²	157.2	66%	0.663	78%	0.781	S	S	*	*				-164.9	138.8	104.4	-106.5	-21.7	0	0	0	116.7
520	K	38	Very low	34.7	Very low	170 Å²	170	157.6 Å²	157.6	74%	0.739	78%	0.784	S	S	*	*			trans	17.6	116.1	151.7	-56.4	170	-167.4	87.5	0	118.4
521	A	32.3	Very low	34.7	Very low	102 Å²	102	162.5 Å²	162.5	84%	0.843	79%	0.793	S	S	*	*				84.4	103	56.2	0	0	0	0	0	115.7
522	Q	35	Very low	34.7	Very low	195 Å²	195	158.3 Å²	158.3	91%	0.911	79%	0.793	S	S	*	*			trans	-143.3	122.1	139.8	-157.6	166.9	-1.7	0	0	107.5
523	R	33	Very low	34.6	Very low	248 Å²	248	152.8 Å²	152.8	94%	0.936	78%	0.782	S	S	*	*			trans	-105.9	107.5	-165.2	-171.2	-175.6	-171.4	-165.8	2.9	109.5
524	I	33.4	Very low	34.8	Very low	126 Å²	126	153.1 Å²	153.1	65%	0.646	78%	0.781	S	S	*	*			trans	-94.4	129.8	167.3	-59.9	175.6	0	0	0	107.2	Y526	I524-Y526 HydrophobicContact CB-CE2 4.06Å; I524-Y526 HydrophobicContact CG2-CD2 4.28Å; I524-Y526 HydrophobicContact CG2-CE2 3.72Å
525	S	27.8	Very low	34.3	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	77%	0.767	S	S	*	*			trans	-88.2	112.7	-177.9	51.7	0	0	0	0	111.6
526	Y	32.6	Very low	34	Very low	163 Å²	163	149.2 Å²	149.2	64%	0.639	75%	0.753	S	S	*	*			trans	-100.8	60.7	171.5	-69.3	-83.6	0	0	0	110.6	I524	I524-Y526 HydrophobicContact CB-CE2 4.06Å; I524-Y526 HydrophobicContact CG2-CD2 4.28Å; I524-Y526 HydrophobicContact CG2-CE2 3.72Å
527	A	35.4	Very low	34.4	Very low	84 Å²	84	147.7 Å²	147.7	69%	0.694	74%	0.739	S	S	*	*			trans	-82.2	-24	-175.5	0	0	0	0	0	113.9
528	E	33.8	Very low	34.4	Very low	185 Å²	185	150.4 Å²	150.4	86%	0.864	74%	0.744	S	S	*	*	S	Bend	trans	-93.8	-14.5	-176.1	-119.9	71.7	-138.9	0	0	114.5
529	T	32.8	Very low	34.8	Very low	103 Å²	103	144.1 Å²	144.1	63%	0.632	73%	0.734	S	S	*	*	S	Bend	trans	-106.6	28.7	-166.7	57	0	0	0	0	114.2
530	I	30	Very low	34.7	Very low	142 Å²	142	140.9 Å²	140.9	73%	0.728	73%	0.729	S	S	*	*			trans	-122.1	87.9	174.6	-51.5	177.8	0	0	0	109.1
531	K	36.7	Very low	34.6	Very low	197 Å²	197	142.3 Å²	142.3	86%	0.857	73%	0.73	S	S	*	*			trans	-124.9	140.7	154.1	-77.3	-171.1	178.5	176.9	0	109.1
532	P	32.6	Very low	34.8	Very low	123 Å²	123	143.7 Å²	143.7	80%	0.799	72%	0.723	S	S	*	*			trans	-77.5	148.7	-164.8	-13	30.5	0	0	0	112.6
533	S	33.8	Very low	34.9	Very low	100 Å²	100	136.4 Å²	136.4	70%	0.699	69%	0.693	S	S	*	*			trans	-66.3	160.2	163.6	48.6	0	0	0	0	112.1
534	E	36.4	Very low	35.1	Very low	179 Å²	179	133.1 Å²	133.1	84%	0.836	68%	0.681	S	S	*	*			trans	49.1	107.7	153.3	-66.4	178.9	138.4	0	0	119.1
535	N	31.2	Very low	35.7	Very low	90 Å²	90	135.9 Å²	135.9	48%	0.481	68%	0.683	S	S	.	*			trans	-158.8	52.1	155.8	-118	-33	0	0	0	112.6	D546	N535-D546 PolarHBondContact ND2-OD2 3.34Å; N535-D546 VanDerWaalsContact ND2-OD2 3.07Å
536	R	32.2	Very low	36.3	Very low	152 Å²	152	135.5 Å²	135.5	57%	0.574	67%	0.673	S	S	*	*	B	Isolated β-bridge	trans	-113.3	108.7	172.8	-71.7	176.9	84.8	131.3	-19.6	110.4	E246	E246-R536 WeakPolarHBondContact OE1-CD 3.32Å; E246-R536 IonicContact OE1-CZ 3.11Å; E246-R536 IonicContact OE1-NE 3.62Å; E246-R536 PolarHBondContact OE1-NE 2.86Å; E246-R536 IonicContact OE1-NH1 3.23Å; E246-R536 PolarHBondContact OE1-NH1 2.74Å; E246-R536 IonicContact OE1-NH2 2.69Å; E246-R536 IonicContact OE2-CZ 3.21Å; E246-R536 IonicContact OE2-NH1 2.75Å; E246-R536 PolarHBondContact OE2-NH1 3.33Å; E246-R536 IonicContact OE2-NH2 2.75Å; E246-R536 PolarHBondContact OE2-NH2 3.12Å
537	T	40.7	Very low	36.6	Very low	81 Å²	81	134.8 Å²	134.8	50%	0.497	67%	0.669	S	S	.	*			trans	-66.6	154.2	162.1	64.8	0	0	0	0	109.7	S539 G540 R541	T537-S539 PolarHBondContact O-N 3.33Å; T537-S539 PolarHBondContact OG1-OG 3.18Å; T537-G540 PolarHBondContact O-N 3.31Å; T537-R541 PolarHBondContact OG1-O 2.94Å
538	R	41.6	Very low	36.7	Very low	269 Å²	269	136.7 Å²	136.7	100%	1.015	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-3.1	174.7	-165.7	174.2	173.9	-167.5	-0.3	114.8
539	S	44.5	Very low	37.2	Very low	89 Å²	89	136.1 Å²	136.1	62%	0.622	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-6.3	176.4	75.9	0	0	0	0	115	T537 R541	T537-S539 PolarHBondContact O-N 3.33Å; T537-S539 PolarHBondContact OG1-OG 3.18Å; S539-R541 VanDerWaalsContact C-N 3.27Å; S539-R541 PolarHBondContact O-N 3.37Å
540	G	35.7	Very low	38	Very low	55 Å²	55	138 Å²	138	57%	0.567	67%	0.668	S	S	*	*			trans	75.1	6.5	-177.3	0	0	0	0	0	115.2	T537 L542	T537-G540 PolarHBondContact O-N 3.31Å; G540-L542 PolarHBondContact O-N 3.5Å
541	R	35.7	Very low	38.9	Very low	201 Å²	201	136.5 Å²	136.5	76%	0.758	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-77.2	120.3	166.8	-78.2	-166.1	179.5	-140.2	3.8	110.6	T537 S539	T537-R541 PolarHBondContact OG1-O 2.94Å; S539-R541 VanDerWaalsContact C-N 3.27Å; S539-R541 PolarHBondContact O-N 3.37Å
542	L	35.8	Very low	39	Very low	131 Å²	131	131.1 Å²	131.1	69%	0.686	65%	0.645	S	S	*	*	B	Isolated β-bridge	trans	-66.2	130.5	163	-70.4	167.2	0	0	0	110	G540	G540-L542 PolarHBondContact O-N 3.5Å
543	S	36.5	Very low	39.1	Very low	41 Å²	41	130.3 Å²	130.3	29%	0.287	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-65.7	132.5	166	-178.8	0	0	0	0	109.5
544	R	38.7	Very low	39.4	Very low	180 Å²	180	130.7 Å²	130.7	68%	0.679	65%	0.645	S	S	*	*	S	Bend	trans	-84.6	-7.6	179	-106.2	-173	-166.3	-163.6	2.1	114	D546	R544-D546 PolarHBondContact O-N 2.88Å
545	R	44.9	Very low	39.6	Very low	183 Å²	183	125.9 Å²	125.9	69%	0.691	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-29.9	-161.4	-65.4	-173.9	-179.3	130.6	-3.8	113.7	W547	R545-W547 PolarHBondContact O-N 2.83Å
546	D	41.3	Very low	39.9	Very low	97 Å²	97	126 Å²	126	52%	0.519	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.4	16.1	-167.2	-44.9	-53	0	0	0	113.9	N535 R544 L548	N535-D546 PolarHBondContact ND2-OD2 3.34Å; N535-D546 VanDerWaalsContact ND2-OD2 3.07Å; R544-D546 PolarHBondContact O-N 2.88Å; D546-L548 PolarHBondContact O-N 3.12Å; D546-L548 VanDerWaalsContact O-N 3.12Å
547	W	37.6	Very low	40.2	Very low	149 Å²	149	127.6 Å²	127.6	56%	0.564	66%	0.661	S	S	*	*			trans	-70.7	109	176.5	-79.6	39.8	0	0	0	109.9	R545 K549 L552	R545-W547 PolarHBondContact O-N 2.83Å; W547-K549 PolarHBondContact O-N 2.76Å; W547-L552 HydrophobicContact CE3-CD1 3.42Å; W547-L552 VanDerWaalsContact CE3-CD1 3.42Å; W547-L552 HydrophobicContact CZ3-CD1 3.68Å
548	L	38.4	Very low	39.9	Very low	123 Å²	123	131.8 Å²	131.8	64%	0.644	68%	0.681	S	S	*	*			trans	-46.9	107.6	173.3	-106.3	155	0	0	0	110.4	D546 N550 V551	D546-L548 PolarHBondContact O-N 3.12Å; D546-L548 VanDerWaalsContact O-N 3.12Å; L548-N550 PolarHBondContact O-N 3.25Å; L548-V551 HydrophobicContact CB-CG2 3.9Å; L548-V551 PolarHBondContact O-N 3.36Å
549	K	43.1	Very low	39.7	Very low	174 Å²	174	123.7 Å²	123.7	76%	0.757	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-49.7	-31.7	-178.7	-70	-179.9	176.5	177.9	0	112.5	W547 V551 S553	W547-K549 PolarHBondContact O-N 2.76Å; K549-V551 VanDerWaalsContact C-N 3.32Å; K549-V551 PolarHBondContact O-N 3.47Å; K549-S553 PolarHBondContact O-OG 2.73Å
550	N	51.1	Low	39.4	Very low	142 Å²	142	126.6 Å²	126.6	76%	0.759	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-76.2	-11.2	-175.6	-56	5.1	0	0	0	114.4	L548	L548-N550 PolarHBondContact O-N 3.25Å
551	V	47.9	Very low	39.7	Very low	111 Å²	111	128 Å²	128	67%	0.673	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-84.3	-13.8	179.9	175.8	0	0	0	0	112.2	L548 K549	L548-V551 HydrophobicContact CB-CG2 3.9Å; L548-V551 PolarHBondContact O-N 3.36Å; K549-V551 VanDerWaalsContact C-N 3.32Å; K549-V551 PolarHBondContact O-N 3.47Å
552	L	38.3	Very low	39.9	Very low	83 Å²	83	122 Å²	122	44%	0.435	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.2	0.1	-171.3	-74.7	159.1	0	0	0	115	W547 S554	W547-L552 HydrophobicContact CE3-CD1 3.42Å; W547-L552 VanDerWaalsContact CE3-CD1 3.42Å; W547-L552 HydrophobicContact CZ3-CD1 3.68Å; L552-S554 VanDerWaalsContact C-N 3.32Å; L552-S554 PolarHBondContact O-N 2.79Å
553	S	35.6	Very low	40	Very low	106 Å²	106	121.2 Å²	121.2	74%	0.741	67%	0.671	S	S	*	*			trans	-90.2	34.7	-175.3	-65.4	0	0	0	0	114.9	K549	K549-S553 PolarHBondContact O-OG 2.73Å
554	S	39.5	Very low	40.8	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	68%	0.682	S	S	*	*	S	Bend	trans	-117.3	115.8	166.3	56.3	0	0	0	0	111.6	L552	L552-S554 VanDerWaalsContact C-N 3.32Å; L552-S554 PolarHBondContact O-N 2.79Å
555	G	42.2	Very low	41.4	Very low	78 Å²	78	119.2 Å²	119.2	80%	0.804	68%	0.68	S	S	*	*	S	Bend	trans	105	14.9	159.1	0	0	0	0	0	119.2
556	V	37.4	Very low	41.7	Very low	92 Å²	92	115.4 Å²	115.4	56%	0.558	67%	0.673	S	S	*	*			trans	-140	130.7	167.2	-170.8	0	0	0	0	110.5
557	E	38.7	Very low	41.9	Very low	186 Å²	186	115.4 Å²	115.4	87%	0.869	67%	0.668	S	S	*	*			trans	-77.6	148.4	-178.3	-65.9	168.7	-164.5	0	0	112.2	S559	E557-S559 PolarHBondContact O-N 3.42Å
558	N	34.3	Very low	42.9	Very low	169 Å²	169	113.8 Å²	113.8	90%	0.904	67%	0.665	S	S	*	*			trans	-78.5	103.9	-178.5	-63.7	-43.9	0	0	0	110.7
559	S	35.6	Very low	44.1	Very low	98 Å²	98	110.8 Å²	110.8	69%	0.685	65%	0.648	S	S	*	*			trans	-128.2	127.4	165.4	-172.1	0	0	0	0	110.8	E557	E557-S559 PolarHBondContact O-N 3.42Å
560	T	40.1	Very low	45.3	Very low	150 Å²	150	105.9 Å²	105.9	92%	0.92	63%	0.633	S	S	*	*			trans	-94.3	5.4	-157.4	41	0	0	0	0	115.3
561	A	41.4	Very low	46	Very low	86 Å²	86	104.5 Å²	104.5	71%	0.711	62%	0.618	S	S	*	*			trans	-116	-0.1	-163.6	0	0	0	0	0	116.7
562	S	40	Very low	46.8	Very low	74 Å²	74	103.4 Å²	103.4	52%	0.517	60%	0.601	S	S	.	*	S	Bend	trans	-107.2	100.8	-169.4	-59.5	0	0	0	0	114.7	F567	S562-F567 WeakPolarHBondContact O-CD2 3.33Å
563	N	38.3	Very low	48	Very low	115 Å²	115	103.7 Å²	103.7	62%	0.615	60%	0.601	S	S	*	*			trans	32.5	87.4	157.4	-68.3	-21.6	0	0	0	116.7	T565 I566 F567	N563-T565 PolarHBondContact O-N 3.15Å; N563-I566 HydrophobicContact CB-CD1 4.33Å; N563-I566 HydrophobicContact CB-CG1 4.49Å; N563-I566 PolarHBondContact O-N 3.13Å; N563-I566 VanDerWaalsContact O-N 3.13Å; N563-F567 PolarHBondContact O-N 3.37Å
564	S	52.4	Low	49.6	Very low	75 Å²	75	104.5 Å²	104.5	52%	0.524	59%	0.591	S	S	.	*	H	α-helix	trans	-59.1	-17.8	-174.5	81.8	0	0	0	0	115.6	K568	S564-K568 VanDerWaalsContact O-CB 3.25Å; S564-K568 WeakPolarHBondContact O-CB 3.48Å; S564-K568 VanDerWaalsContact O-CD 3.27Å; S564-K568 WeakPolarHBondContact O-CD 3.4Å; S564-K568 WeakPolarHBondContact O-CG 3.38Å; S564-K568 PolarHBondContact O-N 3.41Å; S564-K568 VanDerWaalsContact O-N 3.14Å
565	T	51.5	Low	50.8	Low	103 Å²	103	101 Å²	101	63%	0.632	57%	0.568	S	S	*	*	H	α-helix	trans	-75.5	-50.4	175.1	48.6	0	0	0	0	111.9	N563 K568 E569	N563-T565 PolarHBondContact O-N 3.15Å; T565-K568 PolarHBondContact O-N 2.81Å; T565-E569 PolarHBondContact O-N 3.03Å
566	I	50.4	Low	51.6	Low	104 Å²	104	99.1 Å²	99.1	53%	0.533	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-43.2	178.8	-60.3	176.2	0	0	0	109.9	N563 K568 E569 T570	N563-I566 HydrophobicContact CB-CD1 4.33Å; N563-I566 HydrophobicContact CB-CG1 4.49Å; N563-I566 PolarHBondContact O-N 3.13Å; N563-I566 VanDerWaalsContact O-N 3.13Å; I566-K568 PolarHBondContact O-N 3.33Å; I566-E569 PolarHBondContact O-N 3.15Å; I566-E569 VanDerWaalsContact O-N 3.16Å; I566-T570 HydrophobicContact CG2-CG2 4.48Å; I566-T570 PolarHBondContact O-N 3.14Å; I566-T570 PolarHBondContact O-OG1 3.11Å
567	F	47.2	Very low	52.4	Low	97 Å²	97	104.8 Å²	104.8	43%	0.425	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-38	175.1	-110.1	-86.4	0	0	0	112.9	S562 N563 E569 T570 Y571	S562-F567 WeakPolarHBondContact O-CD2 3.33Å; N563-F567 PolarHBondContact O-N 3.37Å; F567-E569 VanDerWaalsContact C-N 3.32Å; F567-T570 PolarHBondContact O-OG1 3.03Å; F567-Y571 HydrophobicContact CD1-CD2 4.16Å; F567-Y571 AromaticContact CD1-CE2 3.98Å; F567-Y571 HydrophobicContact CD1-CE2 3.98Å; F567-Y571 HydrophobicContact CE1-CE2 4.22Å; F567-Y571 WeakPolarHBondContact O-CB 3.41Å; F567-Y571 WeakPolarHBondContact O-CD2 3.19Å; F567-Y571 PolarHBondContact O-N 3.06Å; F567-Y571 VanDerWaalsContact O-N 3.17Å
568	K	56.9	Low	53.5	Low	115 Å²	115	102.8 Å²	102.8	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-38.4	172.3	-82.6	168.3	-172.6	162.4	0	111.6	S564 T565 I566 R572	S564-K568 VanDerWaalsContact O-CB 3.25Å; S564-K568 WeakPolarHBondContact O-CB 3.48Å; S564-K568 VanDerWaalsContact O-CD 3.27Å; S564-K568 WeakPolarHBondContact O-CD 3.4Å; S564-K568 WeakPolarHBondContact O-CG 3.38Å; S564-K568 PolarHBondContact O-N 3.41Å; S564-K568 VanDerWaalsContact O-N 3.14Å; T565-K568 PolarHBondContact O-N 2.81Å; I566-K568 PolarHBondContact O-N 3.33Å; K568-R572 VanDerWaalsContact O-CB 3.27Å; K568-R572 WeakPolarHBondContact O-CB 3.38Å; K568-R572 PolarHBondContact O-N 3.39Å
569	E	63.7	Low	54	Low	59 Å²	59	101.4 Å²	101.4	28%	0.276	53%	0.532	S	S	.	.	H	α-helix	trans	-73.6	-41.9	-177.9	-169	53.6	-146.2	0	0	112.7	T565 I566 F567 Y571 R572 Q573	T565-E569 PolarHBondContact O-N 3.03Å; I566-E569 PolarHBondContact O-N 3.15Å; I566-E569 VanDerWaalsContact O-N 3.16Å; F567-E569 VanDerWaalsContact C-N 3.32Å; E569-Y571 PolarHBondContact O-N 3.01Å; E569-R572 VanDerWaalsContact CD-NH2 3.29Å; E569-R572 WeakPolarHBondContact O-CB 3.45Å; E569-R572 PolarHBondContact O-N 3.11Å; E569-R572 VanDerWaalsContact O-N 3.14Å; E569-R572 IonicContact OE1-CZ 2.63Å; E569-R572 IonicContact OE1-NE 2.69Å; E569-R572 PolarHBondContact OE1-NE 3.1Å; E569-R572 IonicContact OE1-NH2 2.84Å; E569-R572 PolarHBondContact OE1-NH2 2.63Å; E569-R572 IonicContact OE2-CZ 3.65Å; E569-R572 IonicContact OE2-NE 3.41Å; E569-R572 PolarHBondContact OE2-NE 3.5Å; E569-R572 IonicContact OE2-NH2 3.81Å; E569-R572 PolarHBondContact OE2-NH2 3.34Å; E569-R572 VanDerWaalsContact OE2-NH2 3.11Å; E569-Q573 WeakPolarHBondContact O-CG 3.45Å; E569-Q573 PolarHBondContact O-N 3.29Å; E569-Q573 PolarHBondContact OE1-NE2 3.09Å
570	T	68.4	Low	54.6	Low	72 Å²	72	102.3 Å²	102.3	44%	0.442	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-39.3	174.6	55.5	0	0	0	0	112	I566 F567 Q573 K574	I566-T570 HydrophobicContact CG2-CG2 4.48Å; I566-T570 PolarHBondContact O-N 3.14Å; I566-T570 PolarHBondContact O-OG1 3.11Å; F567-T570 PolarHBondContact O-OG1 3.03Å; T570-Q573 PolarHBondContact O-N 2.72Å; T570-K574 WeakPolarHBondContact O-CB 3.38Å; T570-K574 PolarHBondContact O-N 2.84Å
571	Y	66.4	Low	54.9	Low	113 Å²	113	100.6 Å²	100.6	44%	0.443	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-39.7	170.4	-94.2	-96.9	0	0	0	112.3	F567 E569 K574 A575	F567-Y571 HydrophobicContact CD1-CD2 4.16Å; F567-Y571 AromaticContact CD1-CE2 3.98Å; F567-Y571 HydrophobicContact CD1-CE2 3.98Å; F567-Y571 HydrophobicContact CE1-CE2 4.22Å; F567-Y571 WeakPolarHBondContact O-CB 3.41Å; F567-Y571 WeakPolarHBondContact O-CD2 3.19Å; F567-Y571 PolarHBondContact O-N 3.06Å; F567-Y571 VanDerWaalsContact O-N 3.17Å; E569-Y571 PolarHBondContact O-N 3.01Å; Y571-K574 PolarHBondContact O-N 3.24Å; Y571-A575 WeakPolarHBondContact O-CB 3.49Å; Y571-A575 PolarHBondContact O-N 2.88Å
572	R	64.2	Low	55.2	Low	87 Å²	87	100.9 Å²	100.9	33%	0.328	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-43.2	176.5	-167.5	174.4	74.5	125.6	13.4	111.4	K568 E569 A575 N576 S584	K568-R572 VanDerWaalsContact O-CB 3.27Å; K568-R572 WeakPolarHBondContact O-CB 3.38Å; K568-R572 PolarHBondContact O-N 3.39Å; E569-R572 VanDerWaalsContact CD-NH2 3.29Å; E569-R572 WeakPolarHBondContact O-CB 3.45Å; E569-R572 PolarHBondContact O-N 3.11Å; E569-R572 VanDerWaalsContact O-N 3.14Å; E569-R572 IonicContact OE1-CZ 2.63Å; E569-R572 IonicContact OE1-NE 2.69Å; E569-R572 PolarHBondContact OE1-NE 3.1Å; E569-R572 IonicContact OE1-NH2 2.84Å; E569-R572 PolarHBondContact OE1-NH2 2.63Å; E569-R572 IonicContact OE2-CZ 3.65Å; E569-R572 IonicContact OE2-NE 3.41Å; E569-R572 PolarHBondContact OE2-NE 3.5Å; E569-R572 IonicContact OE2-NH2 3.81Å; E569-R572 PolarHBondContact OE2-NH2 3.34Å; E569-R572 VanDerWaalsContact OE2-NH2 3.11Å; R572-A575 PolarHBondContact O-N 3.22Å; R572-N576 WeakPolarHBondContact O-CB 3.26Å; R572-N576 PolarHBondContact O-N 3.38Å; R572-N576 PolarHBondContact O-OD1 3.28Å; R572-S584 VanDerWaalsContact NH1-CB 3.26Å; R572-S584 PolarHBondContact NH1-OG 2.88Å; R572-S584 PolarHBondContact NH2-OG 3.41Å; R572-S584 VanDerWaalsContact NH2-OG 3.09Å
573	Q	63.1	Low	55.5	Low	90 Å²	90	99.5 Å²	99.5	42%	0.421	49%	0.49	S	S	.	.	H	α-helix	trans	-67	-39.4	175.1	-69.6	-178.4	19.8	0	0	112.5	E569 T570 N576 R577	E569-Q573 WeakPolarHBondContact O-CG 3.45Å; E569-Q573 PolarHBondContact O-N 3.29Å; E569-Q573 PolarHBondContact OE1-NE2 3.09Å; T570-Q573 PolarHBondContact O-N 2.72Å; Q573-N576 PolarHBondContact O-N 3.16Å; Q573-R577 WeakPolarHBondContact O-CB 3.4Å; Q573-R577 WeakPolarHBondContact O-CG 3.27Å; Q573-R577 PolarHBondContact O-N 3.28Å
574	K	70.6	Confident	56	Low	122 Å²	122	97.4 Å²	97.4	53%	0.53	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-43.1	175.3	-169.2	172.8	-178.7	178.9	0	111.5	T570 Y571 R577 Q578	T570-K574 WeakPolarHBondContact O-CB 3.38Å; T570-K574 PolarHBondContact O-N 2.84Å; Y571-K574 PolarHBondContact O-N 3.24Å; K574-R577 PolarHBondContact O-N 3.4Å; K574-Q578 WeakPolarHBondContact O-CG 3.43Å; K574-Q578 PolarHBondContact O-N 2.98Å
575	A	63.6	Low	56.1	Low	35 Å²	35	100.4 Å²	100.4	29%	0.289	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-44.7	173.8	0	0	0	0	0	112.1	Y571 R572 R577 Q578 M579	Y571-A575 WeakPolarHBondContact O-CB 3.49Å; Y571-A575 PolarHBondContact O-N 2.88Å; R572-A575 PolarHBondContact O-N 3.22Å; A575-R577 VanDerWaalsContact C-N 3.34Å; A575-R577 PolarHBondContact O-N 2.93Å; A575-Q578 PolarHBondContact O-N 3.04Å; A575-M579 PolarHBondContact O-N 3.29Å
576	N	60.3	Low	55.9	Low	40 Å²	40	100.8 Å²	100.8	21%	0.214	48%	0.48	C	S	.	.	H	α-helix	trans	-61.2	-41.6	177	-74.3	-0.9	0	0	0	112	R572 Q573 M579 N580 M581	R572-N576 WeakPolarHBondContact O-CB 3.26Å; R572-N576 PolarHBondContact O-N 3.38Å; R572-N576 PolarHBondContact O-OD1 3.28Å; Q573-N576 PolarHBondContact O-N 3.16Å; N576-M579 PolarHBondContact O-N 3.35Å; N576-N580 PolarHBondContact O-N 3.06Å; N576-M581 HydrophobicContact CB-CB 4.19Å; N576-M581 PolarHBondContact O-N 2.99Å; N576-M581 VanDerWaalsContact O-N 3.09Å
577	R	53.2	Low	56	Low	211 Å²	211	100.9 Å²	100.9	80%	0.796	49%	0.49	S	S	*	.	H	α-helix	trans	-64	-38	174.2	-75.1	178.6	-177.1	-179.8	3.1	112.7	Q573 K574 A575	Q573-R577 WeakPolarHBondContact O-CB 3.4Å; Q573-R577 WeakPolarHBondContact O-CG 3.27Å; Q573-R577 PolarHBondContact O-N 3.28Å; K574-R577 PolarHBondContact O-N 3.4Å; A575-R577 VanDerWaalsContact C-N 3.34Å; A575-R577 PolarHBondContact O-N 2.93Å
578	Q	61.6	Low	56	Low	144 Å²	144	98.5 Å²	98.5	67%	0.673	48%	0.482	S	S	*	.	H	α-helix	trans	-77	-29.2	178.5	-76.1	-176.2	-36.4	0	0	113.8	K574 A575	K574-Q578 WeakPolarHBondContact O-CG 3.43Å; K574-Q578 PolarHBondContact O-N 2.98Å; A575-Q578 PolarHBondContact O-N 3.04Å
579	M	45.6	Very low	55.6	Low	140 Å²	140	97 Å²	97	69%	0.69	49%	0.486	S	S	*	.	H	α-helix	trans	-105.8	11.2	-177.8	-70.2	-161.7	157.9	0	0	114.6	A575 N576 M581	A575-M579 PolarHBondContact O-N 3.29Å; N576-M579 PolarHBondContact O-N 3.35Å; M579-M581 HydrophobicContact CB-CG 3.83Å; M579-M581 PolarHBondContact O-N 2.81Å; M579-M581 VanDerWaalsContact O-N 3.12Å
580	N	46.7	Very low	54.5	Low	116 Å²	116	103.5 Å²	103.5	62%	0.62	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	26.2	177.5	-132.9	-16.1	0	0	0	113.4	N576 R599	N576-N580 PolarHBondContact O-N 3.06Å; N580-R599 PolarHBondContact OD1-NH2 3.36Å
581	M	48.2	Very low	53.8	Low	115 Å²	115	106.3 Å²	106.3	57%	0.567	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-78.7	137	-175	-63.3	-68.1	-72.5	0	0	111	N576 M579	N576-M581 HydrophobicContact CB-CB 4.19Å; N576-M581 PolarHBondContact O-N 2.99Å; N576-M581 VanDerWaalsContact O-N 3.09Å; M579-M581 HydrophobicContact CB-CG 3.83Å; M579-M581 PolarHBondContact O-N 2.81Å; M579-M581 VanDerWaalsContact O-N 3.12Å
582	L	46.8	Very low	53	Low	92 Å²	92	101.7 Å²	101.7	48%	0.482	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-60.1	135.7	174.1	-51.6	174.3	0	0	0	110	W586 L596	L582-W586 HydrophobicContact CB-CD2 4.47Å; L582-W586 HydrophobicContact CB-CE3 3.83Å; L582-W586 HydrophobicContact CB-CZ3 4.41Å; L582-W586 HydrophobicContact CD2-CE3 3.62Å; L582-W586 HydrophobicContact CD2-CZ3 3.5Å; L582-W586 HydrophobicContact CG-CE3 4.16Å; L582-W586 HydrophobicContact CG-CZ3 4.48Å; L582-L596 HydrophobicContact CD2-CD2 4.44Å
583	P	46.9	Very low	52.1	Low	45 Å²	45	102.7 Å²	102.7	29%	0.292	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-52.5	144	171.2	-27.5	34.7	0	0	0	112.6	E585 W586	P583-E585 PolarHBondContact O-N 3.02Å; P583-E585 VanDerWaalsContact O-N 3.07Å; P583-W586 HydrophobicContact CB-CG 4.44Å; P583-W586 HydrophobicContact CG-CD2 4.31Å; P583-W586 HydrophobicContact CG-CZ2 3.94Å; P583-W586 WeakPolarHBondContact O-CB 3.38Å; P583-W586 PolarHBondContact O-N 2.8Å
584	S	48.4	Very low	51.1	Low	71 Å²	71	105.8 Å²	105.8	50%	0.497	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.1	-176.5	59.5	0	0	0	0	114.6	R572 W586	R572-S584 VanDerWaalsContact NH1-CB 3.26Å; R572-S584 PolarHBondContact NH1-OG 2.88Å; R572-S584 PolarHBondContact NH2-OG 3.41Å; R572-S584 VanDerWaalsContact NH2-OG 3.09Å; S584-W586 PolarHBondContact O-N 3.31Å
585	E	54.7	Low	50	Low	137 Å²	137	104.2 Å²	104.2	64%	0.64	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-19	172.5	-66	110.6	-136	0	0	112.6	P583 S587	P583-E585 PolarHBondContact O-N 3.02Å; P583-E585 VanDerWaalsContact O-N 3.07Å; E585-S587 VanDerWaalsContact C-N 3.3Å; E585-S587 PolarHBondContact O-N 3.31Å
586	W	47.2	Very low	49.4	Very low	111 Å²	111	105.7 Å²	105.7	42%	0.42	52%	0.517	S	S	.	.			trans	-82.3	73.9	-173.2	-63	9.4	0	0	0	111.3	L582 P583 S584 T592	L582-W586 HydrophobicContact CB-CD2 4.47Å; L582-W586 HydrophobicContact CB-CE3 3.83Å; L582-W586 HydrophobicContact CB-CZ3 4.41Å; L582-W586 HydrophobicContact CD2-CE3 3.62Å; L582-W586 HydrophobicContact CD2-CZ3 3.5Å; L582-W586 HydrophobicContact CG-CE3 4.16Å; L582-W586 HydrophobicContact CG-CZ3 4.48Å; P583-W586 HydrophobicContact CB-CG 4.44Å; P583-W586 HydrophobicContact CG-CD2 4.31Å; P583-W586 HydrophobicContact CG-CZ2 3.94Å; P583-W586 WeakPolarHBondContact O-CB 3.38Å; P583-W586 PolarHBondContact O-N 2.8Å; S584-W586 PolarHBondContact O-N 3.31Å; W586-T592 HydrophobicContact CB-CG2 3.95Å; W586-T592 HydrophobicContact CD2-CG2 3.82Å; W586-T592 HydrophobicContact CE3-CG2 3.44Å; W586-T592 VanDerWaalsContact CE3-CG2 3.44Å; W586-T592 HydrophobicContact CG-CG2 4.05Å; W586-T592 HydrophobicContact CZ3-CG2 4.22Å
587	S	51.8	Low	48.9	Very low	106 Å²	106	109.4 Å²	109.4	74%	0.741	54%	0.54	S	S	*	.			trans	-96.3	-13.1	-174.8	55.4	0	0	0	0	115.4	E585	E585-S587 VanDerWaalsContact C-N 3.3Å; E585-S587 PolarHBondContact O-N 3.31Å
588	D	47.5	Very low	48.6	Very low	47 Å²	47	103.1 Å²	103.1	25%	0.251	52%	0.523	S	S	.	.			trans	-117.3	99.5	-176.2	-162.4	60.8	0	0	0	112.3	R469 R590 Q591 T592	R469-D588 IonicContact CZ-OD1 2.67Å; R469-D588 IonicContact NH1-OD1 3.94Å; R469-D588 PolarHBondContact NH1-OD1 2.79Å; R469-D588 IonicContact NH2-OD1 3.29Å; R469-D588 PolarHBondContact NH2-OD1 3.19Å; D588-R590 VanDerWaalsContact C-N 3.27Å; D588-R590 PolarHBondContact O-N 2.94Å; D588-Q591 PolarHBondContact O-N 3.2Å; D588-T592 PolarHBondContact O-N 3.38Å; D588-T592 PolarHBondContact O-OG1 3.31Å
589	S	49.2	Very low	47.5	Very low	84 Å²	84	101 Å²	101	59%	0.587	51%	0.509	S	S	*	.	H	α-helix	trans	-60.3	-27.6	-169.4	50.7	0	0	0	0	114.9	T592 L593	S589-T592 VanDerWaalsContact CA-OG1 3.25Å; S589-T592 WeakPolarHBondContact CA-OG1 3.44Å; S589-L593 WeakPolarHBondContact O-CB 3.17Å; S589-L593 PolarHBondContact O-N 3.07Å
590	R	40.3	Very low	47.4	Very low	195 Å²	195	101.7 Å²	101.7	74%	0.736	52%	0.515	S	S	*	.	H	α-helix	trans	-69.7	-41.7	178.5	-95.6	-176.2	165.4	-172.2	-4.8	112.5	D588	D588-R590 VanDerWaalsContact C-N 3.27Å; D588-R590 PolarHBondContact O-N 2.94Å
591	Q	53.4	Low	47.2	Very low	132 Å²	132	101 Å²	101	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-72.9	-37.3	174.3	-63	-170.3	15.9	0	0	111.2	D588 L593 Y594 Q595	D588-Q591 PolarHBondContact O-N 3.2Å; Q591-L593 VanDerWaalsContact C-N 3.35Å; Q591-L593 PolarHBondContact O-N 3.36Å; Q591-Y594 PolarHBondContact O-N 3.33Å; Q591-Q595 PolarHBondContact O-N 3.34Å
592	T	49.7	Very low	46.8	Very low	16 Å²	16	100.1 Å²	100.1	10%	0.098	51%	0.511	C	S	.	.	H	α-helix	trans	-65.3	-35.8	177.7	3.1	0	0	0	0	112.4	W586 D588 S589 Y594 Q595 L596	W586-T592 HydrophobicContact CB-CG2 3.95Å; W586-T592 HydrophobicContact CD2-CG2 3.82Å; W586-T592 HydrophobicContact CE3-CG2 3.44Å; W586-T592 VanDerWaalsContact CE3-CG2 3.44Å; W586-T592 HydrophobicContact CG-CG2 4.05Å; W586-T592 HydrophobicContact CZ3-CG2 4.22Å; D588-T592 PolarHBondContact O-N 3.38Å; D588-T592 PolarHBondContact O-OG1 3.31Å; S589-T592 VanDerWaalsContact CA-OG1 3.25Å; S589-T592 WeakPolarHBondContact CA-OG1 3.44Å; T592-Y594 PolarHBondContact O-N 2.95Å; T592-Q595 CarbonylContact O-C 3.4Å; T592-Q595 PolarHBondContact O-N 2.69Å; T592-Q595 VanDerWaalsContact O-N 3.17Å; T592-L596 HydrophobicContact CG2-CD1 4.37Å; T592-L596 VanDerWaalsContact O-CB 3.24Å; T592-L596 WeakPolarHBondContact O-CB 3.24Å; T592-L596 WeakPolarHBondContact O-CD1 3.34Å; T592-L596 WeakPolarHBondContact O-CG 3.32Å; T592-L596 PolarHBondContact O-N 3.45Å
593	L	45.6	Very low	46.3	Very low	107 Å²	107	101.8 Å²	101.8	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-57.9	-46.1	176.1	-102.8	160.6	0	0	0	112.5	S589 Q591 Q595 L596 V597	S589-L593 WeakPolarHBondContact O-CB 3.17Å; S589-L593 PolarHBondContact O-N 3.07Å; Q591-L593 VanDerWaalsContact C-N 3.35Å; Q591-L593 PolarHBondContact O-N 3.36Å; L593-Q595 VanDerWaalsContact C-N 3.3Å; L593-Q595 PolarHBondContact O-N 3.19Å; L593-L596 PolarHBondContact O-N 2.94Å; L593-V597 WeakPolarHBondContact O-CG2 3.44Å; L593-V597 PolarHBondContact O-N 3.12Å
594	Y	41.9	Very low	45.6	Very low	156 Å²	156	109 Å²	109	61%	0.612	54%	0.542	S	S	*	.	H	α-helix	trans	-66.4	-29.3	176.7	-95.4	-86.4	0	0	0	113.4	F319 Q591 T592 N598	F319-Y594 HydrophobicContact CE2-CE1 4.41Å; Q591-Y594 PolarHBondContact O-N 3.33Å; T592-Y594 PolarHBondContact O-N 2.95Å; Y594-N598 PolarHBondContact O-ND2 3.18Å
595	Q	48.1	Very low	44.9	Very low	89 Å²	89	111.1 Å²	111.1	42%	0.416	55%	0.554	S	S	.	*	H	α-helix	trans	-81.3	-32.6	174.6	-66.5	178.5	7.9	0	0	112.5	Q591 T592 L593 N598 R599 I602	Q591-Q595 PolarHBondContact O-N 3.34Å; T592-Q595 CarbonylContact O-C 3.4Å; T592-Q595 PolarHBondContact O-N 2.69Å; T592-Q595 VanDerWaalsContact O-N 3.17Å; L593-Q595 VanDerWaalsContact C-N 3.3Å; L593-Q595 PolarHBondContact O-N 3.19Å; Q595-N598 CarbonylContact O-C 3.53Å; Q595-N598 PolarHBondContact O-N 2.96Å; Q595-R599 PolarHBondContact O-N 2.99Å; Q595-I602 HydrophobicContact CB-CD1 3.93Å; Q595-I602 HydrophobicContact CG-CD1 4.39Å; Q595-I602 WeakPolarHBondContact O-CD1 3.29Å
596	L	49.4	Very low	43.8	Very low	66 Å²	66	111.9 Å²	111.9	35%	0.346	56%	0.562	S	S	.	*	H	α-helix	trans	-70.8	-39.5	176.9	-83.7	159.2	0	0	0	112.2	L582 T592 L593 N598 R599	L582-L596 HydrophobicContact CD2-CD2 4.44Å; T592-L596 HydrophobicContact CG2-CD1 4.37Å; T592-L596 VanDerWaalsContact O-CB 3.24Å; T592-L596 WeakPolarHBondContact O-CB 3.24Å; T592-L596 WeakPolarHBondContact O-CD1 3.34Å; T592-L596 WeakPolarHBondContact O-CG 3.32Å; T592-L596 PolarHBondContact O-N 3.45Å; L593-L596 PolarHBondContact O-N 2.94Å; L596-N598 PolarHBondContact O-N 3.35Å; L596-R599 VanDerWaalsContact O-CB 3.23Å; L596-R599 WeakPolarHBondContact O-CB 3.35Å; L596-R599 PolarHBondContact O-N 3.03Å
597	V	49.9	Very low	43.1	Very low	117 Å²	117	113.9 Å²	113.9	71%	0.709	58%	0.58	S	S	*	*	H	α-helix	trans	-68	-23.1	173.9	174.2	0	0	0	0	111.7	L593	L593-V597 WeakPolarHBondContact O-CG2 3.44Å; L593-V597 PolarHBondContact O-N 3.12Å
598	N	48.2	Very low	42.2	Very low	80 Å²	80	116 Å²	116	43%	0.428	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.7	17.7	174.6	-72.2	-67.9	0	0	0	113.7	Y594 Q595 L596 D600 V601	Y594-N598 PolarHBondContact O-ND2 3.18Å; Q595-N598 CarbonylContact O-C 3.53Å; Q595-N598 PolarHBondContact O-N 2.96Å; L596-N598 PolarHBondContact O-N 3.35Å; N598-D600 PolarHBondContact O-N 3.49Å; N598-D600 VanDerWaalsContact O-N 3.11Å; N598-V601 WeakPolarHBondContact O-CB 3.38Å; N598-V601 PolarHBondContact O-N 3.22Å
599	R	38.7	Very low	41.4	Very low	99 Å²	99	121.6 Å²	121.6	37%	0.374	61%	0.611	S	S	.	*	H	α-helix	trans	-59.6	-29.2	-169.3	-170.6	174.3	178.5	-174	-3	114	N580 Q595 L596 V601 I602	N580-R599 PolarHBondContact OD1-NH2 3.36Å; Q595-R599 PolarHBondContact O-N 2.99Å; L596-R599 VanDerWaalsContact O-CB 3.23Å; L596-R599 WeakPolarHBondContact O-CB 3.35Å; L596-R599 PolarHBondContact O-N 3.03Å; R599-V601 PolarHBondContact O-N 2.92Å; R599-I602 PolarHBondContact O-N 3.43Å
600	D	43.2	Very low	40.5	Very low	154 Å²	154	124.8 Å²	124.8	82%	0.824	62%	0.621	S	S	*	*	H	α-helix	trans	-67.2	-20.1	175.3	-67.6	-15.6	0	0	0	113.8	N598	N598-D600 PolarHBondContact O-N 3.49Å; N598-D600 VanDerWaalsContact O-N 3.11Å
601	V	41.3	Very low	40	Very low	101 Å²	101	118 Å²	118	61%	0.612	61%	0.613	S	S	*	*	H	α-helix	trans	-87.3	-28.5	176.9	-174.6	0	0	0	0	111.4	N598 R599	N598-V601 WeakPolarHBondContact O-CB 3.38Å; N598-V601 PolarHBondContact O-N 3.22Å; R599-V601 PolarHBondContact O-N 2.92Å
602	I	41	Very low	38.9	Very low	97 Å²	97	123.1 Å²	123.1	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-84	-22.2	-171	-60	176.9	0	0	0	112.5	Q595 R599 R604	Q595-I602 HydrophobicContact CB-CD1 3.93Å; Q595-I602 HydrophobicContact CG-CD1 4.39Å; Q595-I602 WeakPolarHBondContact O-CD1 3.29Å; R599-I602 PolarHBondContact O-N 3.43Å; I602-R604 VanDerWaalsContact C-N 3.25Å; I602-R604 PolarHBondContact O-N 2.86Å
603	L	36.9	Very low	37.8	Very low	127 Å²	127	129.6 Å²	129.6	67%	0.665	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	15.3	-178.5	-68.4	175.4	0	0	0	115.1
604	R	31.3	Very low	37	Very low	197 Å²	197	131.3 Å²	131.3	74%	0.743	67%	0.669	S	S	*	*	S	Bend	trans	-74.2	134.3	165.9	-72.1	-170.5	175.5	-150.1	-1.1	110.1	I602 N606	I602-R604 VanDerWaalsContact C-N 3.25Å; I602-R604 PolarHBondContact O-N 2.86Å; R604-N606 PolarHBondContact O-N 2.7Å
605	P	33.4	Very low	36.3	Very low	116 Å²	116	129.9 Å²	129.9	75%	0.753	68%	0.677	S	S	*	*			trans	-70.9	99.5	177.9	28.8	-33.6	0	0	0	110.2	I607	P605-I607 PolarHBondContact O-N 3.34Å
606	N	31.2	Very low	35.3	Very low	152 Å²	152	132.7 Å²	132.7	81%	0.813	70%	0.695	S	S	*	*			trans	-67.9	101.2	166	-79.4	-29.6	0	0	0	108.9	R604 L608	R604-N606 PolarHBondContact O-N 2.7Å; N606-L608 VanDerWaalsContact C-N 3.28Å; N606-L608 PolarHBondContact O-N 2.96Å
607	I	33.4	Very low	34.4	Very low	154 Å²	154	135.2 Å²	135.2	79%	0.79	72%	0.716	S	S	*	*			trans	-69.8	90	168.2	-58.6	173.3	0	0	0	107.1	P605 L609	P605-I607 PolarHBondContact O-N 3.34Å; I607-L609 PolarHBondContact O-N 2.9Å
608	L	31.7	Very low	33.3	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	72%	0.718	S	S	*	*			trans	-86.7	91.8	176.5	-154.6	159	0	0	0	108	N606 D610	N606-L608 VanDerWaalsContact C-N 3.28Å; N606-L608 PolarHBondContact O-N 2.96Å; L608-D610 PolarHBondContact O-N 3.21Å
609	L	32.2	Very low	32.4	Very low	164 Å²	164	139.3 Å²	139.3	86%	0.859	73%	0.734	S	S	*	*			trans	-77.6	107.2	174.7	-156.4	80.5	0	0	0	108.6	I607	I607-L609 PolarHBondContact O-N 2.9Å
610	D	30	Very low	32.1	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	75%	0.753	S	S	*	*			trans	-81.5	140.7	-179.6	-166.4	9.8	0	0	0	111.4	L608	L608-D610 PolarHBondContact O-N 3.21Å
611	G	30.4	Very low	31.5	Very low	54 Å²	54	140 Å²	140	56%	0.557	75%	0.749	S	S	*	*			trans	101.8	113.4	163.5	0	0	0	0	0	119
612	R	30.4	Very low	31	Very low	238 Å²	238	139.6 Å²	139.6	90%	0.898	75%	0.75	S	S	*	*			trans	84.4	95.7	140	-52.5	173.2	-166	176.5	5.4	119
613	N	26.1	Very low	30.7	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	76%	0.761	S	S	*	*				57.5	137.1	115.6	-85.2	-25.8	0	0	0	122.3
614	L	27.9	Very low	30.6	Very low	143 Å²	143	143.2 Å²	143.2	75%	0.749	77%	0.766	S	S	*	*			trans	74	94.2	158.7	-86.7	76.5	0	0	0	118.8
615	T	27.9	Very low	30.7	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	77%	0.766	S	S	*	*				47.7	134.5	119.6	59.8	0	0	0	0	121.4
616	N	27.2	Very low	30.7	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	77%	0.768	S	S	*	*			trans	82.1	95.3	142.9	-165.6	40.7	0	0	0	118.3
617	C	30.9	Very low	30.7	Very low	118 Å²	118	142.6 Å²	142.6	80%	0.797	77%	0.769	S	S	*	*				-170.4	153.2	103.6	47.7	0	0	0	0	111.7
618	N	27	Very low	30.6	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	78%	0.776	S	S	*	*			trans	-98.1	168.1	-179.1	-65.9	-46.3	0	0	0	112.2
619	N	29.4	Very low	30.5	Very low	143 Å²	143	143.5 Å²	143.5	77%	0.765	78%	0.777	S	S	*	*			trans	92.2	146.1	145.5	-68.3	-16.1	0	0	0	121.6
620	I	31.7	Very low	30.5	Very low	147 Å²	147	139.3 Å²	139.3	75%	0.754	77%	0.774	S	S	*	*			trans	80.9	81.1	158.5	-62.3	140.8	0	0	0	115.2
621	T	31.3	Very low	30.7	Very low	121 Å²	121	137.5 Å²	137.5	74%	0.742	77%	0.768	S	S	*	*				72.1	125.7	81.2	64.5	0	0	0	0	117.8
622	S	30.7	Very low	30.8	Very low	92 Å²	92	142.4 Å²	142.4	64%	0.643	78%	0.782	S	S	*	*			trans	90.8	138.6	140.5	101.7	0	0	0	0	122.4
623	E	34.8	Very low	30.9	Very low	156 Å²	156	140 Å²	140	73%	0.729	78%	0.78	S	S	*	*			trans	87.8	126.1	143.5	-77.3	158	-113.9	0	0	122.4
624	N	34	Very low	31.1	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	78%	0.783	S	S	*	*			trans	74.3	101.2	157.7	-47.6	-34.3	0	0	0	116.1
625	A	33.6	Very low	31.1	Very low	90 Å²	90	139.9 Å²	139.9	74%	0.744	79%	0.788	S	S	*	*				87.9	127.6	54	0	0	0	0	0	114.4
626	D	33.4	Very low	31.2	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	79%	0.789	S	S	*	*			trans	74.4	133.5	164	-65.8	-13.6	0	0	0	122
627	Y	30.6	Very low	31.4	Very low	213 Å²	213	137.6 Å²	137.6	84%	0.835	79%	0.789	S	S	*	*			trans	59.1	87.9	170.7	-63.4	-79.3	0	0	0	119.3
628	M	30.6	Very low	31.3	Very low	189 Å²	189	139.9 Å²	139.9	93%	0.931	79%	0.793	S	S	*	*			trans	-130.9	137.4	149.9	-91.6	-68.5	108.1	0	0	111.8
629	V	31.5	Very low	31.5	Very low	135 Å²	135	140.2 Å²	140.2	82%	0.818	79%	0.794	S	S	*	*			trans	-81.5	120.3	-175.9	170.5	0	0	0	0	109.9
630	G	32.2	Very low	31.7	Very low	76 Å²	76	139.5 Å²	139.5	78%	0.784	80%	0.795	S	S	*	*			trans	-90.5	110	170.3	0	0	0	0	0	111
631	T	32.8	Very low	31.7	Very low	112 Å²	112	135.5 Å²	135.5	69%	0.687	79%	0.79	S	S	*	*			trans	-63.6	152.6	167.3	51.3	0	0	0	0	111.2
632	N	33.3	Very low	31.7	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	80%	0.797	S	S	*	*				-178	144.4	127.2	-81.8	-18	0	0	0	108.8
633	E	33	Very low	31.9	Very low	186 Å²	186	135.7 Å²	135.7	87%	0.869	80%	0.802	S	S	*	*			trans	-83.5	174.9	-151.8	-58.8	-180	132.8	0	0	116.2
634	L	29	Very low	31.9	Very low	166 Å²	166	134.3 Å²	134.3	87%	0.869	80%	0.8	S	S	*	*			trans	87.3	57.6	169.1	-50.5	-177.3	0	0	0	117.8
635	C	28.8	Very low	32	Very low	128 Å²	128	138.2 Å²	138.2	87%	0.865	80%	0.804	S	S	*	*			trans	-147.8	151.9	144.2	-110	0	0	0	0	109.8
636	A	30.3	Very low	32.2	Very low	95 Å²	95	139 Å²	139	79%	0.785	80%	0.802	S	S	*	*			trans	68.8	147.2	-162.1	0	0	0	0	0	112.9
637	V	30.5	Very low	32.4	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	81%	0.805	S	S	*	*			cis	-134.5	130.8	23.8	167.9	0	0	0	0	111
638	L	28.6	Very low	32.6	Very low	166 Å²	166	134.7 Å²	134.7	87%	0.869	80%	0.797	S	S	*	*			trans	-76.8	157.2	158	-77.1	167.2	0	0	0	109.6
639	N	32.2	Very low	32.9	Very low	147 Å²	147	132.3 Å²	132.3	79%	0.786	79%	0.788	S	S	*	*			trans	91.3	117.6	158.7	-121.9	30.2	0	0	0	119
640	V	32.3	Very low	33.1	Very low	128 Å²	128	132.2 Å²	132.2	78%	0.776	78%	0.779	S	S	*	*			trans	66.2	108.3	137.3	-178.9	0	0	0	0	119.9
641	G	31.5	Very low	33.8	Very low	64 Å²	64	137.1 Å²	137.1	66%	0.66	78%	0.775	S	S	*	*				95.7	108.6	106	0	0	0	0	0	120.4
642	S	31.5	Very low	34.2	Very low	125 Å²	125	138.7 Å²	138.7	87%	0.874	78%	0.775	S	S	*	*			trans	67.8	115.6	134.3	-58.9	0	0	0	0	122.2
643	A	34.8	Very low	34.6	Very low	91 Å²	91	138 Å²	138	75%	0.752	77%	0.771	S	S	*	*				105	138	121	0	0	0	0	0	122
644	D	35.8	Very low	35.1	Very low	128 Å²	128	134 Å²	134	68%	0.684	77%	0.77	S	S	*	*			trans	74.2	95.4	152	-73.7	-43.3	0	0	0	123.4
645	R	35.9	Very low	35.9	Very low	225 Å²	225	133.9 Å²	133.9	85%	0.849	77%	0.77	S	S	*	*				96.3	140.9	113.4	-78.3	169.5	-171.9	-105.1	-1.1	122.1
646	P	37.6	Very low	36.3	Very low	108 Å²	108	131.2 Å²	131.2	70%	0.701	76%	0.764	S	S	*	*			trans	-106.6	175.5	176.7	43.1	-35.7	0	0	0	113.9
647	V	37	Very low	36.6	Very low	141 Å²	141	130.1 Å²	130.1	86%	0.855	76%	0.762	S	S	*	*			trans	-144.2	149.6	159.6	-180	0	0	0	0	109.4
648	D	35.5	Very low	37.1	Very low	128 Å²	128	131.1 Å²	131.1	68%	0.684	76%	0.762	S	S	*	*			trans	-101.2	-168	-159.4	-43.5	-85.8	0	0	0	115.8
649	N	36	Very low	37.8	Very low	139 Å²	139	129 Å²	129	74%	0.743	75%	0.752	S	S	*	*			trans	107.8	134.2	162.9	-56.6	-8	0	0	0	115.5
650	E	37.4	Very low	38.3	Very low	134 Å²	134	128.8 Å²	128.8	63%	0.626	75%	0.746	S	S	*	*			cis	145.9	158.1	-12.2	-96.1	-178.7	169.7	0	0	106.7
651	Y	46.3	Very low	38.6	Very low	179 Å²	179	129.5 Å²	129.5	70%	0.702	75%	0.745	S	S	*	*			trans	74.3	147.2	169.1	-55.1	-69.9	0	0	0	119.6
652	E	41.3	Very low	38.8	Very low	145 Å²	145	138.1 Å²	138.1	68%	0.678	76%	0.758	S	S	*	*			cis	-171.3	150	-36.4	-122.2	174.9	-156.9	0	0	109.4
653	D	40.8	Very low	39.1	Very low	142 Å²	142	139.1 Å²	139.1	76%	0.759	75%	0.753	S	S	*	*			trans	59.3	159.4	140.7	-67.6	-1.5	0	0	0	127.2
654	A	44	Very low	39.7	Very low	102 Å²	102	143.3 Å²	143.3	84%	0.843	76%	0.756	S	S	*	*			trans	83.9	144.3	158.2	0	0	0	0	0	120
655	D	45.3	Very low	40.1	Very low	165 Å²	165	144.6 Å²	144.6	88%	0.882	76%	0.759	S	S	*	*			cis	-170.3	160.6	-20.1	-177.9	26.4	0	0	0	109.4
656	G	38.9	Very low	40.6	Very low	72 Å²	72	141 Å²	141	74%	0.742	76%	0.756	S	S	*	*			trans	77.2	150.6	166.1	0	0	0	0	0	117.1
657	G	36.4	Very low	41.1	Very low	72 Å²	72	141.9 Å²	141.9	74%	0.742	76%	0.755	S	S	*	*			cis	175.8	125.8	-3.8	0	0	0	0	0	107.4
658	L	39.2	Very low	41.6	Very low	153 Å²	153	141.6 Å²	141.6	80%	0.801	75%	0.749	S	S	*	*				93.5	117.3	90.6	-169.1	118.6	0	0	0	113.2
659	D	43.9	Very low	42.2	Very low	120 Å²	120	142.7 Å²	142.7	64%	0.642	76%	0.755	S	S	*	*			trans	67.8	153.8	153.2	-71.9	-2.1	0	0	0	120.1
660	Q	42.5	Very low	42.6	Very low	143 Å²	143	143.3 Å²	143.3	67%	0.668	76%	0.758	S	S	*	*			cis	-160.2	146.5	0.6	-117.7	164.1	56	0	0	110.6
661	L	38.6	Very low	43	Very low	144 Å²	144	144.7 Å²	144.7	75%	0.754	77%	0.769	S	S	*	*			trans	48.5	118.8	142.3	-58.2	165.1	0	0	0	122.2
662	R	35.7	Very low	42.8	Very low	245 Å²	245	143.3 Å²	143.3	93%	0.925	77%	0.774	S	S	*	*				-167	137.5	114.4	-125.4	175.2	170.8	-178.3	-5.9	114.7
663	N	39.1	Very low	42.9	Very low	145 Å²	145	144 Å²	144	78%	0.775	78%	0.782	S	S	*	*			trans	-90.2	140.5	176.1	-61.6	-12.1	0	0	0	112.5
664	H	47.4	Very low	43.1	Very low	179 Å²	179	140.8 Å²	140.8	83%	0.829	78%	0.776	S	S	*	*			trans	-151.1	109.7	141.2	-78.9	-26.9	0	0	0	103.7
665	Q	43.4	Very low	42.9	Very low	156 Å²	156	142.7 Å²	142.7	73%	0.729	77%	0.77	S	S	*	*				70.5	111.8	66.1	-162.5	168.3	3.4	0	0	111
666	D	46.9	Very low	42.6	Very low	149 Å²	149	141 Å²	141	80%	0.797	76%	0.76	S	S	*	*			trans	162.2	93.2	160.5	-79.8	-12.6	0	0	0	107.5
667	D	46.8	Very low	42.5	Very low	127 Å²	127	141.6 Å²	141.6	68%	0.679	75%	0.751	S	S	*	*				36	135.6	112.6	-50.1	-1.8	0	0	0	117
668	D	48.8	Very low	42.4	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	75%	0.752	S	S	*	*			cis	-161	169.5	11.3	-91.2	-32.6	0	0	0	111.7
669	D	46.7	Very low	42.4	Very low	151 Å²	151	147.2 Å²	147.2	81%	0.807	75%	0.751	S	S	*	*			trans	69.2	116.5	153.1	-62.4	-23.5	0	0	0	123.4
670	D	45.2	Very low	41.7	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	76%	0.764	S	S	*	*			trans	-68.3	155.4	161.1	-54.3	-73.7	0	0	0	111.7
671	D	46.2	Very low	41.4	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	76%	0.756	S	S	*	*				-158	154.8	90.1	-101.5	-35.3	0	0	0	112.7	D673	D671-D673 PolarHBondContact O-N 2.95Å
672	D	40.8	Very low	41	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	76%	0.759	S	S	*	*			trans	-75.1	109.5	-166.5	-72.4	-65.3	0	0	0	117	A674	D672-A674 PolarHBondContact O-N 3.25Å
673	D	44.3	Very low	40.8	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	75%	0.746	S	S	*	*			trans	-88.8	68.7	161.5	-115.1	-19.8	0	0	0	111.2	D671 I675	D671-D673 PolarHBondContact O-N 2.95Å; D673-I675 PolarHBondContact O-N 3.27Å
674	A	44.6	Very low	40.6	Very low	76 Å²	76	140.5 Å²	140.5	63%	0.628	75%	0.746	S	S	*	*			trans	-70.6	82.6	-178.6	0	0	0	0	0	112.9	D672 I676	D672-A674 PolarHBondContact O-N 3.25Å; A674-I676 PolarHBondContact O-N 2.87Å
675	I	39.5	Very low	39.8	Very low	141 Å²	141	139.4 Å²	139.4	72%	0.723	75%	0.747	S	S	*	*			trans	-69.6	87.1	174.4	-58.7	175.1	0	0	0	110.6	D673 P677	D673-I675 PolarHBondContact O-N 3.27Å; I675-P677 WeakPolarHBondContact O-CD 3.45Å
676	I	38.8	Very low	39.4	Very low	130 Å²	130	137.2 Å²	137.2	67%	0.667	76%	0.755	S	S	*	*			trans	-78.6	118.1	169.2	-56.7	177.3	0	0	0	109	A674 F678	A674-I676 PolarHBondContact O-N 2.87Å; I676-F678 HydrophobicContact CG2-CD2 4.38Å; I676-F678 PolarHBondContact O-N 2.98Å
677	P	37.3	Very low	38.8	Very low	85 Å²	85	133.4 Å²	133.4	55%	0.552	75%	0.752	S	S	*	*			trans	-77.3	108.1	175.3	-5.9	23.7	0	0	0	109.6	I675 E679	I675-P677 WeakPolarHBondContact O-CD 3.45Å; P677-E679 PolarHBondContact O-N 2.64Å
678	F	35.2	Very low	38.3	Very low	172 Å²	172	138.7 Å²	138.7	75%	0.754	76%	0.764	S	S	*	*			trans	-94.6	91.1	-178.8	-137.9	-88.8	0	0	0	111.9	I676 A681	I676-F678 HydrophobicContact CG2-CD2 4.38Å; I676-F678 PolarHBondContact O-N 2.98Å; F678-A681 HydrophobicContact CE1-CB 4.03Å; F678-A681 HydrophobicContact CZ-CB 4.2Å
679	E	37.8	Very low	38	Very low	170 Å²	170	140 Å²	140	79%	0.794	77%	0.771	S	S	*	*			trans	-131.8	135.5	164.5	-158.2	169.3	-150.7	0	0	107.7	P677	P677-E679 PolarHBondContact O-N 2.64Å
680	C	30.6	Very low	37.5	Very low	133 Å²	133	140.8 Å²	140.8	90%	0.899	78%	0.775	S	S	*	*			trans	67	76.6	-175.2	-63.6	0	0	0	0	118.7
681	A	35.6	Very low	37.2	Very low	61 Å²	61	136.9 Å²	136.9	50%	0.504	77%	0.77	S	S	.	*			trans	-143.4	112.3	142.7	0	0	0	0	0	109.1	F678	F678-A681 HydrophobicContact CE1-CB 4.03Å; F678-A681 HydrophobicContact CZ-CB 4.2Å
682	F	29.7	Very low	36.8	Very low	186 Å²	186	138 Å²	138	82%	0.816	77%	0.77	S	S	*	*				57.8	95.8	104.6	-102.5	-110.5	0	0	0	112.9
683	T	32.6	Very low	36.7	Very low	106 Å²	106	138.6 Å²	138.6	65%	0.65	77%	0.772	S	S	*	*				46.9	127.6	88.1	67.9	0	0	0	0	115.4
684	Q	35	Very low	36.3	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.794	77%	0.77	S	S	*	*			trans	95	121.6	163.5	-61.1	179.6	-24.5	0	0	119.2
685	N	29.7	Very low	36.4	Very low	157 Å²	157	141.2 Å²	141.2	84%	0.84	78%	0.781	S	S	*	*			trans	65.1	97.2	138.3	-65.5	24.5	0	0	0	121.4
686	A	35.6	Very low	36.7	Very low	109 Å²	109	142.7 Å²	142.7	90%	0.901	79%	0.787	S	S	*	*				-171.4	136.8	123.2	0	0	0	0	0	108.4
687	G	34.9	Very low	37.6	Very low	70 Å²	70	145.4 Å²	145.4	72%	0.722	80%	0.797	S	S	*	*			cis	-175.7	118.1	-10.9	0	0	0	0	0	106.9	N689	G687-N689 PolarHBondContact O-N 3.46Å
688	Y	36.3	Very low	38.5	Very low	238 Å²	238	149.2 Å²	149.2	93%	0.933	81%	0.811	S	S	*	*			trans	-71.5	121	178.8	-82	-98.4	0	0	0	109.4
689	N	41.3	Very low	40	Very low	163 Å²	163	148.9 Å²	148.9	87%	0.872	82%	0.816	S	S	*	*			trans	-113.6	116	157	-87.5	-29.2	0	0	0	107.6	G687	G687-N689 PolarHBondContact O-N 3.46Å
690	D	36	Very low	41.3	Very low	167 Å²	167	145.8 Å²	145.8	89%	0.893	81%	0.813	S	S	*	*			trans	-69.9	151.1	178.8	-162.6	-0.1	0	0	0	110.7
691	G	39.6	Very low	43.1	Very low	69 Å²	69	146 Å²	146	71%	0.711	80%	0.801	S	S	*	*			trans	-164.4	40.2	-158	0	0	0	0	0	115.1
692	E	38.4	Very low	44.8	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	81%	0.812	S	S	*	*			trans	59.9	116.7	152.1	-154.6	163.4	-173.5	0	0	119
693	L	36.9	Very low	46.8	Very low	162 Å²	162	147.3 Å²	147.3	85%	0.848	81%	0.814	S	S	*	*			trans	-66.3	132.5	176.5	-73.8	116.5	0	0	0	113.9
694	T	36.9	Very low	48.5	Very low	131 Å²	131	150.1 Å²	150.1	80%	0.804	82%	0.817	S	S	*	*			trans	-144.2	127.1	137.1	54.2	0	0	0	0	110.7
695	D	46.6	Very low	50.3	Low	160 Å²	160	148.1 Å²	148.1	86%	0.856	82%	0.816	S	S	*	*			trans	48.4	68	164.3	-63.5	-13.1	0	0	0	118.6	E697	D695-E697 PolarHBondContact O-N 3.39Å; D695-E697 VanDerWaalsContact O-N 3.12Å
696	M	46.5	Very low	52.4	Low	172 Å²	172	144.5 Å²	144.5	85%	0.847	81%	0.808	S	S	*	*			trans	-74	93.9	155.8	-74.2	-72.4	-76	0	0	109.7	L698	M696-L698 PolarHBondContact O-N 3.32Å
697	E	57.1	Low	54.1	Low	186 Å²	186	151 Å²	151	87%	0.869	81%	0.81	S	S	*	*			trans	-54.1	109.2	174.4	-172.3	174.7	-177.2	0	0	110.5	D695 I699	D695-E697 PolarHBondContact O-N 3.39Å; D695-E697 VanDerWaalsContact O-N 3.12Å; E697-I699 PolarHBondContact O-N 2.83Å
698	L	57.1	Low	56	Low	165 Å²	165	154.5 Å²	154.5	86%	0.864	81%	0.81	S	S	*	*			trans	-66.6	108.5	-175.9	-70.8	171.9	0	0	0	110.3	M696 S700	M696-L698 PolarHBondContact O-N 3.32Å; L698-S700 PolarHBondContact O-N 3.12Å; L698-S700 VanDerWaalsContact O-N 3.16Å
699	I	64.9	Low	57.8	Low	166 Å²	166	151.7 Å²	151.7	85%	0.851	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-51.6	122.2	173.8	-61	170.4	0	0	0	108.9	E697	E697-I699 PolarHBondContact O-N 2.83Å
700	S	66.6	Low	59.3	Low	104 Å²	104	150.2 Å²	150.2	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-61.2	138.3	-175.4	56.9	0	0	0	0	111.6	L698	L698-S700 PolarHBondContact O-N 3.12Å; L698-S700 VanDerWaalsContact O-N 3.16Å
701	Q	67.3	Low	60.9	Low	138 Å²	138	146.2 Å²	146.2	65%	0.645	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-58	128.4	-179.5	176.7	166.1	88.7	0	0	110.2
702	P	71	Confident	62.5	Low	113 Å²	113	149.7 Å²	149.7	73%	0.734	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60.3	143.6	179.9	22.7	-33.3	0	0	0	111.7	K704	P702-K704 PolarHBondContact O-N 2.73Å; P702-K704 VanDerWaalsContact O-N 3.15Å
703	N	72.5	Confident	63.9	Low	162 Å²	162	145.2 Å²	145.2	87%	0.866	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-54.8	117.1	-173.5	-87.3	-29.3	0	0	0	112.6	V705	N703-V705 PolarHBondContact O-N 3.16Å
704	K	68.6	Low	65.5	Low	165 Å²	165	146.8 Å²	146.8	72%	0.717	78%	0.777	S	S	*	*			trans	-76.8	102.9	171	-69.8	174.2	177.4	158.2	0	109.5	P702	P702-K704 PolarHBondContact O-N 2.73Å; P702-K704 VanDerWaalsContact O-N 3.15Å
705	V	72	Confident	67	Low	127 Å²	127	146 Å²	146	77%	0.77	77%	0.772	S	S	*	*			trans	-66.7	143.5	168.9	-174.8	0	0	0	0	109.1	N703	N703-V705 PolarHBondContact O-N 3.16Å
706	A	75	Confident	68.1	Low	82 Å²	82	142.1 Å²	142.1	68%	0.678	76%	0.762	S	S	*	*			trans	-58.3	141.8	177.9	0	0	0	0	0	111.4	I708	A706-I708 PolarHBondContact O-N 2.98Å
707	R	71.7	Confident	69.4	Low	246 Å²	246	140.8 Å²	140.8	93%	0.928	75%	0.751	S	S	*	*			trans	-64.8	108.9	172	-90.3	-176.2	165.9	176.1	-3.4	109.4	E709	R707-E709 PolarHBondContact O-N 3.46Å
708	I	74.8	Confident	70.2	Confident	142 Å²	142	139.7 Å²	139.7	73%	0.728	75%	0.748	S	S	*	*			trans	-77.6	114.1	167.2	-58.5	172.1	0	0	0	107.2	A706 I710	A706-I708 PolarHBondContact O-N 2.98Å; I708-I710 VanDerWaalsContact C-N 3.31Å; I708-I710 HydrophobicContact CG2-CG1 4.14Å; I708-I710 PolarHBondContact O-N 3.18Å
709	E	73.3	Confident	71.4	Confident	180 Å²	180	133.2 Å²	133.2	84%	0.841	71%	0.714	S	S	*	*			trans	-75.4	85.1	172	-68.3	-160.4	147.1	0	0	110.1	R707 G711	R707-E709 PolarHBondContact O-N 3.46Å; E709-G711 PolarHBondContact O-N 3.17Å
710	I	73.1	Confident	72.4	Confident	131 Å²	131	129.4 Å²	129.4	67%	0.672	70%	0.696	S	S	*	*			trans	-65.8	119.5	166.6	-56.2	176.6	0	0	0	107.4	I708 Y712	I708-I710 VanDerWaalsContact C-N 3.31Å; I708-I710 HydrophobicContact CG2-CG1 4.14Å; I708-I710 PolarHBondContact O-N 3.18Å; I710-Y712 VanDerWaalsContact O-CD1 3.22Å; I710-Y712 WeakPolarHBondContact O-CD1 3.5Å; I710-Y712 PolarHBondContact O-N 2.79Å
711	G	69.6	Low	73.4	Confident	83 Å²	83	127.8 Å²	127.8	86%	0.856	68%	0.681	S	S	*	*			trans	-73.4	65.7	-179.2	0	0	0	0	0	113.4	E709	E709-G711 PolarHBondContact O-N 3.17Å
712	Y	72.2	Confident	74.4	Confident	143 Å²	143	128.5 Å²	128.5	56%	0.561	68%	0.684	S	S	*	*			trans	-71.8	146	173.8	62.7	-91.4	0	0	0	111.6	I710 R714	I710-Y712 VanDerWaalsContact O-CD1 3.22Å; I710-Y712 WeakPolarHBondContact O-CD1 3.5Å; I710-Y712 PolarHBondContact O-N 2.79Å; Y712-R714 HydrophobicContact CD2-CG 4.08Å; Y712-R714 HydrophobicContact CE2-CG 3.69Å; Y712-R714 PolarHBondContact O-N 2.9Å; Y712-R714 VanDerWaalsContact O-N 3.15Å; Y712-R714 PolarHBondContact OH-NH1 3.5Å; Y712-R714 VanDerWaalsContact OH-NH1 3.16Å
713	A	67.5	Low	75.1	Confident	92 Å²	92	129.9 Å²	129.9	76%	0.76	68%	0.675	S	S	*	*			trans	-65.1	114.4	172.7	0	0	0	0	0	109.8	T715	A713-T715 PolarHBondContact O-N 2.76Å
714	R	70.7	Confident	76	Confident	195 Å²	195	122.1 Å²	122.1	74%	0.736	63%	0.634	S	S	*	*	S	Bend	trans	-79.4	-3.3	178	-65.1	179.8	-177.9	-95.4	2.7	113.8	Y712	Y712-R714 HydrophobicContact CD2-CG 4.08Å; Y712-R714 HydrophobicContact CE2-CG 3.69Å; Y712-R714 PolarHBondContact O-N 2.9Å; Y712-R714 VanDerWaalsContact O-N 3.15Å; Y712-R714 PolarHBondContact OH-NH1 3.5Å; Y712-R714 VanDerWaalsContact OH-NH1 3.16Å
715	T	68.4	Low	77	Confident	115 Å²	115	115.7 Å²	115.7	71%	0.706	61%	0.606	S	S	*	*	S	Bend	trans	-139.2	128.3	-175.2	-48	0	0	0	0	108.4	A713	A713-T715 PolarHBondContact O-N 2.76Å
716	A	70.4	Confident	77.8	Confident	78 Å²	78	114 Å²	114	65%	0.645	60%	0.599	S	S	*	*			trans	-69.7	147.8	171.9	0	0	0	0	0	110.6	M718	A716-M718 PolarHBondContact O-N 2.91Å
717	K	73.5	Confident	78.4	Confident	143 Å²	143	111.2 Å²	111.2	62%	0.622	58%	0.575	S	S	*	*			trans	-63.5	131.2	167.4	-67.9	-177.3	178.8	-177.3	0	108.8	E823	K717-E823 VanDerWaalsContact CA-OE2 3.27Å; K717-E823 WeakPolarHBondContact CA-OE2 3.23Å; K717-E823 WeakPolarHBondContact CB-OE2 3.37Å; K717-E823 HydrophobicContact CG-CG 4.43Å
718	M	73.2	Confident	79.3	Confident	164 Å²	164	99.5 Å²	99.5	81%	0.808	53%	0.531	S	S	*	.			trans	-122	86.7	-174.6	-70.2	-164.2	76.9	0	0	110.9	A716 E823	A716-M718 PolarHBondContact O-N 2.91Å; M718-E823 PolarHBondContact N-OE2 3.47Å
719	I	82.2	Confident	79.9	Confident	29 Å²	29	94.1 Å²	94.1	15%	0.149	50%	0.501	C	S	.	.			trans	-101.8	122.2	179.1	-63.6	177.1	0	0	0	109.6	V721 L724 M820 E823 I828	I719-V721 PolarHBondContact O-N 2.86Å; I719-L724 HydrophobicContact CG2-CD2 3.92Å; I719-M820 HydrophobicContact CG2-CE 3.82Å; I719-M820 HydrophobicContact CG2-CG 4.26Å; I719-E823 HydrophobicContact CD1-CB 3.91Å; I719-E823 HydrophobicContact CG1-CB 3.98Å; I719-I828 HydrophobicContact CD1-CD1 3.71Å; I719-I828 HydrophobicContact CD1-CG2 4.02Å; I719-I828 HydrophobicContact CG2-CG2 4.3Å
720	N	85.9	Confident	80.4	Confident	86 Å²	86	86.6 Å²	86.6	46%	0.46	47%	0.472	S	S	.	.			trans	-74.5	93.9	173	-175.5	-45.3	0	0	0	110.1	Q722 R723 L724 M820	N720-Q722 VanDerWaalsContact C-N 3.28Å; N720-Q722 PolarHBondContact O-N 2.83Å; N720-Q722 PolarHBondContact OD1-N 3.41Å; N720-R723 HydrophobicContact CB-CB 4.12Å; N720-R723 PolarHBondContact O-N 3.02Å; N720-R723 WeakPolarHBondContact OD1-CB 3.34Å; N720-R723 PolarHBondContact OD1-N 2.82Å; N720-L724 PolarHBondContact O-N 3.41Å; N720-M820 HydrophobicContact CB-CE 3.87Å; N720-M820 WeakPolarHBondContact O-CE 3.39Å
721	V	88.8	Confident	80.9	Confident	69 Å²	69	81.1 Å²	81.1	42%	0.418	44%	0.443	S	S	.	.	H	α-helix	trans	-56.2	-39.2	-177.2	177.6	0	0	0	0	112.4	I719 L724 K725	I719-V721 PolarHBondContact O-N 2.86Å; V721-L724 PolarHBondContact O-N 3.18Å; V721-K725 HydrophobicContact CG1-CD 3.92Å; V721-K725 HydrophobicContact CG1-CG 4.37Å; V721-K725 WeakPolarHBondContact O-CB 3.48Å; V721-K725 WeakPolarHBondContact O-CG 3.5Å; V721-K725 PolarHBondContact O-N 3.35Å
722	Q	87.9	Confident	81.6	Confident	153 Å²	153	77.2 Å²	77.2	72%	0.715	40%	0.403	S	S	*	.	H	α-helix	trans	-61.7	-48.7	177.2	-68.7	178.3	-15.8	0	0	111.5	N720 L724 K725 C726	N720-Q722 VanDerWaalsContact C-N 3.28Å; N720-Q722 PolarHBondContact O-N 2.83Å; N720-Q722 PolarHBondContact OD1-N 3.41Å; Q722-L724 VanDerWaalsContact C-N 3.31Å; Q722-L724 PolarHBondContact O-N 2.93Å; Q722-K725 PolarHBondContact O-N 3.21Å; Q722-C726 WeakPolarHBondContact O-CB 3.22Å; Q722-C726 PolarHBondContact O-N 3.08Å; Q722-C726 PolarHBondContact O-SG 3.44Å
723	R	86.1	Confident	81.9	Confident	142 Å²	142	73 Å²	73	54%	0.536	39%	0.388	S	S	.	.	H	α-helix	trans	-64	-36.7	178.3	-174.3	175.1	-177.7	165.7	2	112	N720 A727 M820	N720-R723 HydrophobicContact CB-CB 4.12Å; N720-R723 PolarHBondContact O-N 3.02Å; N720-R723 WeakPolarHBondContact OD1-CB 3.34Å; N720-R723 PolarHBondContact OD1-N 2.82Å; R723-A727 WeakPolarHBondContact O-CB 3.43Å; R723-A727 PolarHBondContact O-N 3.19Å; R723-M820 HydrophobicContact CB-CE 4.35Å
724	L	90.3	Very high	81.8	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-65	-48.5	175.9	-172.1	60.1	0	0	0	111.3	I719 N720 V721 Q722 C726 A727 M728 L812 I816 M820 L824 I828	I719-L724 HydrophobicContact CG2-CD2 3.92Å; N720-L724 PolarHBondContact O-N 3.41Å; V721-L724 PolarHBondContact O-N 3.18Å; Q722-L724 VanDerWaalsContact C-N 3.31Å; Q722-L724 PolarHBondContact O-N 2.93Å; L724-C726 PolarHBondContact O-N 2.97Å; L724-A727 PolarHBondContact O-N 3.16Å; L724-M728 WeakPolarHBondContact O-CB 3.47Å; L724-M728 PolarHBondContact O-N 3.16Å; L724-L812 HydrophobicContact CD1-CD1 4.29Å; L724-L812 HydrophobicContact CD1-CD2 3.69Å; L724-L812 HydrophobicContact CD1-CG 4.12Å; L724-I816 HydrophobicContact CD1-CG2 4.04Å; L724-M820 HydrophobicContact CB-CE 4.05Å; L724-M820 HydrophobicContact CB-SD 4.38Å; L724-M820 HydrophobicContact CD1-SD 4.2Å; L724-L824 HydrophobicContact CD1-CD1 4Å; L724-L824 HydrophobicContact CD2-CD1 3.68Å; L724-I828 HydrophobicContact CD2-CG2 3.97Å
725	K	90.9	Very high	81	Confident	30 Å²	30	68 Å²	68	13%	0.13	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-42.9	175	-73.7	174.3	62.6	-173.9	0	112.4	V721 Q722 M728 W729 C832 H835 L836 E839	V721-K725 HydrophobicContact CG1-CD 3.92Å; V721-K725 HydrophobicContact CG1-CG 4.37Å; V721-K725 WeakPolarHBondContact O-CB 3.48Å; V721-K725 WeakPolarHBondContact O-CG 3.5Å; V721-K725 PolarHBondContact O-N 3.35Å; Q722-K725 PolarHBondContact O-N 3.21Å; K725-M728 PolarHBondContact O-N 3.07Å; K725-W729 VanDerWaalsContact O-CB 3.25Å; K725-W729 WeakPolarHBondContact O-CB 3.49Å; K725-W729 PolarHBondContact O-N 3.2Å; K725-C832 HydrophobicContact CG-CB 3.91Å; K725-H835 HydrophobicContact CD-CB 4.2Å; K725-L836 HydrophobicContact CB-CD2 4.19Å; K725-L836 HydrophobicContact CB-CG 4.33Å; K725-L836 HydrophobicContact CG-CG 4.29Å; K725-E839 WeakPolarHBondContact CE-OE2 3.45Å; K725-E839 IonicContact NZ-OE1 2.93Å; K725-E839 PolarHBondContact NZ-OE1 2.93Å; K725-E839 IonicContact NZ-OE2 2.75Å; K725-E839 PolarHBondContact NZ-OE2 2.92Å
726	C	88.6	Confident	79.6	Confident	92 Å²	92	66.9 Å²	66.9	62%	0.622	35%	0.353	S	S	*	.	H	α-helix	trans	-63.3	-40.6	175.7	-70.5	0	0	0	0	112.5	Q722 L724 G730	Q722-C726 WeakPolarHBondContact O-CB 3.22Å; Q722-C726 PolarHBondContact O-N 3.08Å; Q722-C726 PolarHBondContact O-SG 3.44Å; L724-C726 PolarHBondContact O-N 2.97Å; C726-G730 PolarHBondContact O-N 3.3Å
727	A	87.7	Confident	78	Confident	22 Å²	22	67.7 Å²	67.7	18%	0.182	35%	0.352	C	S	.	.	H	α-helix	trans	-67.1	-42.1	176.8	0	0	0	0	0	112.1	R723 L724 G730 F731 L812 R815 I816	R723-A727 WeakPolarHBondContact O-CB 3.43Å; R723-A727 PolarHBondContact O-N 3.19Å; L724-A727 PolarHBondContact O-N 3.16Å; A727-G730 PolarHBondContact O-N 2.68Å; A727-F731 PolarHBondContact O-N 3.23Å; A727-F731 VanDerWaalsContact O-N 3.07Å; A727-L812 HydrophobicContact CB-CD1 3.7Å; A727-R815 HydrophobicContact CB-CB 4.45Å; A727-I816 HydrophobicContact CB-CG2 4.1Å
728	M	89.4	Confident	76.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-68.6	-43.8	178	-171.4	155.3	73	0	0	112.2	L724 K725 G730 F731 L732 V808 L812 C832 L833 L836	L724-M728 WeakPolarHBondContact O-CB 3.47Å; L724-M728 PolarHBondContact O-N 3.16Å; K725-M728 PolarHBondContact O-N 3.07Å; M728-G730 VanDerWaalsContact C-N 3.34Å; M728-G730 PolarHBondContact O-N 3.43Å; M728-F731 PolarHBondContact O-N 3.45Å; M728-L732 WeakPolarHBondContact O-CG 3.44Å; M728-L732 PolarHBondContact O-N 2.87Å; M728-L732 VanDerWaalsContact O-N 3.08Å; M728-V808 HydrophobicContact CG-CG1 3.62Å; M728-V808 HydrophobicContact SD-CG1 3.71Å; M728-L812 HydrophobicContact CB-CD1 4.19Å; M728-L812 HydrophobicContact CB-CD2 4.44Å; M728-L812 HydrophobicContact SD-CD2 4.25Å; M728-C832 VanDerWaalsContact CE-C 3.44Å; M728-C832 HydrophobicContact CE-CB 3.68Å; M728-L833 HydrophobicContact CE-CB 3.79Å; M728-L833 HydrophobicContact CE-CD1 4.47Å; M728-L833 VanDerWaalsContact CE-N 3.28Å; M728-L836 HydrophobicContact CB-CD1 4.09Å; M728-L836 HydrophobicContact CE-CD1 3.76Å; M728-L836 HydrophobicContact CG-CD1 4.14Å
729	W	88.2	Confident	74.4	Confident	30 Å²	30	67.8 Å²	67.8	11%	0.114	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-42.1	172.2	-179.6	-102.8	0	0	0	112	K725 F731 L732 E733 K798 V799 L836 K840 L842	K725-W729 VanDerWaalsContact O-CB 3.25Å; K725-W729 WeakPolarHBondContact O-CB 3.49Å; K725-W729 PolarHBondContact O-N 3.2Å; W729-F731 VanDerWaalsContact C-N 3.28Å; W729-F731 PolarHBondContact O-N 3.36Å; W729-L732 HydrophobicContact CE3-CD1 4.45Å; W729-L732 PolarHBondContact O-N 3.4Å; W729-E733 PolarHBondContact NE1-OE2 3.03Å; W729-E733 WeakPolarHBondContact O-CB 3.46Å; W729-E733 PolarHBondContact O-N 3.19Å; W729-K798 HydrophobicContact CH2-CB 4.44Å; W729-K798 HydrophobicContact CZ2-CB 4.25Å; W729-K798 HydrophobicContact CZ2-CD 4.09Å; W729-V799 HydrophobicContact CH2-CG2 4.04Å; W729-V799 HydrophobicContact CZ3-CG2 4.05Å; W729-L836 HydrophobicContact CB-CD1 4.15Å; W729-L836 HydrophobicContact CB-CD2 4.16Å; W729-K840 HydrophobicContact CD2-CD 4.17Å; W729-K840 HydrophobicContact CD2-CG 4.07Å; W729-K840 HydrophobicContact CE3-CB 4.04Å; W729-K840 HydrophobicContact CE3-CD 4.16Å; W729-K840 HydrophobicContact CE3-CG 3.59Å; W729-K840 HydrophobicContact CH2-CB 3.85Å; W729-K840 HydrophobicContact CH2-CD 4.09Å; W729-K840 HydrophobicContact CH2-CG 4Å; W729-K840 HydrophobicContact CZ2-CD 4.1Å; W729-K840 HydrophobicContact CZ2-CG 4.44Å; W729-K840 HydrophobicContact CZ3-CB 3.47Å; W729-K840 VanDerWaalsContact CZ3-CB 3.47Å; W729-K840 HydrophobicContact CZ3-CD 4.1Å; W729-K840 HydrophobicContact CZ3-CG 3.54Å; W729-L842 HydrophobicContact CZ3-CD1 4.48Å; W729-L842 HydrophobicContact CZ3-CD2 4.14Å
730	G	84.8	Confident	71.8	Confident	21 Å²	21	69.6 Å²	69.6	22%	0.216	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-33	175.4	0	0	0	0	0	113.5	C726 A727 M728 H734	C726-G730 PolarHBondContact O-N 3.3Å; A727-G730 PolarHBondContact O-N 2.68Å; M728-G730 VanDerWaalsContact C-N 3.34Å; M728-G730 PolarHBondContact O-N 3.43Å; G730-H734 WeakPolarHBondContact O-CB 3.44Å; G730-H734 PolarHBondContact O-CD2 3.49Å; G730-H734 PolarHBondContact O-N 2.97Å
731	F	83.2	Confident	69.4	Low	17 Å²	17	72.9 Å²	72.9	8%	0.075	40%	0.403	C	S	.	.	H	α-helix	trans	-70.1	-43.5	172.5	-179.4	-100.8	0	0	0	112.1	A727 M728 W729 E733 H734 T735 E807 V808 N811	A727-F731 PolarHBondContact O-N 3.23Å; A727-F731 VanDerWaalsContact O-N 3.07Å; M728-F731 PolarHBondContact O-N 3.45Å; W729-F731 VanDerWaalsContact C-N 3.28Å; W729-F731 PolarHBondContact O-N 3.36Å; F731-E733 VanDerWaalsContact C-N 3.34Å; F731-E733 PolarHBondContact O-N 2.83Å; F731-H734 PolarHBondContact O-N 2.98Å; F731-T735 HydrophobicContact CD2-CG2 4.29Å; F731-T735 HydrophobicContact CE1-CG2 4.48Å; F731-T735 HydrophobicContact CE2-CG2 3.85Å; F731-T735 HydrophobicContact CZ-CG2 3.96Å; F731-T735 PolarHBondContact O-N 2.68Å; F731-E807 HydrophobicContact CZ-CG 4.28Å; F731-V808 HydrophobicContact CD1-CB 4.38Å; F731-V808 HydrophobicContact CD1-CG1 4.35Å; F731-V808 HydrophobicContact CD1-CG2 3.94Å; F731-V808 HydrophobicContact CE1-CB 4.41Å; F731-V808 HydrophobicContact CE1-CG2 3.87Å; F731-N811 HydrophobicContact CD2-CB 3.8Å; F731-N811 HydrophobicContact CE1-CB 4.46Å; F731-N811 HydrophobicContact CE2-CB 3.36Å; F731-N811 VanDerWaalsContact CE2-CG 3.48Å; F731-N811 HydrophobicContact CZ-CB 3.74Å; F731-N811 WeakPolarHBondContact CZ-ND2 3.02Å
732	L	83.5	Confident	66.5	Low	1 Å²	1	77.4 Å²	77.4	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-64.5	-34.7	176.8	-66.8	171.1	0	0	0	112.7	M728 W729 V799 V808 L842 I855	M728-L732 WeakPolarHBondContact O-CG 3.44Å; M728-L732 PolarHBondContact O-N 2.87Å; M728-L732 VanDerWaalsContact O-N 3.08Å; W729-L732 HydrophobicContact CE3-CD1 4.45Å; W729-L732 PolarHBondContact O-N 3.4Å; L732-V799 HydrophobicContact CB-CG2 3.94Å; L732-V799 HydrophobicContact CD2-CG1 4.5Å; L732-V808 HydrophobicContact CD2-CG2 4.15Å; L732-L842 HydrophobicContact CD1-CD1 3.94Å; L732-I855 HydrophobicContact CD1-CG2 4.38Å; L732-I855 HydrophobicContact CD2-CD1 4.49Å; L732-I855 HydrophobicContact CD2-CG2 4.15Å
733	E	79.3	Confident	63.9	Low	53 Å²	53	77.2 Å²	77.2	25%	0.248	43%	0.427	C	S	.	.	H	α-helix	trans	-83.1	-28.1	178.7	-174.1	163.2	-161.5	0	0	113.5	W729 F731 K798	W729-E733 PolarHBondContact NE1-OE2 3.03Å; W729-E733 WeakPolarHBondContact O-CB 3.46Å; W729-E733 PolarHBondContact O-N 3.19Å; F731-E733 VanDerWaalsContact C-N 3.34Å; F731-E733 PolarHBondContact O-N 2.83Å; E733-K798 HydrophobicContact CG-CB 4.5Å; E733-K798 WeakPolarHBondContact OE1-CD 3.35Å; E733-K798 WeakPolarHBondContact OE1-CE 3.46Å; E733-K798 IonicContact OE1-NZ 3.37Å; E733-K798 PolarHBondContact OE1-NZ 3.41Å; E733-K798 IonicContact OE2-NZ 2.88Å
734	H	64.3	Low	61.2	Low	142 Å²	142	75.9 Å²	75.9	66%	0.657	44%	0.436	S	S	*	.	H	α-helix	trans	-103.9	6.3	-172.6	-65.7	-49.4	0	0	0	116.7	G730 F731 V736	G730-H734 WeakPolarHBondContact O-CB 3.44Å; G730-H734 PolarHBondContact O-CD2 3.49Å; G730-H734 PolarHBondContact O-N 2.97Å; F731-H734 PolarHBondContact O-N 2.98Å; H734-V736 PolarHBondContact O-N 2.83Å
735	T	54.9	Low	58.4	Low	40 Å²	40	80.6 Å²	80.6	25%	0.245	47%	0.47	C	S	.	.			trans	-82.2	61.2	167.2	51.1	0	0	0	0	111.6	F731 P737 R803	F731-T735 HydrophobicContact CD2-CG2 4.29Å; F731-T735 HydrophobicContact CE1-CG2 4.48Å; F731-T735 HydrophobicContact CE2-CG2 3.85Å; F731-T735 HydrophobicContact CZ-CG2 3.96Å; F731-T735 PolarHBondContact O-N 2.68Å; T735-P737 WeakPolarHBondContact O-CD 3.25Å; T735-R803 PolarHBondContact O-NH2 2.76Å; T735-R803 PolarHBondContact OG1-NE 3.08Å; T735-R803 VanDerWaalsContact OG1-NE 3.17Å; T735-R803 PolarHBondContact OG1-NH2 3.13Å
736	V	39.3	Very low	55.8	Low	92 Å²	92	87.4 Å²	87.4	56%	0.558	50%	0.502	S	S	*	.			trans	-87.1	112.1	170.3	176.3	0	0	0	0	108.8	H734 H738	H734-V736 PolarHBondContact O-N 2.83Å; V736-H738 PolarHBondContact O-N 3.2Å
737	P	37.2	Very low	53	Low	96 Å²	96	87.9 Å²	87.9	62%	0.623	51%	0.506	S	S	*	.			trans	-68	122.6	159	-4.4	21.8	0	0	0	106.8	T735 V739	T735-P737 WeakPolarHBondContact O-CD 3.25Å; P737-V739 VanDerWaalsContact C-N 3.25Å; P737-V739 PolarHBondContact O-N 3.43Å
738	H	33.8	Very low	50.6	Low	183 Å²	183	92.2 Å²	92.2	85%	0.847	53%	0.533	S	S	*	.			trans	-64.9	89.3	168.8	-76.3	-73.2	0	0	0	109.2	V736 G740	V736-H738 PolarHBondContact O-N 3.2Å; H738-G740 PolarHBondContact O-N 2.97Å
739	V	35.5	Very low	47.9	Very low	126 Å²	126	99.2 Å²	99.2	76%	0.764	57%	0.569	S	S	*	*			trans	-64.3	104.5	170.2	177.1	0	0	0	0	107.2	P737 L741	P737-V739 VanDerWaalsContact C-N 3.25Å; P737-V739 PolarHBondContact O-N 3.43Å; V739-L741 PolarHBondContact O-N 3.19Å
740	G	29.4	Very low	45.1	Very low	67 Å²	67	103 Å²	103	69%	0.691	60%	0.6	S	S	*	*			trans	-66.8	95.4	-172.8	0	0	0	0	0	112.5	H738 N742	H738-G740 PolarHBondContact O-N 2.97Å; G740-N742 PolarHBondContact O-N 3.35Å; G740-N742 VanDerWaalsContact O-N 3.09Å
741	L	33.7	Very low	42.7	Very low	155 Å²	155	108.8 Å²	108.8	81%	0.812	63%	0.631	S	S	*	*			trans	-74.5	93.2	161.6	-74.1	174.7	0	0	0	109.1	V739 I743	V739-L741 PolarHBondContact O-N 3.19Å; L741-I743 PolarHBondContact O-N 3.42Å; L741-I743 VanDerWaalsContact O-N 3.08Å
742	N	28.1	Very low	40.3	Very low	163 Å²	163	111.9 Å²	111.9	87%	0.872	66%	0.66	S	S	*	*			trans	-58.3	107.1	167.2	-83.4	-31.7	0	0	0	110.2	G740	G740-N742 PolarHBondContact O-N 3.35Å; G740-N742 VanDerWaalsContact O-N 3.09Å
743	I	34	Very low	37.9	Very low	150 Å²	150	117.8 Å²	117.8	77%	0.769	70%	0.701	S	S	*	*			trans	-127.2	116.9	162.9	-57.8	178.1	0	0	0	106.9	L741	L741-I743 PolarHBondContact O-N 3.42Å; L741-I743 VanDerWaalsContact O-N 3.08Å
744	P	28.6	Very low	35.7	Very low	113 Å²	113	121.3 Å²	121.3	73%	0.734	73%	0.726	S	S	*	*			trans	-87.5	161.1	-171.2	34.2	-35.6	0	0	0	113.6
745	S	32.9	Very low	34.4	Very low	100 Å²	100	121.1 Å²	121.1	70%	0.699	74%	0.735	S	S	*	*			trans	116.6	132.3	146.1	85.2	0	0	0	0	118.5
746	Q	36.2	Very low	33.5	Very low	173 Å²	173	124.8 Å²	124.8	81%	0.808	76%	0.763	S	S	*	*			trans	78.7	82.8	151.1	-65.9	172.6	70.1	0	0	120
747	S	30.2	Very low	33.4	Very low	101 Å²	101	125.2 Å²	125.2	71%	0.706	78%	0.775	S	S	*	*				11.4	144.4	126	59.6	0	0	0	0	120.1
748	P	35.5	Very low	33.5	Very low	114 Å²	114	125.7 Å²	125.7	74%	0.74	78%	0.779	S	S	*	*				-118.4	132.9	89.6	-3.9	24	0	0	0	113.1
749	L	32.9	Very low	33.7	Very low	147 Å²	147	124.5 Å²	124.5	77%	0.77	78%	0.779	S	S	*	*				58.4	100.4	103.2	-65.5	163.3	0	0	0	113.2
750	S	30.3	Very low	33.8	Very low	108 Å²	108	122.5 Å²	122.5	76%	0.755	78%	0.775	S	S	*	*				66.4	134.2	90.3	-57.2	0	0	0	0	112.7
751	V	34.9	Very low	34	Very low	144 Å²	144	126.9 Å²	126.9	87%	0.873	78%	0.783	S	S	*	*			cis	-147.3	160.9	42.3	178.2	0	0	0	0	111.1
752	A	31.8	Very low	34.2	Very low	82 Å²	82	124.6 Å²	124.6	68%	0.678	78%	0.78	S	S	*	*			trans	-75.8	157	-177	0	0	0	0	0	115.7
753	S	32.2	Very low	34.5	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	78%	0.778	S	S	*	*			trans	-79.6	118.3	164.7	-56.8	0	0	0	0	111.3
754	T	33.8	Very low	35.1	Very low	127 Å²	127	122.3 Å²	122.3	78%	0.779	77%	0.772	S	S	*	*			trans	-121.7	136.7	163.7	52.1	0	0	0	0	109.3
755	T	37.3	Very low	35.6	Very low	138 Å²	138	123.9 Å²	123.9	85%	0.847	77%	0.774	S	S	*	*			trans	-133.1	99.6	175.7	53.9	0	0	0	0	111.2
756	S	36	Very low	35.7	Very low	118 Å²	118	125 Å²	125	83%	0.825	77%	0.772	S	S	*	*			trans	-153	88.6	160.3	-2.8	0	0	0	0	110.9
757	A	36.9	Very low	35.7	Very low	100 Å²	100	123.7 Å²	123.7	83%	0.826	77%	0.766	S	S	*	*			trans	64.3	164.7	161.4	0	0	0	0	0	118.3
758	P	40.2	Very low	35.7	Very low	107 Å²	107	124.7 Å²	124.7	70%	0.695	77%	0.768	S	S	*	*			cis	-128.3	166.6	-3.9	39.2	-22.7	0	0	0	116.3
759	D	36.9	Very low	35.4	Very low	158 Å²	158	124.4 Å²	124.4	85%	0.845	77%	0.769	S	S	*	*			trans	58.2	130.7	140.9	-60	-20.3	0	0	0	125.9
760	A	37.2	Very low	35.2	Very low	84 Å²	84	125 Å²	125	69%	0.694	77%	0.772	S	S	*	*			trans	84.5	91.3	134.7	0	0	0	0	0	122.1
761	N	34.8	Very low	35.2	Very low	158 Å²	158	126.8 Å²	126.8	85%	0.845	77%	0.773	S	S	*	*				67.6	133.8	121.4	-68.6	-16.7	0	0	0	123
762	S	37.1	Very low	35	Very low	108 Å²	108	125 Å²	125	76%	0.755	76%	0.762	S	S	*	*			trans	74.6	135.5	155.4	133.9	0	0	0	0	115.8
763	L	35.3	Very low	34.9	Very low	159 Å²	159	127.9 Å²	127.9	83%	0.832	77%	0.766	S	S	*	*			cis	-146.6	-174.8	8.9	-147.8	74.8	0	0	0	111
764	V	45.2	Very low	34.8	Very low	106 Å²	106	130 Å²	130	64%	0.642	76%	0.763	S	S	*	*			trans	-86.6	175.6	-162	-69	0	0	0	0	116.4
765	D	40.4	Very low	34.5	Very low	146 Å²	146	130.1 Å²	130.1	78%	0.781	76%	0.758	S	S	*	*			trans	77.9	141.1	160.8	-49.9	-33.3	0	0	0	117.2
766	D	34.2	Very low	34.1	Very low	122 Å²	122	131 Å²	131	65%	0.652	75%	0.753	S	S	*	*			cis	-151.6	156.4	8.6	-157.6	4.2	0	0	0	114.1
767	Q	36.9	Very low	33.8	Very low	147 Å²	147	133.4 Å²	133.4	69%	0.687	75%	0.751	S	S	*	*			trans	22.7	119.9	152.3	-83.2	169.8	94.1	0	0	120.3
768	T	30.3	Very low	33.2	Very low	122 Å²	122	135.3 Å²	135.3	75%	0.748	74%	0.743	S	S	*	*				173.9	161.3	63.5	29.2	0	0	0	0	112.2
769	S	27.8	Very low	32.6	Very low	107 Å²	107	138.2 Å²	138.2	75%	0.748	74%	0.741	S	S	*	*			trans	105.5	139.2	161.4	79.5	0	0	0	0	118.4
770	L	30	Very low	32.3	Very low	159 Å²	159	135.3 Å²	135.3	83%	0.832	73%	0.731	S	S	*	*			trans	62.8	111.7	174.8	-46.4	177.4	0	0	0	114.4
771	N	30.1	Very low	31.7	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	73%	0.734	S	S	*	*				-172.7	159.7	75.1	-126.8	-11	0	0	0	113.4
772	V	30	Very low	31.5	Very low	106 Å²	106	137.9 Å²	137.9	64%	0.642	73%	0.73	S	S	*	*			trans	50.9	110.8	142.8	175.5	0	0	0	0	118.4
773	N	30.4	Very low	31	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	73%	0.733	S	S	*	*				-164.7	150.3	111.1	-99.4	-40.3	0	0	0	114.1
774	E	29.2	Very low	30.7	Very low	168 Å²	168	140.7 Å²	140.7	79%	0.785	73%	0.732	S	S	*	*			trans	-37.2	133.3	173.1	-54.5	166.9	131.1	0	0	115
775	N	27.8	Very low	30.2	Very low	129 Å²	129	142.1 Å²	142.1	69%	0.69	74%	0.74	S	S	*	*			trans	-178	123.3	140.8	-100.4	-57.5	0	0	0	113.8
776	Q	29	Very low	30	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.734	74%	0.741	S	S	*	*			trans	63.8	176.7	141	-59.9	172.2	41.1	0	0	119.3
777	Q	30.6	Very low	29.7	Very low	168 Å²	168	145.2 Å²	145.2	79%	0.785	75%	0.75	S	S	*	*			trans	71.3	109.1	173	-58	155.5	34.4	0	0	113
778	Q	23.6	Very low	29.3	Very low	140 Å²	140	143.8 Å²	143.8	65%	0.654	76%	0.756	S	S	*	*			cis	52.4	127	30	-160.9	174.7	25.2	0	0	113.5
779	Y	27.2	Very low	29.4	Very low	169 Å²	169	145.2 Å²	145.2	66%	0.663	76%	0.759	S	S	*	*			trans	109.7	146.9	175.6	-63.9	-63	0	0	0	115.4
780	P	31.2	Very low	29.7	Very low	96 Å²	96	144.8 Å²	144.8	62%	0.623	76%	0.756	S	S	*	*			trans	-130.7	-152.6	-136	35.5	-12.6	0	0	0	112
781	M	24.5	Very low	29.5	Very low	153 Å²	153	140.6 Å²	140.6	75%	0.754	75%	0.751	S	S	*	*			trans	71.8	147.7	170.4	-30	-76.6	-75.1	0	0	113
782	N	31.7	Very low	29.4	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	76%	0.758	S	S	*	*			cis	-150.6	163	28	-68.3	-78.8	0	0	0	110.4
783	E	26.9	Very low	29.7	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	77%	0.77	S	S	*	*			trans	-69.5	174.9	154	-72.8	162.3	122.6	0	0	111.3
784	D	28.5	Very low	30	Very low	151 Å²	151	144.5 Å²	144.5	81%	0.807	76%	0.762	S	S	*	*			trans	78.2	149.8	165.6	-58.7	-31.9	0	0	0	120.4
785	V	34.1	Very low	30.7	Very low	136 Å²	136	147.8 Å²	147.8	82%	0.824	77%	0.769	S	S	*	*			trans	63	124.1	173.8	-118.1	0	0	0	0	114.4
786	I	35.3	Very low	31.7	Very low	156 Å²	156	148 Å²	148	80%	0.8	77%	0.77	S	S	*	*			cis	-142.7	136.4	32.1	-72.4	160.9	0	0	0	111.4
787	E	29.2	Very low	32.9	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	75%	0.753	S	S	*	*			trans	-73	162.3	169.4	-173.7	177.5	-154.4	0	0	112.2
788	S	28.9	Very low	34.3	Very low	117 Å²	117	140.8 Å²	140.8	82%	0.818	74%	0.739	S	S	*	*			trans	74.2	106.3	168.6	71.5	0	0	0	0	119.3
789	D	31.9	Very low	36	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	71%	0.709	S	S	*	*				-155	151.9	108.3	-158.6	-7.1	0	0	0	110.7
790	S	33.4	Very low	37.3	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	71%	0.706	S	S	*	*			trans	-9.3	131.1	166.4	50.7	0	0	0	0	117.8
791	G	26.5	Very low	38.9	Very low	71 Å²	71	130 Å²	130	73%	0.732	70%	0.699	S	S	*	*			cis	79.7	102.2	39.9	0	0	0	0	0	110.3
792	R	28.6	Very low	41.1	Very low	248 Å²	248	125.2 Å²	125.2	94%	0.936	68%	0.684	S	S	*	*			trans	97.2	67.2	177.8	-159.5	-169.8	-162.2	171.3	4.5	116.9
793	T	35	Very low	43.5	Very low	145 Å²	145	120.3 Å²	120.3	89%	0.89	65%	0.654	S	S	*	*			trans	-117.1	131.5	147.5	52.2	0	0	0	0	109.6
794	S	37.1	Very low	46.3	Very low	86 Å²	86	112.2 Å²	112.2	60%	0.601	62%	0.618	S	S	*	*			trans	-93.9	156.7	-157.6	47.3	0	0	0	0	114.9	L796	S794-L796 VanDerWaalsContact C-N 3.31Å; S794-L796 PolarHBondContact O-N 3.38Å
795	Y	43.6	Very low	49.3	Very low	236 Å²	236	105.7 Å²	105.7	93%	0.925	58%	0.583	S	S	*	*			trans	-58.1	73.1	177.3	-22.7	-89.8	0	0	0	113.6
796	L	49.2	Very low	51.8	Low	135 Å²	135	102 Å²	102	71%	0.707	56%	0.563	S	S	*	*			trans	-108.2	137	165.4	-80.7	164.9	0	0	0	109	S794 K798	S794-L796 VanDerWaalsContact C-N 3.31Å; S794-L796 PolarHBondContact O-N 3.38Å; L796-K798 PolarHBondContact O-N 2.95Å
797	P	54.5	Low	54.2	Low	61 Å²	61	98.5 Å²	98.5	40%	0.396	54%	0.543	S	S	.	.			trans	-61.2	131.5	173.6	26.9	-33	0	0	0	109	H800	P797-H800 PolarHBondContact O-CE1 3Å
798	K	58.6	Low	57	Low	111 Å²	111	90 Å²	90	48%	0.483	50%	0.504	S	S	.	.	S	Bend	trans	-91.2	-35.6	-179.2	-72.3	179	157.9	-140.3	0	111.2	W729 E733 L796 H800	W729-K798 HydrophobicContact CH2-CB 4.44Å; W729-K798 HydrophobicContact CZ2-CB 4.25Å; W729-K798 HydrophobicContact CZ2-CD 4.09Å; E733-K798 HydrophobicContact CG-CB 4.5Å; E733-K798 WeakPolarHBondContact OE1-CD 3.35Å; E733-K798 WeakPolarHBondContact OE1-CE 3.46Å; E733-K798 IonicContact OE1-NZ 3.37Å; E733-K798 PolarHBondContact OE1-NZ 3.41Å; E733-K798 IonicContact OE2-NZ 2.88Å; L796-K798 PolarHBondContact O-N 2.95Å; K798-H800 PolarHBondContact O-ND1 3.1Å
799	V	60.3	Low	59.8	Low	3 Å²	3	86.3 Å²	86.3	2%	0.018	47%	0.474	C	S	.	.	S	Bend	trans	-85	117.1	172.7	-168.5	0	0	0	0	109.4	W729 L732 L842 Q857	W729-V799 HydrophobicContact CH2-CG2 4.04Å; W729-V799 HydrophobicContact CZ3-CG2 4.05Å; L732-V799 HydrophobicContact CB-CG2 3.94Å; L732-V799 HydrophobicContact CD2-CG1 4.5Å; V799-L842 HydrophobicContact CG2-CD2 4Å; V799-Q857 HydrophobicContact CB-CB 3.71Å; V799-Q857 HydrophobicContact CG2-CB 3.99Å
800	H	53.6	Low	62.4	Low	130 Å²	130	84.7 Å²	84.7	60%	0.602	47%	0.465	S	S	*	.			trans	-102.4	107.8	179.5	-74.1	71.3	0	0	0	111.2	P797 K798 R803	P797-H800 PolarHBondContact O-CE1 3Å; K798-H800 PolarHBondContact O-ND1 3.1Å; H800-R803 PolarHBondContact O-NH1 2.77Å; H800-R803 PolarHBondContact O-NH2 3.39Å
801	G	65.2	Low	64.7	Low	46 Å²	46	83.6 Å²	83.6	47%	0.474	45%	0.452	S	S	.	.	S	Bend	trans	87.9	165.2	179.5	0	0	0	0	0	114
802	A	70.9	Confident	67.5	Low	53 Å²	53	80.3 Å²	80.3	44%	0.438	42%	0.418	S	S	.	.			trans	-67.2	145.1	172.8	0	0	0	0	0	111.2	Y854 I855	A802-Y854 HydrophobicContact CB-CD1 4.06Å; A802-Y854 HydrophobicContact CB-CG 4.44Å; A802-I855 CarbonylContact C-O 3.58Å; A802-I855 VanDerWaalsContact CA-O 3.32Å; A802-I855 WeakPolarHBondContact CA-O 3.44Å
803	R	81.7	Confident	69.9	Low	40 Å²	40	71.7 Å²	71.7	15%	0.151	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.8	170.9	-68.5	-69.9	-178	-76.8	-10.5	109.4	T735 H800 E807 Y854 I855	T735-R803 PolarHBondContact O-NH2 2.76Å; T735-R803 PolarHBondContact OG1-NE 3.08Å; T735-R803 VanDerWaalsContact OG1-NE 3.17Å; T735-R803 PolarHBondContact OG1-NH2 3.13Å; H800-R803 PolarHBondContact O-NH1 2.77Å; H800-R803 PolarHBondContact O-NH2 3.39Å; R803-E807 WeakPolarHBondContact CD-OE2 3.14Å; R803-Y854 CarbonylContact O-C 3.6Å; R803-Y854 WeakPolarHBondContact O-CA 3.37Å; R803-I855 PolarHBondContact N-O 3.49Å; R803-I855 PolarHBondContact O-N 3.22Å
804	G	86.8	Confident	72.1	Confident	6 Å²	6	68.1 Å²	68.1	6%	0.062	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	139.3	171.7	0	0	0	0	0	110.7	S806 E807 V808 D852	G804-S806 PolarHBondContact O-N 3.2Å; G804-E807 WeakPolarHBondContact O-CB 3.3Å; G804-E807 PolarHBondContact O-N 3.19Å; G804-V808 WeakPolarHBondContact O-CG2 3.18Å; G804-V808 PolarHBondContact O-N 3.41Å; G804-V808 VanDerWaalsContact O-N 3.16Å; G804-D852 WeakPolarHBondContact CA-OD2 3.42Å
805	F	90.4	Very high	74.1	Confident	13 Å²	13	72.5 Å²	72.5	6%	0.057	39%	0.391	C	S	.	.	H	α-helix	trans	-64.7	-30.5	174.2	175.1	-122.9	0	0	0	111.6	V808 I809 I826 A829 L830 L833 D852 I853 I855	F805-V808 WeakPolarHBondContact O-CB 3.09Å; F805-V808 PolarHBondContact O-N 3.25Å; F805-I809 HydrophobicContact CD1-CD1 4.04Å; F805-I809 HydrophobicContact CD2-CD1 4.45Å; F805-I809 HydrophobicContact CD2-CG1 4.42Å; F805-I809 HydrophobicContact CE1-CD1 3.61Å; F805-I809 HydrophobicContact CE2-CD1 4.06Å; F805-I809 HydrophobicContact CE2-CG1 4.09Å; F805-I809 HydrophobicContact CG-CD1 4.46Å; F805-I809 HydrophobicContact CZ-CD1 3.61Å; F805-I809 HydrophobicContact CZ-CG1 4.14Å; F805-I809 WeakPolarHBondContact O-CG1 3.23Å; F805-I809 PolarHBondContact O-N 2.79Å; F805-I826 HydrophobicContact CE1-CG2 3.94Å; F805-A829 HydrophobicContact CE2-CB 4.02Å; F805-A829 HydrophobicContact CZ-CB 3.83Å; F805-L830 HydrophobicContact CE1-CB 4.26Å; F805-L830 HydrophobicContact CE1-CD1 4.3Å; F805-L830 HydrophobicContact CZ-CB 3.85Å; F805-L830 HydrophobicContact CZ-CD1 4.3Å; F805-L833 HydrophobicContact CD2-CD2 3.69Å; F805-L833 HydrophobicContact CE2-CB 4.47Å; F805-L833 HydrophobicContact CE2-CD2 4.01Å; F805-L833 HydrophobicContact CG-CD2 4.29Å; F805-D852 WeakPolarHBondContact CA-OD1 3.49Å; F805-D852 WeakPolarHBondContact CB-OD1 3.1Å; F805-D852 PolarHBondContact N-OD1 2.83Å; F805-I853 HydrophobicContact CB-CB 4.05Å; F805-I853 WeakPolarHBondContact CB-O 3.49Å; F805-I853 PolarHBondContact N-O 2.89Å; F805-I855 HydrophobicContact CB-CD1 4.22Å; F805-I855 HydrophobicContact CD2-CD1 4.38Å
806	S	87.8	Confident	76.1	Confident	59 Å²	59	62 Å²	62	41%	0.413	35%	0.35	S	S	.	.	H	α-helix	trans	-54.3	-52.8	167.9	63.9	0	0	0	0	112.4	G804 V808 I809 D810 D852	G804-S806 PolarHBondContact O-N 3.2Å; S806-V808 VanDerWaalsContact C-N 3.27Å; S806-V808 PolarHBondContact O-N 3.34Å; S806-I809 PolarHBondContact O-N 3.27Å; S806-I809 VanDerWaalsContact O-N 3.15Å; S806-D810 PolarHBondContact O-N 2.67Å; S806-D852 WeakPolarHBondContact CB-OD2 3.44Å; S806-D852 PolarHBondContact N-OD1 2.89Å; S806-D852 PolarHBondContact OG-OD2 3.24Å
807	E	86	Confident	77.7	Confident	82 Å²	82	57.5 Å²	57.5	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-37.9	176.9	-172.5	-168.9	178.5	0	0	111.7	F731 R803 G804 N811	F731-E807 HydrophobicContact CZ-CG 4.28Å; R803-E807 WeakPolarHBondContact CD-OE2 3.14Å; G804-E807 WeakPolarHBondContact O-CB 3.3Å; G804-E807 PolarHBondContact O-N 3.19Å; E807-N811 WeakPolarHBondContact O-CB 3.19Å; E807-N811 PolarHBondContact O-N 3.46Å; E807-N811 PolarHBondContact O-ND2 3.05Å
808	V	87.8	Confident	79.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-48.1	175.5	177.1	0	0	0	0	110.9	M728 F731 L732 G804 F805 S806 N811 L812 I855	M728-V808 HydrophobicContact CG-CG1 3.62Å; M728-V808 HydrophobicContact SD-CG1 3.71Å; F731-V808 HydrophobicContact CD1-CB 4.38Å; F731-V808 HydrophobicContact CD1-CG1 4.35Å; F731-V808 HydrophobicContact CD1-CG2 3.94Å; F731-V808 HydrophobicContact CE1-CB 4.41Å; F731-V808 HydrophobicContact CE1-CG2 3.87Å; L732-V808 HydrophobicContact CD2-CG2 4.15Å; G804-V808 WeakPolarHBondContact O-CG2 3.18Å; G804-V808 PolarHBondContact O-N 3.41Å; G804-V808 VanDerWaalsContact O-N 3.16Å; F805-V808 WeakPolarHBondContact O-CB 3.09Å; F805-V808 PolarHBondContact O-N 3.25Å; S806-V808 VanDerWaalsContact C-N 3.27Å; S806-V808 PolarHBondContact O-N 3.34Å; V808-N811 PolarHBondContact O-N 3Å; V808-L812 WeakPolarHBondContact O-CB 3.34Å; V808-L812 PolarHBondContact O-N 3.4Å; V808-I855 HydrophobicContact CG2-CD1 3.88Å
809	I	88.2	Confident	80.1	Confident	39 Å²	39	63.6 Å²	63.6	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-48.7	179.9	-72.5	171.5	0	0	0	111.3	F805 S806 N811 L812 S813 I826 A829	F805-I809 HydrophobicContact CD1-CD1 4.04Å; F805-I809 HydrophobicContact CD2-CD1 4.45Å; F805-I809 HydrophobicContact CD2-CG1 4.42Å; F805-I809 HydrophobicContact CE1-CD1 3.61Å; F805-I809 HydrophobicContact CE2-CD1 4.06Å; F805-I809 HydrophobicContact CE2-CG1 4.09Å; F805-I809 HydrophobicContact CG-CD1 4.46Å; F805-I809 HydrophobicContact CZ-CD1 3.61Å; F805-I809 HydrophobicContact CZ-CG1 4.14Å; F805-I809 WeakPolarHBondContact O-CG1 3.23Å; F805-I809 PolarHBondContact O-N 2.79Å; S806-I809 PolarHBondContact O-N 3.27Å; S806-I809 VanDerWaalsContact O-N 3.15Å; I809-N811 VanDerWaalsContact C-N 3.34Å; I809-N811 PolarHBondContact O-N 2.86Å; I809-L812 PolarHBondContact O-N 3.16Å; I809-S813 PolarHBondContact O-N 3.25Å; I809-I826 HydrophobicContact CD1-CG1 4.43Å; I809-I826 HydrophobicContact CD1-CG2 4.4Å; I809-A829 HydrophobicContact CD1-CB 4.42Å; I809-A829 HydrophobicContact CG1-CB 4.22Å
810	D	84.9	Confident	81.1	Confident	117 Å²	117	63.9 Å²	63.9	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-59.8	-45.4	-177.4	-79.3	-15.7	0	0	0	111.3	S806 S813	S806-D810 PolarHBondContact O-N 2.67Å; D810-S813 PolarHBondContact O-OG 2.9Å
811	N	83.3	Confident	82.5	Confident	75 Å²	75	59.4 Å²	59.4	40%	0.401	33%	0.334	S	S	.	.	H	α-helix	trans	-73.8	-29.9	177.9	-75.1	-74.2	0	0	0	113.5	F731 E807 V808 I809 S813 G814	F731-N811 HydrophobicContact CD2-CB 3.8Å; F731-N811 HydrophobicContact CE1-CB 4.46Å; F731-N811 HydrophobicContact CE2-CB 3.36Å; F731-N811 VanDerWaalsContact CE2-CG 3.48Å; F731-N811 HydrophobicContact CZ-CB 3.74Å; F731-N811 WeakPolarHBondContact CZ-ND2 3.02Å; E807-N811 WeakPolarHBondContact O-CB 3.19Å; E807-N811 PolarHBondContact O-N 3.46Å; E807-N811 PolarHBondContact O-ND2 3.05Å; V808-N811 PolarHBondContact O-N 3Å; I809-N811 VanDerWaalsContact C-N 3.34Å; I809-N811 PolarHBondContact O-N 2.86Å; N811-S813 VanDerWaalsContact C-N 3.29Å; N811-S813 PolarHBondContact O-N 3.43Å; N811-G814 PolarHBondContact O-N 3.49Å
812	L	83.9	Confident	83.3	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-64.9	-34.8	178.4	-172.6	61.8	0	0	0	111.4	L724 A727 M728 V808 I809 G814 R815 I816 L824	L724-L812 HydrophobicContact CD1-CD1 4.29Å; L724-L812 HydrophobicContact CD1-CD2 3.69Å; L724-L812 HydrophobicContact CD1-CG 4.12Å; A727-L812 HydrophobicContact CB-CD1 3.7Å; M728-L812 HydrophobicContact CB-CD1 4.19Å; M728-L812 HydrophobicContact CB-CD2 4.44Å; M728-L812 HydrophobicContact SD-CD2 4.25Å; V808-L812 WeakPolarHBondContact O-CB 3.34Å; V808-L812 PolarHBondContact O-N 3.4Å; I809-L812 PolarHBondContact O-N 3.16Å; L812-G814 PolarHBondContact O-N 3.31Å; L812-G814 VanDerWaalsContact O-N 3.16Å; L812-R815 PolarHBondContact O-N 2.96Å; L812-I816 HydrophobicContact CD1-CG2 3.96Å; L812-I816 HydrophobicContact CG-CG2 4.2Å; L812-I816 WeakPolarHBondContact O-CG1 3.48Å; L812-I816 PolarHBondContact O-N 2.81Å; L812-L824 HydrophobicContact CD2-CD2 4.3Å
813	S	79.5	Confident	83.9	Confident	67 Å²	67	65.1 Å²	65.1	47%	0.469	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.7	177.1	77.8	0	0	0	0	113.7	I809 D810 N811	I809-S813 PolarHBondContact O-N 3.25Å; D810-S813 PolarHBondContact O-OG 2.9Å; N811-S813 VanDerWaalsContact C-N 3.29Å; N811-S813 PolarHBondContact O-N 3.43Å
814	G	81.1	Confident	84.1	Confident	70 Å²	70	64.9 Å²	64.9	72%	0.722	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.6	177.7	0	0	0	0	0	115.4	N811 L812	N811-G814 PolarHBondContact O-N 3.49Å; L812-G814 PolarHBondContact O-N 3.31Å; L812-G814 VanDerWaalsContact O-N 3.16Å
815	R	80.2	Confident	84.1	Confident	178 Å²	178	66.3 Å²	66.3	67%	0.672	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-23.4	179.7	-67.7	-72.3	-174.2	168.4	1.8	113.2	A727 L812	A727-R815 HydrophobicContact CB-CB 4.45Å; L812-R815 PolarHBondContact O-N 2.96Å
816	I	84.8	Confident	84.1	Confident	15 Å²	15	70.1 Å²	70.1	8%	0.077	37%	0.368	C	S	.	.	S	Bend	trans	-93.5	166.3	179.6	65.7	-169.7	0	0	0	111.8	L724 A727 L812 M820 A821 L824	L724-I816 HydrophobicContact CD1-CG2 4.04Å; A727-I816 HydrophobicContact CB-CG2 4.1Å; L812-I816 HydrophobicContact CD1-CG2 3.96Å; L812-I816 HydrophobicContact CG-CG2 4.2Å; L812-I816 WeakPolarHBondContact O-CG1 3.48Å; L812-I816 PolarHBondContact O-N 2.81Å; I816-M820 HydrophobicContact CB-CB 4.29Å; I816-M820 HydrophobicContact CB-CG 4.25Å; I816-M820 HydrophobicContact CB-SD 3.69Å; I816-M820 HydrophobicContact CD1-CB 4.43Å; I816-M820 HydrophobicContact CD1-CG 4.15Å; I816-M820 HydrophobicContact CD1-SD 4.45Å; I816-M820 HydrophobicContact CG1-CB 4.42Å; I816-M820 HydrophobicContact CG2-SD 3.73Å; I816-A821 HydrophobicContact CD1-CB 3.86Å; I816-A821 HydrophobicContact CG1-CB 3.91Å; I816-L824 HydrophobicContact CD1-CD2 3.9Å
817	S	83.4	Confident	84.3	Confident	41 Å²	41	71.1 Å²	71.1	29%	0.287	38%	0.375	S	S	.	.			trans	-68.1	147	173.3	52.6	0	0	0	0	110.9	Q819 M820 A821	S817-Q819 PolarHBondContact O-N 3.49Å; S817-Q819 VanDerWaalsContact O-N 3.13Å; S817-M820 WeakPolarHBondContact O-CA 3.4Å; S817-M820 WeakPolarHBondContact O-CB 3.3Å; S817-M820 PolarHBondContact O-N 3.21Å; S817-M820 WeakPolarHBondContact OG-CB 3.47Å; S817-A821 PolarHBondContact O-N 3.13Å
818	W	82.5	Confident	84.5	Confident	181 Å²	181	69.6 Å²	69.6	69%	0.686	37%	0.369	S	S	*	.	H	α-helix	trans	-52	-38.2	179.9	173.6	83.2	0	0	0	113.6	M820 A821 K822	W818-M820 PolarHBondContact O-N 3.04Å; W818-A821 PolarHBondContact O-N 2.77Å; W818-K822 HydrophobicContact CH2-CD 4.18Å; W818-K822 HydrophobicContact CZ2-CD 4.29Å; W818-K822 PolarHBondContact O-N 2.86Å
819	Q	79.4	Confident	84.6	Confident	119 Å²	119	69.7 Å²	69.7	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-61.6	-43	175.2	-64.4	81.5	-3.7	0	0	111.9	S817 K822 E823	S817-Q819 PolarHBondContact O-N 3.49Å; S817-Q819 VanDerWaalsContact O-N 3.13Å; Q819-K822 PolarHBondContact O-N 3.31Å; Q819-E823 PolarHBondContact O-N 3.3Å
820	M	82.2	Confident	84.8	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.049	37%	0.373	C	S	.	.	H	α-helix	trans	-69	-40.5	178	-173.9	-176.5	-112.3	0	0	111.1	I719 N720 R723 L724 I816 S817 W818 K822 E823 L824	I719-M820 HydrophobicContact CG2-CE 3.82Å; I719-M820 HydrophobicContact CG2-CG 4.26Å; N720-M820 HydrophobicContact CB-CE 3.87Å; N720-M820 WeakPolarHBondContact O-CE 3.39Å; R723-M820 HydrophobicContact CB-CE 4.35Å; L724-M820 HydrophobicContact CB-CE 4.05Å; L724-M820 HydrophobicContact CB-SD 4.38Å; L724-M820 HydrophobicContact CD1-SD 4.2Å; I816-M820 HydrophobicContact CB-CB 4.29Å; I816-M820 HydrophobicContact CB-CG 4.25Å; I816-M820 HydrophobicContact CB-SD 3.69Å; I816-M820 HydrophobicContact CD1-CB 4.43Å; I816-M820 HydrophobicContact CD1-CG 4.15Å; I816-M820 HydrophobicContact CD1-SD 4.45Å; I816-M820 HydrophobicContact CG1-CB 4.42Å; I816-M820 HydrophobicContact CG2-SD 3.73Å; S817-M820 WeakPolarHBondContact O-CA 3.4Å; S817-M820 WeakPolarHBondContact O-CB 3.3Å; S817-M820 PolarHBondContact O-N 3.21Å; S817-M820 WeakPolarHBondContact OG-CB 3.47Å; W818-M820 PolarHBondContact O-N 3.04Å; M820-K822 VanDerWaalsContact C-N 3.27Å; M820-K822 PolarHBondContact O-N 3.15Å; M820-E823 PolarHBondContact O-N 2.95Å; M820-L824 WeakPolarHBondContact O-CB 3.45Å; M820-L824 PolarHBondContact O-N 2.96Å
821	A	82.6	Confident	85.1	Confident	35 Å²	35	68.9 Å²	68.9	29%	0.289	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-34.2	174.5	0	0	0	0	0	112.7	I816 S817 W818	I816-A821 HydrophobicContact CD1-CB 3.86Å; I816-A821 HydrophobicContact CG1-CB 3.91Å; S817-A821 PolarHBondContact O-N 3.13Å; W818-A821 PolarHBondContact O-N 2.77Å
822	K	83.1	Confident	85.5	Confident	159 Å²	159	65.4 Å²	65.4	69%	0.691	35%	0.347	S	S	*	.	H	α-helix	trans	-70.9	-28.4	176.3	-171	-178.4	176.3	-170.6	0	113.4	W818 Q819 M820	W818-K822 HydrophobicContact CH2-CD 4.18Å; W818-K822 HydrophobicContact CZ2-CD 4.29Å; W818-K822 PolarHBondContact O-N 2.86Å; Q819-K822 PolarHBondContact O-N 3.31Å; M820-K822 VanDerWaalsContact C-N 3.27Å; M820-K822 PolarHBondContact O-N 3.15Å
823	E	82.3	Confident	85.9	Confident	61 Å²	61	65.4 Å²	65.4	29%	0.285	35%	0.346	S	S	.	.	H	α-helix	trans	-96.1	-17.1	-179.3	-67.4	-174	-173	0	0	113.7	K717 M718 I719 Q819 M820 S825	K717-E823 VanDerWaalsContact CA-OE2 3.27Å; K717-E823 WeakPolarHBondContact CA-OE2 3.23Å; K717-E823 WeakPolarHBondContact CB-OE2 3.37Å; K717-E823 HydrophobicContact CG-CG 4.43Å; M718-E823 PolarHBondContact N-OE2 3.47Å; I719-E823 HydrophobicContact CD1-CB 3.91Å; I719-E823 HydrophobicContact CG1-CB 3.98Å; Q819-E823 PolarHBondContact O-N 3.3Å; M820-E823 PolarHBondContact O-N 2.95Å; E823-S825 PolarHBondContact O-N 3.27Å
824	L	85.2	Confident	86.5	Confident	35 Å²	35	65.8 Å²	65.8	18%	0.183	34%	0.343	C	S	.	.			trans	-61.3	120.7	-179.3	-173.7	67.8	0	0	0	111.7	L724 L812 I816 M820 I828 A829	L724-L824 HydrophobicContact CD1-CD1 4Å; L724-L824 HydrophobicContact CD2-CD1 3.68Å; L812-L824 HydrophobicContact CD2-CD2 4.3Å; I816-L824 HydrophobicContact CD1-CD2 3.9Å; M820-L824 WeakPolarHBondContact O-CB 3.45Å; M820-L824 PolarHBondContact O-N 2.96Å; L824-I828 HydrophobicContact CD1-CG2 4.37Å; L824-A829 HydrophobicContact CD1-CB 4.24Å
825	S	88.7	Confident	87	Confident	36 Å²	36	66.4 Å²	66.4	25%	0.252	33%	0.327	S	S	.	.			trans	-106.2	159.3	166.1	62.7	0	0	0	0	111	E823 S827 I828 A829	E823-S825 PolarHBondContact O-N 3.27Å; S825-S827 PolarHBondContact O-N 2.91Å; S825-S827 PolarHBondContact OG-OG 3.1Å; S825-I828 PolarHBondContact O-N 2.98Å; S825-I828 WeakPolarHBondContact OG-CD1 3.27Å; S825-I828 VanDerWaalsContact OG-CG1 3.26Å; S825-I828 WeakPolarHBondContact OG-CG1 3.34Å; S825-I828 PolarHBondContact OG-N 3.44Å; S825-A829 PolarHBondContact O-N 3.37Å
826	I	89.7	Confident	87.5	Confident	93 Å²	93	58 Å²	58	48%	0.477	30%	0.295	S	S	.	.	H	α-helix	trans	-53.5	-43.7	173.7	-58.9	171.9	0	0	0	110.3	F805 I809 I828 A829 L830	F805-I826 HydrophobicContact CE1-CG2 3.94Å; I809-I826 HydrophobicContact CD1-CG1 4.43Å; I809-I826 HydrophobicContact CD1-CG2 4.4Å; I826-I828 VanDerWaalsContact C-N 3.34Å; I826-I828 PolarHBondContact O-N 3.13Å; I826-A829 PolarHBondContact O-N 3.28Å; I826-L830 VanDerWaalsContact O-CB 3.3Å; I826-L830 WeakPolarHBondContact O-CB 3.44Å; I826-L830 PolarHBondContact O-N 3.35Å
827	S	90.8	Very high	87.7	Confident	80 Å²	80	57.6 Å²	57.6	56%	0.559	29%	0.293	S	S	*	.	H	α-helix	trans	-59.8	-37.1	176.8	51.5	0	0	0	0	114.1	S825 N831	S825-S827 PolarHBondContact O-N 2.91Å; S825-S827 PolarHBondContact OG-OG 3.1Å; S827-N831 WeakPolarHBondContact O-CB 3.21Å; S827-N831 PolarHBondContact O-N 2.99Å
828	I	90.6	Very high	87.9	Confident	50 Å²	50	60.9 Å²	60.9	26%	0.256	31%	0.308	S	S	.	.	H	α-helix	trans	-76.3	-37.9	179.3	-66.5	169.2	0	0	0	110.7	I719 L724 L824 S825 I826 C832	I719-I828 HydrophobicContact CD1-CD1 3.71Å; I719-I828 HydrophobicContact CD1-CG2 4.02Å; I719-I828 HydrophobicContact CG2-CG2 4.3Å; L724-I828 HydrophobicContact CD2-CG2 3.97Å; L824-I828 HydrophobicContact CD1-CG2 4.37Å; S825-I828 PolarHBondContact O-N 2.98Å; S825-I828 WeakPolarHBondContact OG-CD1 3.27Å; S825-I828 VanDerWaalsContact OG-CG1 3.26Å; S825-I828 WeakPolarHBondContact OG-CG1 3.34Å; S825-I828 PolarHBondContact OG-N 3.44Å; I826-I828 VanDerWaalsContact C-N 3.34Å; I826-I828 PolarHBondContact O-N 3.13Å; I828-C832 PolarHBondContact O-N 3.3Å; I828-C832 VanDerWaalsContact O-N 3.09Å; I828-C832 PolarHBondContact O-SG 3.3Å
829	A	90.8	Very high	88.2	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-44.2	171.5	0	0	0	0	0	111.5	F805 I809 L824 S825 I826 C832 L833	F805-A829 HydrophobicContact CE2-CB 4.02Å; F805-A829 HydrophobicContact CZ-CB 3.83Å; I809-A829 HydrophobicContact CD1-CB 4.42Å; I809-A829 HydrophobicContact CG1-CB 4.22Å; L824-A829 HydrophobicContact CD1-CB 4.24Å; S825-A829 PolarHBondContact O-N 3.37Å; I826-A829 PolarHBondContact O-N 3.28Å; A829-C832 WeakPolarHBondContact O-CB 3.48Å; A829-C832 PolarHBondContact O-N 3.31Å; A829-L833 PolarHBondContact O-N 3.24Å
830	L	92.5	Very high	88.5	Confident	54 Å²	54	55.7 Å²	55.7	28%	0.283	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-43.9	179.5	-176.8	62.5	0	0	0	111.4	F805 I826 C832 L833 L834 I853	F805-L830 HydrophobicContact CE1-CB 4.26Å; F805-L830 HydrophobicContact CE1-CD1 4.3Å; F805-L830 HydrophobicContact CZ-CB 3.85Å; F805-L830 HydrophobicContact CZ-CD1 4.3Å; I826-L830 VanDerWaalsContact O-CB 3.3Å; I826-L830 WeakPolarHBondContact O-CB 3.44Å; I826-L830 PolarHBondContact O-N 3.35Å; L830-C832 VanDerWaalsContact C-N 3.3Å; L830-C832 PolarHBondContact O-N 3.36Å; L830-L833 HydrophobicContact CD1-CD2 4.34Å; L830-L833 WeakPolarHBondContact O-CA 3.48Å; L830-L833 WeakPolarHBondContact O-CB 3.35Å; L830-L833 PolarHBondContact O-N 3.47Å; L830-L834 WeakPolarHBondContact O-CG 3.45Å; L830-L834 PolarHBondContact O-N 3.22Å; L830-I853 HydrophobicContact CD1-CD1 3.66Å
831	N	91.5	Very high	88.5	Confident	86 Å²	86	63 Å²	63	46%	0.46	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-39.4	175	-168.3	27.6	0	0	0	111.7	S827 L833 L834 H835	S827-N831 WeakPolarHBondContact O-CB 3.21Å; S827-N831 PolarHBondContact O-N 2.99Å; N831-L833 VanDerWaalsContact C-N 3.27Å; N831-L833 PolarHBondContact O-N 3.27Å; N831-L834 PolarHBondContact O-N 3.12Å; N831-H835 PolarHBondContact O-CD2 2.93Å; N831-H835 PolarHBondContact O-N 2.9Å
832	C	91.7	Very high	88.6	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-31.7	172.4	-67.9	0	0	0	0	113	K725 M728 I828 A829 L830 L836	K725-C832 HydrophobicContact CG-CB 3.91Å; M728-C832 VanDerWaalsContact CE-C 3.44Å; M728-C832 HydrophobicContact CE-CB 3.68Å; I828-C832 PolarHBondContact O-N 3.3Å; I828-C832 VanDerWaalsContact O-N 3.09Å; I828-C832 PolarHBondContact O-SG 3.3Å; A829-C832 WeakPolarHBondContact O-CB 3.48Å; A829-C832 PolarHBondContact O-N 3.31Å; L830-C832 VanDerWaalsContact C-N 3.3Å; L830-C832 PolarHBondContact O-N 3.36Å; C832-L836 WeakPolarHBondContact O-CG 3.22Å; C832-L836 PolarHBondContact O-N 3.41Å
833	L	91.7	Very high	88.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-72.3	-42.4	176.7	178.2	64	0	0	0	111.4	M728 F805 A829 L830 N831 H835 L836 S837 L842 L844 I855	M728-L833 HydrophobicContact CE-CB 3.79Å; M728-L833 HydrophobicContact CE-CD1 4.47Å; M728-L833 VanDerWaalsContact CE-N 3.28Å; F805-L833 HydrophobicContact CD2-CD2 3.69Å; F805-L833 HydrophobicContact CE2-CB 4.47Å; F805-L833 HydrophobicContact CE2-CD2 4.01Å; F805-L833 HydrophobicContact CG-CD2 4.29Å; A829-L833 PolarHBondContact O-N 3.24Å; L830-L833 HydrophobicContact CD1-CD2 4.34Å; L830-L833 WeakPolarHBondContact O-CA 3.48Å; L830-L833 WeakPolarHBondContact O-CB 3.35Å; L830-L833 PolarHBondContact O-N 3.47Å; N831-L833 VanDerWaalsContact C-N 3.27Å; N831-L833 PolarHBondContact O-N 3.27Å; L833-H835 VanDerWaalsContact C-N 3.35Å; L833-H835 PolarHBondContact O-N 3.27Å; L833-L836 CarbonylContact O-C 3.53Å; L833-L836 PolarHBondContact O-N 3.47Å; L833-S837 WeakPolarHBondContact O-CB 3.38Å; L833-S837 PolarHBondContact O-N 3.28Å; L833-S837 PolarHBondContact O-OG 2.99Å; L833-L842 HydrophobicContact CD1-CD1 4.31Å; L833-L844 HydrophobicContact CD1-CD2 4.26Å; L833-L844 HydrophobicContact CD2-CD1 4.48Å; L833-L844 HydrophobicContact CD2-CD2 3.94Å; L833-L844 HydrophobicContact CG-CD1 4.44Å; L833-L844 HydrophobicContact CG-CD2 4.08Å; L833-I855 HydrophobicContact CD1-CD1 3.68Å; L833-I855 HydrophobicContact CD1-CG1 4.01Å; L833-I855 HydrophobicContact CD1-CG2 4.16Å; L833-I855 HydrophobicContact CD2-CD1 3.72Å; L833-I855 HydrophobicContact CD2-CG1 3.89Å; L833-I855 HydrophobicContact CG-CD1 4.37Å
834	L	92.1	Very high	89	Confident	75 Å²	75	54.6 Å²	54.6	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-44.7	173.1	-67.1	170.7	0	0	0	111.1	L830 N831 L836 S837 N838 L844	L830-L834 WeakPolarHBondContact O-CG 3.45Å; L830-L834 PolarHBondContact O-N 3.22Å; N831-L834 PolarHBondContact O-N 3.12Å; L834-L836 PolarHBondContact O-N 3.36Å; L834-S837 WeakPolarHBondContact O-CB 3.47Å; L834-S837 PolarHBondContact O-N 3.45Å; L834-N838 PolarHBondContact O-N 3.37Å; L834-N838 VanDerWaalsContact O-N 3.16Å; L834-L844 HydrophobicContact CD2-CD1 3.92Å
835	H	90.8	Very high	89	Confident	83 Å²	83	57.2 Å²	57.2	38%	0.384	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-41.9	172.4	-75.5	-59	0	0	0	113.1	K725 N831 L833 S837 E839	K725-H835 HydrophobicContact CD-CB 4.2Å; N831-H835 PolarHBondContact O-CD2 2.93Å; N831-H835 PolarHBondContact O-N 2.9Å; L833-H835 VanDerWaalsContact C-N 3.35Å; L833-H835 PolarHBondContact O-N 3.27Å; H835-S837 VanDerWaalsContact C-N 3.32Å; H835-E839 WeakPolarHBondContact O-CB 3.06Å; H835-E839 WeakPolarHBondContact O-CG 3.46Å; H835-E839 PolarHBondContact O-N 3.09Å; H835-E839 VanDerWaalsContact O-N 3.12Å
836	L	90.5	Very high	88.9	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-31.7	174.6	-78.4	179.8	0	0	0	112.6	K725 M728 W729 C832 L833 L834 E839 K840 L842	K725-L836 HydrophobicContact CB-CD2 4.19Å; K725-L836 HydrophobicContact CB-CG 4.33Å; K725-L836 HydrophobicContact CG-CG 4.29Å; M728-L836 HydrophobicContact CB-CD1 4.09Å; M728-L836 HydrophobicContact CE-CD1 3.76Å; M728-L836 HydrophobicContact CG-CD1 4.14Å; W729-L836 HydrophobicContact CB-CD1 4.15Å; W729-L836 HydrophobicContact CB-CD2 4.16Å; C832-L836 WeakPolarHBondContact O-CG 3.22Å; C832-L836 PolarHBondContact O-N 3.41Å; L833-L836 CarbonylContact O-C 3.53Å; L833-L836 PolarHBondContact O-N 3.47Å; L834-L836 PolarHBondContact O-N 3.36Å; L836-E839 PolarHBondContact O-N 2.84Å; L836-K840 HydrophobicContact CD2-CG 4.25Å; L836-K840 WeakPolarHBondContact O-CA 3.13Å; L836-K840 VanDerWaalsContact O-CB 3.22Å; L836-K840 WeakPolarHBondContact O-CB 3Å; L836-K840 WeakPolarHBondContact O-CG 3.17Å; L836-K840 PolarHBondContact O-N 3.34Å; L836-L842 HydrophobicContact CB-CD1 4.25Å
837	S	89.4	Confident	88.6	Confident	5 Å²	5	56.1 Å²	56.1	4%	0.035	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-43.7	178.6	-56.8	0	0	0	0	111	L833 L834 H835 Q841 L842	L833-S837 WeakPolarHBondContact O-CB 3.38Å; L833-S837 PolarHBondContact O-N 3.28Å; L833-S837 PolarHBondContact O-OG 2.99Å; L834-S837 WeakPolarHBondContact O-CB 3.47Å; L834-S837 PolarHBondContact O-N 3.45Å; H835-S837 VanDerWaalsContact C-N 3.32Å; S837-Q841 VanDerWaalsContact O-CA 3.23Å; S837-Q841 WeakPolarHBondContact O-CA 3.38Å; S837-Q841 PolarHBondContact O-N 2.82Å; S837-L842 PolarHBondContact O-N 2.81Å
838	N	87.6	Confident	88.1	Confident	110 Å²	110	59.1 Å²	59.1	59%	0.588	30%	0.295	S	S	*	.	H	α-helix	trans	-65.5	-41.9	172.8	-67.8	-10.3	0	0	0	112.5	L834	L834-N838 PolarHBondContact O-N 3.37Å; L834-N838 VanDerWaalsContact O-N 3.16Å
839	E	88.7	Confident	87.7	Confident	111 Å²	111	60.9 Å²	60.9	52%	0.519	31%	0.311	S	S	.	.	H	α-helix	trans	-76.8	-24.6	-177.5	-76.4	174.4	-177.3	0	0	115	K725 H835 L836	K725-E839 WeakPolarHBondContact CE-OE2 3.45Å; K725-E839 IonicContact NZ-OE1 2.93Å; K725-E839 PolarHBondContact NZ-OE1 2.93Å; K725-E839 IonicContact NZ-OE2 2.75Å; K725-E839 PolarHBondContact NZ-OE2 2.92Å; H835-E839 WeakPolarHBondContact O-CB 3.06Å; H835-E839 WeakPolarHBondContact O-CG 3.46Å; H835-E839 PolarHBondContact O-N 3.09Å; H835-E839 VanDerWaalsContact O-N 3.12Å; L836-E839 PolarHBondContact O-N 2.84Å
840	K	85.2	Confident	87.1	Confident	80 Å²	80	69 Å²	69	35%	0.348	35%	0.346	S	S	.	.	H	α-helix	trans	-125.5	2.5	-170.3	-53.8	-66.5	178.7	-161.1	0	113.7	W729 L836 L842 Q857	W729-K840 HydrophobicContact CD2-CD 4.17Å; W729-K840 HydrophobicContact CD2-CG 4.07Å; W729-K840 HydrophobicContact CE3-CB 4.04Å; W729-K840 HydrophobicContact CE3-CD 4.16Å; W729-K840 HydrophobicContact CE3-CG 3.59Å; W729-K840 HydrophobicContact CH2-CB 3.85Å; W729-K840 HydrophobicContact CH2-CD 4.09Å; W729-K840 HydrophobicContact CH2-CG 4Å; W729-K840 HydrophobicContact CZ2-CD 4.1Å; W729-K840 HydrophobicContact CZ2-CG 4.44Å; W729-K840 HydrophobicContact CZ3-CB 3.47Å; W729-K840 VanDerWaalsContact CZ3-CB 3.47Å; W729-K840 HydrophobicContact CZ3-CD 4.1Å; W729-K840 HydrophobicContact CZ3-CG 3.54Å; L836-K840 HydrophobicContact CD2-CG 4.25Å; L836-K840 WeakPolarHBondContact O-CA 3.13Å; L836-K840 VanDerWaalsContact O-CB 3.22Å; L836-K840 WeakPolarHBondContact O-CB 3Å; L836-K840 WeakPolarHBondContact O-CG 3.17Å; L836-K840 PolarHBondContact O-N 3.34Å; K840-L842 HydrophobicContact CB-CG 4.27Å; K840-Q857 PolarHBondContact O-NE2 2.96Å
841	Q	83.4	Confident	86.7	Confident	164 Å²	164	71.1 Å²	71.1	77%	0.766	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	53.5	-178.6	-58.5	177.1	-12	0	0	111.5	S837	S837-Q841 VanDerWaalsContact O-CA 3.23Å; S837-Q841 WeakPolarHBondContact O-CA 3.38Å; S837-Q841 PolarHBondContact O-N 2.82Å
842	L	85.1	Confident	86.5	Confident	8 Å²	8	68.5 Å²	68.5	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	141.9	172.1	-55.6	174.1	0	0	0	110	W729 L732 V799 L833 L836 S837 K840 I855 S856 Q857	W729-L842 HydrophobicContact CZ3-CD1 4.48Å; W729-L842 HydrophobicContact CZ3-CD2 4.14Å; L732-L842 HydrophobicContact CD1-CD1 3.94Å; V799-L842 HydrophobicContact CG2-CD2 4Å; L833-L842 HydrophobicContact CD1-CD1 4.31Å; L836-L842 HydrophobicContact CB-CD1 4.25Å; S837-L842 PolarHBondContact O-N 2.81Å; K840-L842 HydrophobicContact CB-CG 4.27Å; L842-I855 HydrophobicContact CB-CG2 4.37Å; L842-I855 HydrophobicContact CD1-CG2 3.98Å; L842-I855 HydrophobicContact CD2-CG2 4.48Å; L842-S856 CarbonylContact C-O 3.55Å; L842-S856 VanDerWaalsContact CA-O 3.27Å; L842-S856 WeakPolarHBondContact CA-O 3.28Å; L842-Q857 HydrophobicContact CD2-CB 3.74Å; L842-Q857 HydrophobicContact CD2-CG 4Å
843	Y	84.7	Confident	86.4	Confident	58 Å²	58	70.2 Å²	70.2	23%	0.227	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.4	170.5	-171	-91	0	0	0	109	E845 S856 P860 F862	Y843-E845 HydrophobicContact CE1-CB 4.15Å; Y843-S856 PolarHBondContact N-O 2.88Å; Y843-S856 PolarHBondContact O-N 3Å; Y843-P860 HydrophobicContact CD1-CB 3.93Å; Y843-P860 HydrophobicContact CD2-CB 3.98Å; Y843-P860 HydrophobicContact CD2-CG 4.05Å; Y843-P860 HydrophobicContact CE1-CB 3.89Å; Y843-P860 HydrophobicContact CE2-CB 3.93Å; Y843-P860 HydrophobicContact CE2-CG 3.94Å; Y843-P860 HydrophobicContact CG-CB 3.99Å; Y843-F862 HydrophobicContact CE2-CE1 4.22Å; Y843-F862 AromaticContact CZ-CE1 3.94Å; Y843-F862 WeakPolarHBondContact OH-CE1 3.45Å
844	L	88.4	Confident	86.2	Confident	12 Å²	12	75.3 Å²	75.3	6%	0.063	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.3	-177.9	-58.4	-179.3	0	0	0	108.8	L833 L834 I853 Y854 I855	L833-L844 HydrophobicContact CD1-CD2 4.26Å; L833-L844 HydrophobicContact CD2-CD1 4.48Å; L833-L844 HydrophobicContact CD2-CD2 3.94Å; L833-L844 HydrophobicContact CG-CD1 4.44Å; L833-L844 HydrophobicContact CG-CD2 4.08Å; L834-L844 HydrophobicContact CD2-CD1 3.92Å; L844-I853 HydrophobicContact CB-CG2 4Å; L844-I853 HydrophobicContact CD2-CG2 4.21Å; L844-Y854 WeakPolarHBondContact CA-O 3.23Å; L844-I855 HydrophobicContact CD2-CB 4.26Å; L844-I855 HydrophobicContact CD2-CG1 3.81Å; L844-I855 HydrophobicContact CD2-CG2 4.17Å
845	E	85.5	Confident	86.1	Confident	90 Å²	90	71.7 Å²	71.7	42%	0.421	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.3	179.3	-178.1	175.4	-178.2	0	0	108.6	Y843 Y854	Y843-E845 HydrophobicContact CE1-CB 4.15Å; E845-Y854 PolarHBondContact N-O 2.89Å; E845-Y854 PolarHBondContact O-N 3.36Å
846	N	86.4	Confident	85.7	Confident	65 Å²	65	69 Å²	69	35%	0.348	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	149.7	177.1	61	-52.3	0	0	0	110.8	W906	N846-W906 HydrophobicContact CB-CH2 4.26Å; N846-W906 HydrophobicContact CB-CZ2 4.05Å
847	V	83.5	Confident	85	Confident	41 Å²	41	70.8 Å²	70.8	25%	0.248	36%	0.361	C	S	.	.			trans	-91	135.4	164	-177.2	0	0	0	0	108.2	S849 F850 D852 Y854	V847-S849 PolarHBondContact O-N 3.19Å; V847-F850 WeakPolarHBondContact O-CA 3.41Å; V847-F850 PolarHBondContact O-N 2.96Å; V847-D852 HydrophobicContact CG2-CB 4.47Å; V847-D852 PolarHBondContact N-O 3.35Å; V847-Y854 HydrophobicContact CG2-CD2 3.8Å; V847-Y854 HydrophobicContact CG2-CE2 3.56Å
848	D	80.4	Confident	83.9	Confident	144 Å²	144	72.5 Å²	72.5	77%	0.77	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-26.5	-179.3	-57.2	-36.2	0	0	0	114.2	F850	D848-F850 VanDerWaalsContact C-N 3.26Å; D848-F850 WeakPolarHBondContact O-CD2 3.32Å; D848-F850 PolarHBondContact O-N 3.17Å
849	S	81.2	Confident	82.6	Confident	86 Å²	86	71.2 Å²	71.2	60%	0.601	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	6.1	177.3	-48.6	0	0	0	0	114.3	V847 S851	V847-S849 PolarHBondContact O-N 3.19Å; S849-S851 PolarHBondContact O-N 2.85Å; S849-S851 PolarHBondContact O-OG 2.57Å
850	F	79	Confident	81.2	Confident	171 Å²	171	66.2 Å²	66.2	75%	0.75	35%	0.349	S	S	*	.	S	Bend	trans	48.6	21.7	-174.9	-62.1	-83	0	0	0	115.1	V847 D848	V847-F850 WeakPolarHBondContact O-CA 3.41Å; V847-F850 PolarHBondContact O-N 2.96Å; D848-F850 VanDerWaalsContact C-N 3.26Å; D848-F850 WeakPolarHBondContact O-CD2 3.32Å; D848-F850 PolarHBondContact O-N 3.17Å
851	S	83.7	Confident	79.9	Confident	99 Å²	99	66.4 Å²	66.4	69%	0.692	36%	0.36	S	S	*	.	S	Bend	trans	-92.8	-23	-169.1	-60.4	0	0	0	0	113.7	S849	S849-S851 PolarHBondContact O-N 2.85Å; S849-S851 PolarHBondContact O-OG 2.57Å
852	D	88	Confident	78.9	Confident	31 Å²	31	64 Å²	64	17%	0.166	35%	0.347	C	S	.	.			trans	-155.4	167.2	177.5	-154.2	-5.9	0	0	0	110.6	G804 F805 S806 V847	G804-D852 WeakPolarHBondContact CA-OD2 3.42Å; F805-D852 WeakPolarHBondContact CA-OD1 3.49Å; F805-D852 WeakPolarHBondContact CB-OD1 3.1Å; F805-D852 PolarHBondContact N-OD1 2.83Å; S806-D852 WeakPolarHBondContact CB-OD2 3.44Å; S806-D852 PolarHBondContact N-OD1 2.89Å; S806-D852 PolarHBondContact OG-OD2 3.24Å; V847-D852 HydrophobicContact CG2-CB 4.47Å; V847-D852 PolarHBondContact N-O 3.35Å
853	I	89.7	Confident	77.7	Confident	38 Å²	38	66.1 Å²	66.1	20%	0.195	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.5	176.6	-59.7	169	0	0	0	108.2	F805 L830 L844	F805-I853 HydrophobicContact CB-CB 4.05Å; F805-I853 WeakPolarHBondContact CB-O 3.49Å; F805-I853 PolarHBondContact N-O 2.89Å; L830-I853 HydrophobicContact CD1-CD1 3.66Å; L844-I853 HydrophobicContact CB-CG2 4Å; L844-I853 HydrophobicContact CD2-CG2 4.21Å
854	Y	88.1	Confident	76.5	Confident	107 Å²	107	67.5 Å²	67.5	42%	0.42	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.7	175.3	-76.4	-63.3	0	0	0	111.4	A802 R803 L844 E845 V847	A802-Y854 HydrophobicContact CB-CD1 4.06Å; A802-Y854 HydrophobicContact CB-CG 4.44Å; R803-Y854 CarbonylContact O-C 3.6Å; R803-Y854 WeakPolarHBondContact O-CA 3.37Å; L844-Y854 WeakPolarHBondContact CA-O 3.23Å; E845-Y854 PolarHBondContact N-O 2.89Å; E845-Y854 PolarHBondContact O-N 3.36Å; V847-Y854 HydrophobicContact CG2-CD2 3.8Å; V847-Y854 HydrophobicContact CG2-CE2 3.56Å
855	I	89.1	Confident	75.1	Confident	0 Å²	0	74 Å²	74	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.9	-178.3	-53.6	160	0	0	0	108.8	L732 A802 R803 F805 V808 L833 L842 L844	L732-I855 HydrophobicContact CD1-CG2 4.38Å; L732-I855 HydrophobicContact CD2-CD1 4.49Å; L732-I855 HydrophobicContact CD2-CG2 4.15Å; A802-I855 CarbonylContact C-O 3.58Å; A802-I855 VanDerWaalsContact CA-O 3.32Å; A802-I855 WeakPolarHBondContact CA-O 3.44Å; R803-I855 PolarHBondContact N-O 3.49Å; R803-I855 PolarHBondContact O-N 3.22Å; F805-I855 HydrophobicContact CB-CD1 4.22Å; F805-I855 HydrophobicContact CD2-CD1 4.38Å; V808-I855 HydrophobicContact CG2-CD1 3.88Å; L833-I855 HydrophobicContact CD1-CD1 3.68Å; L833-I855 HydrophobicContact CD1-CG1 4.01Å; L833-I855 HydrophobicContact CD1-CG2 4.16Å; L833-I855 HydrophobicContact CD2-CD1 3.72Å; L833-I855 HydrophobicContact CD2-CG1 3.89Å; L833-I855 HydrophobicContact CG-CD1 4.37Å; L842-I855 HydrophobicContact CB-CG2 4.37Å; L842-I855 HydrophobicContact CD1-CG2 3.98Å; L842-I855 HydrophobicContact CD2-CG2 4.48Å; L844-I855 HydrophobicContact CD2-CB 4.26Å; L844-I855 HydrophobicContact CD2-CG1 3.81Å; L844-I855 HydrophobicContact CD2-CG2 4.17Å
856	S	81.6	Confident	73.7	Confident	26 Å²	26	75.5 Å²	75.5	18%	0.182	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	166	175.7	63.7	0	0	0	0	111.7	L842 Y843	L842-S856 CarbonylContact C-O 3.55Å; L842-S856 VanDerWaalsContact CA-O 3.27Å; L842-S856 WeakPolarHBondContact CA-O 3.28Å; Y843-S856 PolarHBondContact N-O 2.88Å; Y843-S856 PolarHBondContact O-N 3Å
857	Q	76.8	Confident	72.2	Confident	41 Å²	41	76.5 Å²	76.5	19%	0.192	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122	174.6	-167.9	-178.8	34.5	0	0	110.5	V799 K840 L842	V799-Q857 HydrophobicContact CB-CB 3.71Å; V799-Q857 HydrophobicContact CG2-CB 3.99Å; K840-Q857 PolarHBondContact O-NE2 2.96Å; L842-Q857 HydrophobicContact CD2-CB 3.74Å; L842-Q857 HydrophobicContact CD2-CG 4Å
858	G	66	Low	70.9	Confident	41 Å²	41	79.9 Å²	79.9	42%	0.423	42%	0.42	S	S	.	.	S	Bend	trans	134.6	-162.1	-179.3	0	0	0	0	0	112.5
859	L	60.1	Low	69.8	Low	83 Å²	83	77 Å²	77	44%	0.435	41%	0.408	S	S	.	.	S	Bend	trans	-70.5	130.1	169.3	-69.4	160.2	0	0	0	108.5	E863 L864 L867	L859-E863 HydrophobicContact CD2-CB 4.35Å; L859-E863 WeakPolarHBondContact CD2-OE2 3.38Å; L859-L864 HydrophobicContact CB-CG 4.29Å; L859-L867 HydrophobicContact CD1-CD1 3.77Å; L859-L867 HydrophobicContact CD2-CD1 4.45Å
860	P	60.3	Low	68.3	Low	6 Å²	6	80.1 Å²	80.1	4%	0.039	41%	0.408	C	S	.	.			trans	-64.3	158.1	175.8	28.1	-35	0	0	0	111.1	Y843 F862 E863 L864	Y843-P860 HydrophobicContact CD1-CB 3.93Å; Y843-P860 HydrophobicContact CD2-CB 3.98Å; Y843-P860 HydrophobicContact CD2-CG 4.05Å; Y843-P860 HydrophobicContact CE1-CB 3.89Å; Y843-P860 HydrophobicContact CE2-CB 3.93Å; Y843-P860 HydrophobicContact CE2-CG 3.94Å; Y843-P860 HydrophobicContact CG-CB 3.99Å; P860-F862 HydrophobicContact CB-CD1 3.7Å; P860-F862 HydrophobicContact CB-CE1 3.51Å; P860-F862 HydrophobicContact CB-CZ 4.4Å; P860-F862 HydrophobicContact CG-CD1 3.79Å; P860-F862 HydrophobicContact CG-CE1 3.24Å; P860-F862 HydrophobicContact CG-CE2 4.48Å; P860-F862 HydrophobicContact CG-CZ 3.65Å; P860-F862 PolarHBondContact O-N 3.26Å; P860-F862 VanDerWaalsContact O-N 3.16Å; P860-E863 WeakPolarHBondContact CD-OE2 3.35Å; P860-E863 HydrophobicContact CG-CB 4.06Å; P860-E863 HydrophobicContact CG-CG 3.94Å; P860-E863 PolarHBondContact O-N 3.33Å; P860-L864 PolarHBondContact O-N 2.81Å
861	S	56.8	Low	67.1	Low	83 Å²	83	76.1 Å²	76.1	58%	0.58	40%	0.397	S	S	*	.	H	α-helix	trans	-54.9	-35.5	-175.2	54.4	0	0	0	0	113.3	K865	S861-K865 WeakPolarHBondContact O-CB 3.35Å; S861-K865 PolarHBondContact O-N 2.75Å
862	F	62.5	Low	65.4	Low	115 Å²	115	76.6 Å²	76.6	50%	0.504	39%	0.392	S	S	.	.	H	α-helix	trans	-70.1	-41.5	176.2	76.4	-92.2	0	0	0	112.8	Y843 P860 L864 K865 H866	Y843-F862 HydrophobicContact CE2-CE1 4.22Å; Y843-F862 AromaticContact CZ-CE1 3.94Å; Y843-F862 WeakPolarHBondContact OH-CE1 3.45Å; P860-F862 HydrophobicContact CB-CD1 3.7Å; P860-F862 HydrophobicContact CB-CE1 3.51Å; P860-F862 HydrophobicContact CB-CZ 4.4Å; P860-F862 HydrophobicContact CG-CD1 3.79Å; P860-F862 HydrophobicContact CG-CE1 3.24Å; P860-F862 HydrophobicContact CG-CE2 4.48Å; P860-F862 HydrophobicContact CG-CZ 3.65Å; P860-F862 PolarHBondContact O-N 3.26Å; P860-F862 VanDerWaalsContact O-N 3.16Å; F862-L864 VanDerWaalsContact C-N 3.33Å; F862-L864 PolarHBondContact O-N 2.94Å; F862-K865 PolarHBondContact O-N 2.8Å; F862-H866 WeakPolarHBondContact O-CB 3.18Å; F862-H866 PolarHBondContact O-N 3.29Å
863	E	59.7	Low	63.3	Low	52 Å²	52	79.8 Å²	79.8	24%	0.243	41%	0.413	C	S	.	.	H	α-helix	trans	-65.7	-37.4	174.5	-78.8	-160.3	127.3	0	0	111	L859 P860 H866 L867 R899	L859-E863 HydrophobicContact CD2-CB 4.35Å; L859-E863 WeakPolarHBondContact CD2-OE2 3.38Å; P860-E863 WeakPolarHBondContact CD-OE2 3.35Å; P860-E863 HydrophobicContact CG-CB 4.06Å; P860-E863 HydrophobicContact CG-CG 3.94Å; P860-E863 PolarHBondContact O-N 3.33Å; E863-H866 PolarHBondContact O-N 3.4Å; E863-L867 VanDerWaalsContact O-CB 3.3Å; E863-L867 WeakPolarHBondContact O-CB 3.47Å; E863-L867 WeakPolarHBondContact O-CD1 3.24Å; E863-L867 VanDerWaalsContact O-CG 3.24Å; E863-L867 WeakPolarHBondContact O-CG 3.46Å; E863-L867 PolarHBondContact O-N 2.84Å; E863-R899 IonicContact OE1-CZ 3.59Å; E863-R899 IonicContact OE1-NH2 2.66Å; E863-R899 PolarHBondContact OE1-NH2 3.1Å; E863-R899 IonicContact OE2-CZ 2.89Å; E863-R899 VanDerWaalsContact OE2-CZ 3.29Å; E863-R899 IonicContact OE2-NH1 3.15Å; E863-R899 PolarHBondContact OE2-NH1 3.22Å; E863-R899 IonicContact OE2-NH2 2.71Å; E863-R899 PolarHBondContact OE2-NH2 2.86Å
864	L	59.1	Low	60.9	Low	86 Å²	86	83 Å²	83	45%	0.45	44%	0.438	S	S	.	.	H	α-helix	trans	-58.6	-47.6	172	-95	159.2	0	0	0	111.6	L859 P860 F862 H866 L867 E868	L859-L864 HydrophobicContact CB-CG 4.29Å; P860-L864 PolarHBondContact O-N 2.81Å; F862-L864 VanDerWaalsContact C-N 3.33Å; F862-L864 PolarHBondContact O-N 2.94Å; L864-H866 PolarHBondContact O-N 3.43Å; L864-L867 PolarHBondContact O-N 3.45Å; L864-E868 WeakPolarHBondContact O-CG 3.3Å; L864-E868 PolarHBondContact O-N 2.83Å
865	K	59.2	Low	58.5	Low	149 Å²	149	85 Å²	85	65%	0.648	46%	0.456	S	S	*	.	H	α-helix	trans	-65.5	-36.2	177.4	-167.5	178.8	-177.8	-176.1	0	113	S861 F862 T869	S861-K865 WeakPolarHBondContact O-CB 3.35Å; S861-K865 PolarHBondContact O-N 2.75Å; F862-K865 PolarHBondContact O-N 2.8Å; K865-T869 PolarHBondContact O-N 3.29Å; K865-T869 VanDerWaalsContact O-N 3.1Å; K865-T869 PolarHBondContact O-OG1 3.01Å
866	H	57.2	Low	55.8	Low	121 Å²	121	92.1 Å²	92.1	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-67.9	-42.7	174.3	-134.4	-103.5	0	0	0	111.1	F862 E863 L864 T869 Y870	F862-H866 WeakPolarHBondContact O-CB 3.18Å; F862-H866 PolarHBondContact O-N 3.29Å; E863-H866 PolarHBondContact O-N 3.4Å; L864-H866 PolarHBondContact O-N 3.43Å; H866-T869 WeakPolarHBondContact O-CB 3.46Å; H866-T869 PolarHBondContact O-N 2.79Å; H866-Y870 AromaticContact ND1-CE2 3.76Å; H866-Y870 WeakPolarHBondContact O-CD2 3.47Å; H866-Y870 PolarHBondContact O-N 3.5Å
867	L	53.9	Low	53.6	Low	86 Å²	86	94 Å²	94	45%	0.45	52%	0.517	S	S	.	.	H	α-helix	trans	-63.2	-41.1	174.2	-76.1	163.9	0	0	0	112.1	L859 E863 L864 T869 Y870 T871	L859-L867 HydrophobicContact CD1-CD1 3.77Å; L859-L867 HydrophobicContact CD2-CD1 4.45Å; E863-L867 VanDerWaalsContact O-CB 3.3Å; E863-L867 WeakPolarHBondContact O-CB 3.47Å; E863-L867 WeakPolarHBondContact O-CD1 3.24Å; E863-L867 VanDerWaalsContact O-CG 3.24Å; E863-L867 WeakPolarHBondContact O-CG 3.46Å; E863-L867 PolarHBondContact O-N 2.84Å; L864-L867 PolarHBondContact O-N 3.45Å; L867-T869 VanDerWaalsContact C-N 3.29Å; L867-T869 PolarHBondContact O-N 3Å; L867-Y870 CarbonylContact O-C 3.59Å; L867-Y870 PolarHBondContact O-N 3.36Å; L867-T871 PolarHBondContact O-N 2.88Å; L867-T871 PolarHBondContact O-OG1 3.03Å
868	E	56.3	Low	51.6	Low	113 Å²	113	100 Å²	100	53%	0.528	55%	0.55	S	S	.	*	H	α-helix	trans	-60	-39	173.1	-77.4	178.5	171.8	0	0	112	L864 T871 N872	L864-E868 WeakPolarHBondContact O-CG 3.3Å; L864-E868 PolarHBondContact O-N 2.83Å; E868-T871 WeakPolarHBondContact CA-OG1 3.46Å; E868-T871 PolarHBondContact O-N 3.28Å; E868-T871 PolarHBondContact O-OG1 3.08Å; E868-N872 WeakPolarHBondContact O-CB 3.49Å; E868-N872 PolarHBondContact O-N 3.09Å; E868-N872 PolarHBondContact O-ND2 2.99Å
869	T	57.9	Low	49.9	Very low	83 Å²	83	106 Å²	106	51%	0.509	57%	0.571	S	S	.	*	H	α-helix	trans	-68.4	-38	176.8	-55.9	0	0	0	0	111.4	K865 H866 L867 T873	K865-T869 PolarHBondContact O-N 3.29Å; K865-T869 VanDerWaalsContact O-N 3.1Å; K865-T869 PolarHBondContact O-OG1 3.01Å; H866-T869 WeakPolarHBondContact O-CB 3.46Å; H866-T869 PolarHBondContact O-N 2.79Å; L867-T869 VanDerWaalsContact C-N 3.29Å; L867-T869 PolarHBondContact O-N 3Å; T869-T873 WeakPolarHBondContact O-CG2 3.36Å; T869-T873 PolarHBondContact O-N 3.48Å; T869-T873 PolarHBondContact O-OG1 3.27Å
870	Y	49	Very low	48.8	Very low	151 Å²	151	109.9 Å²	109.9	59%	0.592	59%	0.59	S	S	*	*	H	α-helix	trans	-69	-37.7	172	-90.8	-81.4	0	0	0	113	H866 L867 T873 C874	H866-Y870 AromaticContact ND1-CE2 3.76Å; H866-Y870 WeakPolarHBondContact O-CD2 3.47Å; H866-Y870 PolarHBondContact O-N 3.5Å; L867-Y870 CarbonylContact O-C 3.59Å; L867-Y870 PolarHBondContact O-N 3.36Å; Y870-T873 WeakPolarHBondContact CA-OG1 3.42Å; Y870-T873 PolarHBondContact O-N 3.04Å; Y870-T873 PolarHBondContact O-OG1 2.94Å; Y870-T873 VanDerWaalsContact O-OG1 3.07Å; Y870-C874 PolarHBondContact O-N 2.97Å; Y870-C874 PolarHBondContact O-SG 2.82Å
871	T	53.9	Low	47.6	Very low	87 Å²	87	115.1 Å²	115.1	53%	0.534	63%	0.628	S	S	.	*	H	α-helix	trans	-68.5	-39.2	175.6	50.9	0	0	0	0	112.2	L867 E868 T873 C874 D875	L867-T871 PolarHBondContact O-N 2.88Å; L867-T871 PolarHBondContact O-OG1 3.03Å; E868-T871 WeakPolarHBondContact CA-OG1 3.46Å; E868-T871 PolarHBondContact O-N 3.28Å; E868-T871 PolarHBondContact O-OG1 3.08Å; T871-T873 VanDerWaalsContact C-N 3.26Å; T871-T873 PolarHBondContact O-N 3.16Å; T871-C874 PolarHBondContact O-N 3.26Å; T871-D875 PolarHBondContact O-N 3.38Å
872	N	48.4	Very low	46.5	Very low	109 Å²	109	114.4 Å²	114.4	58%	0.583	63%	0.633	S	S	*	*	H	α-helix	trans	-70.5	-19.9	-179.9	-70.7	-28.4	0	0	0	113.6	E868 N876	E868-N872 WeakPolarHBondContact O-CB 3.49Å; E868-N872 PolarHBondContact O-N 3.09Å; E868-N872 PolarHBondContact O-ND2 2.99Å; N872-N876 PolarHBondContact O-ND2 2.94Å
873	T	43.4	Very low	45.3	Very low	99 Å²	99	116 Å²	116	61%	0.607	65%	0.652	S	S	*	*	H	α-helix	trans	-90.3	-12.8	175.4	45.3	0	0	0	0	113.5	T869 Y870 T871	T869-T873 WeakPolarHBondContact O-CG2 3.36Å; T869-T873 PolarHBondContact O-N 3.48Å; T869-T873 PolarHBondContact O-OG1 3.27Å; Y870-T873 WeakPolarHBondContact CA-OG1 3.42Å; Y870-T873 PolarHBondContact O-N 3.04Å; Y870-T873 PolarHBondContact O-OG1 2.94Å; Y870-T873 VanDerWaalsContact O-OG1 3.07Å; T871-T873 VanDerWaalsContact C-N 3.26Å; T871-T873 PolarHBondContact O-N 3.16Å
874	C	38.9	Very low	43.9	Very low	106 Å²	106	123.4 Å²	123.4	72%	0.716	68%	0.684	S	S	*	*	H	α-helix	trans	-96.9	-11.9	177.5	-66.2	0	0	0	0	115	Y870 T871	Y870-C874 PolarHBondContact O-N 2.97Å; Y870-C874 PolarHBondContact O-SG 2.82Å; T871-C874 PolarHBondContact O-N 3.26Å
875	D	37.8	Very low	42.6	Very low	148 Å²	148	125.3 Å²	125.3	79%	0.791	70%	0.704	S	S	*	*	S	Bend	trans	-100.1	9.3	-172.6	-138.9	13.2	0	0	0	114	T871	T871-D875 PolarHBondContact O-N 3.38Å
876	N	33.6	Very low	41.3	Very low	150 Å²	150	127.4 Å²	127.4	80%	0.802	71%	0.713	S	S	*	*			trans	-105.4	64.1	176.2	-73.7	-63.9	0	0	0	111	N872	N872-N876 PolarHBondContact O-ND2 2.94Å
877	G	34	Very low	40.1	Very low	65 Å²	65	126.7 Å²	126.7	67%	0.67	72%	0.722	S	S	*	*	S	Bend	trans	-155.2	105.1	180	0	0	0	0	0	113.3
878	D	35.2	Very low	39.1	Very low	167 Å²	167	129.5 Å²	129.5	89%	0.893	74%	0.737	S	S	*	*			trans	55.1	89	163.2	-61.9	-20.3	0	0	0	119.3	I880	D878-I880 PolarHBondContact O-N 3.49Å
879	I	31.5	Very low	37.9	Very low	168 Å²	168	131.6 Å²	131.6	86%	0.862	75%	0.752	S	S	*	*			trans	-61.2	116.6	152.5	-60.9	163.1	0	0	0	109.4
880	I	36.9	Very low	36.8	Very low	163 Å²	163	137.1 Å²	137.1	84%	0.836	77%	0.772	S	S	*	*			trans	-162.1	144.1	141.9	-99.5	145.9	0	0	0	111.2	D878	D878-I880 PolarHBondContact O-N 3.49Å
881	S	35	Very low	36.1	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	78%	0.784	S	S	*	*			trans	-67.5	150.6	-171	55.3	0	0	0	0	116.5
882	G	33.9	Very low	35.3	Very low	67 Å²	67	146.7 Å²	146.7	69%	0.691	80%	0.803	S	S	*	*			trans	172.7	68.7	161.2	0	0	0	0	0	120.3
883	T	35.9	Very low	34.7	Very low	148 Å²	148	148.9 Å²	148.9	91%	0.908	81%	0.814	S	S	*	*			trans	47.1	124.1	148.1	52.9	0	0	0	0	122.5
884	K	30	Very low	34.3	Very low	209 Å²	209	154.1 Å²	154.1	91%	0.909	83%	0.829	S	S	*	*			trans	-52.4	142.7	173.9	-59.3	162.3	178.5	169.8	0	115.8
885	S	33.1	Very low	34.2	Very low	126 Å²	126	155.1 Å²	155.1	88%	0.881	83%	0.832	S	S	*	*			trans	-148.9	155.6	135.1	-163.2	0	0	0	0	111.7
886	K	32.2	Very low	34	Very low	192 Å²	192	156.5 Å²	156.5	84%	0.835	83%	0.833	S	S	*	*			trans	-104.1	141.4	-173.3	-68.7	175.2	174	178.1	0	111.7
887	S	32.2	Very low	34	Very low	107 Å²	107	157.7 Å²	157.7	75%	0.748	83%	0.834	S	S	*	*				147.8	158.4	123.4	63	0	0	0	0	114.6
888	N	33	Very low	34.2	Very low	144 Å²	144	162 Å²	162	77%	0.77	84%	0.839	S	S	*	*			trans	75.5	83.2	164.2	-64.4	-8.3	0	0	0	120.1
889	N	29.3	Very low	34.5	Very low	158 Å²	158	161.7 Å²	161.7	85%	0.845	83%	0.825	S	S	*	*				25.2	116	122	-71	-19.1	0	0	0	118.9
890	Q	36.1	Very low	35.1	Very low	199 Å²	199	158.4 Å²	158.4	93%	0.93	82%	0.815	S	S	*	*			trans	-144.2	142.5	133.3	-116.1	176.9	1.9	0	0	111.5
891	K	34.7	Very low	35.5	Very low	193 Å²	193	152.9 Å²	152.9	84%	0.839	79%	0.79	S	S	*	*			trans	-62.6	138.6	-175.1	-72.8	172.2	170.9	176.5	0	111.7
892	R	35.8	Very low	36.4	Very low	246 Å²	246	149.1 Å²	149.1	93%	0.928	76%	0.762	S	S	*	*			trans	-122	119.7	152.2	-88.1	-178.8	154.5	158.4	-6.9	108.7
893	N	36.5	Very low	37.1	Very low	154 Å²	154	151.9 Å²	151.9	82%	0.824	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-73.1	130.5	177.5	-61.2	-22.8	0	0	0	108.9
894	K	34.9	Very low	37.8	Very low	210 Å²	210	148 Å²	148	91%	0.913	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-91.3	118.9	166.3	-99.1	-177.2	171.4	-177.1	0	108.5
895	T	36.4	Very low	38.8	Very low	127 Å²	127	140.3 Å²	140.3	78%	0.779	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-66	134	164.7	33	0	0	0	0	109.5	H897	T895-H897 PolarHBondContact O-N 3.21Å
896	Q	33.5	Very low	39.6	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	69%	0.689	S	S	*	*			trans	-74.6	113	167.5	-77.2	179.7	-38.8	0	0	108.2	M898	Q896-M898 PolarHBondContact O-N 2.97Å
897	H	34.8	Very low	40.4	Very low	175 Å²	175	137.6 Å²	137.6	81%	0.81	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-72.5	118.1	157.9	-102.7	-88	0	0	0	107.7	T895 R899	T895-H897 PolarHBondContact O-N 3.21Å; H897-R899 PolarHBondContact O-N 3.41Å
898	M	36.5	Very low	41.3	Very low	157 Å²	157	138.5 Å²	138.5	77%	0.773	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-59.5	125.9	160.7	-67.2	-84.3	95.5	0	0	107.4	Q896	Q896-M898 PolarHBondContact O-N 2.97Å
899	R	42.1	Very low	41.9	Very low	160 Å²	160	138.7 Å²	138.7	60%	0.604	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-80.6	149.3	169.7	-81.9	-174.1	167.6	-163.6	-10.9	109	E863 H897	E863-R899 IonicContact OE1-CZ 3.59Å; E863-R899 IonicContact OE1-NH2 2.66Å; E863-R899 PolarHBondContact OE1-NH2 3.1Å; E863-R899 IonicContact OE2-CZ 2.89Å; E863-R899 VanDerWaalsContact OE2-CZ 3.29Å; E863-R899 IonicContact OE2-NH1 3.15Å; E863-R899 PolarHBondContact OE2-NH1 3.22Å; E863-R899 IonicContact OE2-NH2 2.71Å; E863-R899 PolarHBondContact OE2-NH2 2.86Å; H897-R899 PolarHBondContact O-N 3.41Å
900	P	44.5	Very low	42.4	Very low	99 Å²	99	138 Å²	138	64%	0.643	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.9	156.4	167.7	-20.6	32.4	0	0	0	111	D904	P900-D904 HydrophobicContact CB-CB 3.69Å
901	S	45.1	Very low	42.3	Very low	47 Å²	47	139.6 Å²	139.6	33%	0.329	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-68.1	159.4	174.4	74	0	0	0	0	110.7	L903 D904 S905	S901-L903 PolarHBondContact O-N 3.48Å; S901-L903 VanDerWaalsContact O-N 3.1Å; S901-L903 WeakPolarHBondContact OG-CB 3.43Å; S901-L903 PolarHBondContact OG-N 3.4Å; S901-D904 WeakPolarHBondContact CA-OD2 3.46Å; S901-D904 WeakPolarHBondContact CB-OD2 3.49Å; S901-D904 PolarHBondContact N-OD2 3.26Å; S901-D904 WeakPolarHBondContact O-CB 3.44Å; S901-D904 PolarHBondContact O-N 2.88Å; S901-D904 PolarHBondContact OG-N 3.24Å; S901-D904 PolarHBondContact OG-OD2 2.86Å; S901-S905 PolarHBondContact O-N 3.49Å
902	T	53.5	Low	42.6	Very low	37 Å²	37	136.9 Å²	136.9	23%	0.227	68%	0.676	C	S	.	*	H	α-helix	trans	-57.9	-26.1	174.9	-43.6	0	0	0	0	112.2	S905 W906	T902-S905 PolarHBondContact O-N 2.96Å; T902-W906 PolarHBondContact O-N 3.07Å
903	L	48.3	Very low	43	Very low	125 Å²	125	131.2 Å²	131.2	65%	0.654	66%	0.663	S	S	*	*	H	α-helix	trans	-67.6	-38.2	175.5	-161.3	108.1	0	0	0	112.2	S901 S905 W906 L907	S901-L903 PolarHBondContact O-N 3.48Å; S901-L903 VanDerWaalsContact O-N 3.1Å; S901-L903 WeakPolarHBondContact OG-CB 3.43Å; S901-L903 PolarHBondContact OG-N 3.4Å; L903-S905 VanDerWaalsContact C-N 3.3Å; L903-S905 PolarHBondContact O-N 3.04Å; L903-W906 PolarHBondContact O-N 3.25Å; L903-L907 HydrophobicContact CD2-CD1 4.12Å; L903-L907 PolarHBondContact O-N 3.11Å
904	D	51	Low	43.4	Very low	66 Å²	66	129.9 Å²	129.9	35%	0.353	65%	0.654	S	S	.	*	H	α-helix	trans	-66.3	-35.3	176.9	-57.2	-61.3	0	0	0	110.8	P900 S901 W906 L907 I908	P900-D904 HydrophobicContact CB-CB 3.69Å; S901-D904 WeakPolarHBondContact CA-OD2 3.46Å; S901-D904 WeakPolarHBondContact CB-OD2 3.49Å; S901-D904 PolarHBondContact N-OD2 3.26Å; S901-D904 WeakPolarHBondContact O-CB 3.44Å; S901-D904 PolarHBondContact O-N 2.88Å; S901-D904 PolarHBondContact OG-N 3.24Å; S901-D904 PolarHBondContact OG-OD2 2.86Å; D904-W906 VanDerWaalsContact C-N 3.33Å; D904-W906 PolarHBondContact O-N 3.33Å; D904-L907 PolarHBondContact O-N 3.27Å; D904-I908 VanDerWaalsContact O-CD1 3.28Å; D904-I908 WeakPolarHBondContact O-CD1 3.34Å; D904-I908 VanDerWaalsContact O-CG1 3.23Å; D904-I908 WeakPolarHBondContact O-CG1 3.47Å; D904-I908 PolarHBondContact O-N 3.33Å
905	S	51.6	Low	43.9	Very low	48 Å²	48	125.2 Å²	125.2	34%	0.336	64%	0.638	S	S	.	*	H	α-helix	trans	-64.7	-36.1	177.2	-154.9	0	0	0	0	112.5	S901 T902 L903	S901-S905 PolarHBondContact O-N 3.49Å; T902-S905 PolarHBondContact O-N 2.96Å; L903-S905 VanDerWaalsContact C-N 3.3Å; L903-S905 PolarHBondContact O-N 3.04Å
906	W	49.3	Very low	44.3	Very low	133 Å²	133	125.1 Å²	125.1	50%	0.504	63%	0.63	S	S	.	*	H	α-helix	trans	-76.1	-22	177.5	-83.5	42.9	0	0	0	113.5	N846 T902 L903 D904	N846-W906 HydrophobicContact CB-CH2 4.26Å; N846-W906 HydrophobicContact CB-CZ2 4.05Å; T902-W906 PolarHBondContact O-N 3.07Å; L903-W906 PolarHBondContact O-N 3.25Å; D904-W906 VanDerWaalsContact C-N 3.33Å; D904-W906 PolarHBondContact O-N 3.33Å
907	L	49.1	Very low	45	Very low	129 Å²	129	121.7 Å²	121.7	68%	0.675	62%	0.617	S	S	*	*	H	α-helix	trans	-83.2	-11.9	176	-85.5	160.6	0	0	0	113.6	L903 D904	L903-L907 HydrophobicContact CD2-CD1 4.12Å; L903-L907 PolarHBondContact O-N 3.11Å; D904-L907 PolarHBondContact O-N 3.27Å
908	I	50.6	Low	45.8	Very low	126 Å²	126	117.9 Å²	117.9	65%	0.646	60%	0.603	S	S	*	*	H	α-helix	trans	-98.6	-15.9	-175.3	-69.4	166.3	0	0	0	112.8	D904	D904-I908 VanDerWaalsContact O-CD1 3.28Å; D904-I908 WeakPolarHBondContact O-CD1 3.34Å; D904-I908 VanDerWaalsContact O-CG1 3.23Å; D904-I908 WeakPolarHBondContact O-CG1 3.47Å; D904-I908 PolarHBondContact O-N 3.33Å
909	E	46.4	Very low	46.5	Very low	148 Å²	148	114.8 Å²	114.8	69%	0.692	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	18.9	-175.8	-69.8	-173.8	140.7	0	0	115
910	N	40.6	Very low	46.8	Very low	143 Å²	143	111.1 Å²	111.1	77%	0.765	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	19.6	-178.6	-76.4	-65.7	0	0	0	115.2
911	D	32.3	Very low	47.1	Very low	232 Å²	232	112.2 Å²	112.2	100%	1.241	58%	0.584	S	S	*	*			trans	-119.1	0	171.3	-93.9	-21.6	0	0	0	111.2

Retrieved 911 of 911 residues in 914.1 ms (Link to these results)

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