A0A077ZI62_TRITR Loading...

Rhomboid family protein

AlphaFold DB , UniProt , Accession A0A077ZI62, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,357 aa.

						>A0A077ZI62_TRITR|A0A077ZI62
MHGKGNEWHDSKKTLCKSVSAPSGRSDGTPSLRSAGTLENLKNQLSSNAASYFGLLPSSEACMQKWTNRRLRHCSRRYGGVRDPTQSFIDGVGGVSCRIRDPLALGRAQSVRSAAASLGRSMSVDSRTSKVRVLQRRESVAKLAWDKFSSLLRVSLFFVHPFIVYFCPADVIGDDTVFEVDRLAAEGPGIDVVDSVPMDTISEEDTAQSFGRLAAKRRAKEESSEFLKDESPLQDEVFFDFLPPSATSAHRLSENFPFNFARVSRATPQTTIMESTPGEHMDVIDGRQAVEPEALHHGQLGSNLRRLKDAVSRPTYISDRYATGQPVSTSPWSRFWSGLCSILLRRKGRRKFGEGVVGHFLGRTLRRRSELSPQVVQQLDDFDDYRPFFTYWITTVQVLVMIIALVSYGFGPIGFWRTHYSAMVLQPSLVLEQVAYFEQDNFYIGPRYADLVHLGAKYAPCMRRDLNVYSVVEENRRQENQSGCCIFHDKSGCVQTTEDRCPQLLAVWDKWSTSNPGPDGRVSGAVCGQDPRACAIPASISPLEWPDDLTRWPLCRETNEGVSLRHTECELTGRPCCIGIQGECRITTREYCDFVRGYFHEEATLCSQVSCLGEVCGMVPFLKSENPDQFSRLLIPLFLHAGIIHCLVTVIIQHFLLRDLEKLVGWSRVAIIYLVSGIGGNLGSAVFVPYQAEVGPAGSQFGLLAGLIVDVVYSWKMIARPWRALGQLVTFVCLLFLVGLLPWIDNYAHAFGFIFGLLLSLALFPYIQFSKNDRRKRLIIVGASLTLCVALLALLFVLFYVNPLWSCQNCMYFNSEQAQEVTALQAIYGDDFRMESESYPAKFCIALREELGDDGKPINVECTLCVTFTERYPQELAKVSLHWSEDVSEKDREQAAEQVLLVMEQNLGSPVIFSLVDVVQSHLLNIAERKRSEQKAKLLAEIELARQKEKEMEKNRESAVHQPMTYEQFLSWNLRFNEANARCRTKEVTEEKGRRLTGREQFLKDNSLVTSDVRMISQNGDEVVVDETLFEDDDIAASSPPPSNALSSSLEANSSVRATTLGHFGAAALIEVKSKFDAEFRRFSVDRTAVGSVEQFRKLVGGLHHVEDIPFTLCYSDPHGDLLPINNDENYRKALDSAHPLLRLLLQRKGESLEERYGYGTDSLKKRNRISRFLGAGAVTGPYSRAYDISMPQDFRQVSAIIDVDIVPECHRRVRLCKHGSEKPLGFYIRDGTSVRVSAQGLVKMPGIFISRLVPGGLAESTGLLAVNDEVLEVNGIEVAGKSLDQVTDMMIANASNLIITVRPADQRLTLARCNNNRGSQISKVSDTRSSMYASNESDEETEDEVKDLLSVNANAQ
					

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(Predicted Aligned Error values between residue pairs)

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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	33.3	Very low	29.5	Very low	173 Å²	173	145.5 Å²	145.5	85%	0.852	77%	0.765	S	S	*	*				0	165	0	-102.9	-165.5	175.2	0	0	109.7	G3 E279 H280	M1-G3 PolarHBondContact O-N 3.36Å; M1-E279 PolarHBondContact N-OE1 3.24Å; M1-E279 PolarHBondContact N-OE2 3.48Å; M1-H280 WeakPolarHBondContact CB-NE2 3.22Å; M1-H280 PolarHBondContact N-NE2 3.46Å
2	H	27.4	Very low	29.9	Very low	203 Å²	203	150 Å²	150	94%	0.94	77%	0.773	S	S	*	*			trans	-56.5	129.2	-171.1	-73.8	-18.2	0	0	0	116.3
3	G	28.6	Very low	30.1	Very low	65 Å²	65	152.1 Å²	152.1	67%	0.67	77%	0.773	S	S	*	*				117.7	144.2	98.3	0	0	0	0	0	118.3	M1	M1-G3 PolarHBondContact O-N 3.36Å
4	K	29.5	Very low	30.3	Very low	220 Å²	220	149.9 Å²	149.9	96%	0.957	77%	0.771	S	S	*	*			trans	37.6	128.1	150.8	-54.7	176	-177.3	177.7	0	117.4
5	G	27.3	Very low	30.3	Very low	71 Å²	71	150.3 Å²	150.3	73%	0.732	77%	0.774	S	S	*	*			cis	156.8	-163.5	23.3	0	0	0	0	0	108.9
6	N	31.5	Very low	30.1	Very low	163 Å²	163	148 Å²	148	87%	0.872	77%	0.773	S	S	*	*			trans	-70.2	166.4	-167.3	-56.4	-5.3	0	0	0	115.6
7	E	27.8	Very low	30.2	Very low	159 Å²	159	150.4 Å²	150.4	74%	0.743	78%	0.776	S	S	*	*			trans	109.4	144.9	134.5	-137.2	178	-127.8	0	0	119.3
8	W	26	Very low	30.2	Very low	192 Å²	192	147.9 Å²	147.9	73%	0.727	77%	0.774	S	S	*	*			trans	73.5	114.7	170.2	-59.9	93	0	0	0	122.3
9	H	29.1	Very low	30.3	Very low	151 Å²	151	147.6 Å²	147.6	70%	0.699	78%	0.779	S	S	*	*				43.5	151.3	120.1	-79.1	-94.5	0	0	0	121.9
10	D	33.7	Very low	30.4	Very low	126 Å²	126	145.6 Å²	145.6	67%	0.674	78%	0.777	S	S	*	*			cis	-158.5	152	21	-152.8	11	0	0	0	117.2
11	S	30.9	Very low	30.5	Very low	78 Å²	78	143 Å²	143	55%	0.545	78%	0.776	S	S	.	*			trans	30.4	121.4	144.6	-67.1	0	0	0	0	124.8
12	K	34.1	Very low	30.5	Very low	199 Å²	199	140.7 Å²	140.7	87%	0.865	77%	0.774	S	S	*	*				-173.8	120.8	113.5	-96	151	-172.9	169.3	0	110.1
13	K	32.6	Very low	30.7	Very low	177 Å²	177	137 Å²	137	77%	0.77	77%	0.771	S	S	*	*				60.2	129.7	64.2	-70	-172.6	175.6	174.7	0	113.3
14	T	32.1	Very low	30.8	Very low	122 Å²	122	137.8 Å²	137.8	75%	0.748	78%	0.78	S	S	*	*			cis	-162.8	172.2	-2.9	6.4	0	0	0	0	106.9
15	L	30.5	Very low	30.7	Very low	155 Å²	155	138.9 Å²	138.9	81%	0.812	78%	0.778	S	S	*	*			cis	-169.4	162.4	46.8	-166.5	70.5	0	0	0	110.6
16	C	28.1	Very low	30.7	Very low	114 Å²	114	140 Å²	140	77%	0.77	78%	0.775	S	S	*	*			trans	-145.8	168.2	169.7	-167.9	0	0	0	0	110.5
17	K	31.3	Very low	30.6	Very low	189 Å²	189	140.2 Å²	140.2	82%	0.822	78%	0.776	S	S	*	*			trans	69.2	152	-174.9	-56	179.7	-180	-179.3	0	113.7
18	S	30	Very low	30.7	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	78%	0.777	S	S	*	*			cis	-177.7	157.2	-14	49.1	0	0	0	0	108.6
19	V	32.3	Very low	31	Very low	142 Å²	142	134.2 Å²	134.2	86%	0.861	79%	0.786	S	S	*	*			trans	-179.9	147.3	141	140.4	0	0	0	0	112.9
20	S	32.6	Very low	31.2	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	79%	0.793	S	S	*	*			trans	-47.4	160.1	-178.4	-38.2	0	0	0	0	120.1
21	A	31.4	Very low	31	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	80%	0.797	S	S	*	*			trans	-71.2	168.8	161.8	0	0	0	0	0	112.9
22	P	34.4	Very low	31	Very low	125 Å²	125	135.4 Å²	135.4	81%	0.812	81%	0.806	S	S	*	*				-139.7	178.7	106.7	40.4	-29.6	0	0	0	114.8
23	S	30.5	Very low	31	Very low	124 Å²	124	138 Å²	138	87%	0.867	81%	0.811	S	S	*	*			trans	-70.4	146.4	-176	50	0	0	0	0	115.3
24	G	30.7	Very low	31.1	Very low	83 Å²	83	133.7 Å²	133.7	86%	0.856	80%	0.803	S	S	*	*			trans	-160	145	172	0	0	0	0	0	111.2
25	R	27.9	Very low	31.6	Very low	243 Å²	243	131.7 Å²	131.7	92%	0.917	80%	0.798	S	S	*	*			trans	-114.3	164.2	-169.7	-160.3	176	-172.8	165.9	2.6	111.6
26	S	28.1	Very low	32.3	Very low	95 Å²	95	126.7 Å²	126.7	66%	0.664	79%	0.785	S	S	*	*			trans	68.7	122	165.2	50.9	0	0	0	0	119.9
27	D	28.8	Very low	33.3	Very low	167 Å²	167	126.4 Å²	126.4	89%	0.893	78%	0.78	S	S	*	*			trans	50.7	120.1	131	-47.9	-24.1	0	0	0	121.5
28	G	28.9	Very low	34	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	77%	0.769	S	S	*	*			trans	159.3	102.5	157.7	0	0	0	0	0	115.8	P30	G28-P30 WeakPolarHBondContact O-CD 3.29Å
29	T	33.2	Very low	35.3	Very low	150 Å²	150	122.4 Å²	122.4	92%	0.92	76%	0.755	S	S	*	*			trans	-88	130.6	168.7	53.2	0	0	0	0	112.4
30	P	33	Very low	36.7	Very low	129 Å²	129	121 Å²	121	84%	0.838	74%	0.743	S	S	*	*			trans	-126.4	175.9	158.1	31.7	-14.3	0	0	0	113.3	G28	G28-P30 WeakPolarHBondContact O-CD 3.29Å
31	S	29.8	Very low	37.8	Very low	109 Å²	109	120.2 Å²	120.2	76%	0.762	73%	0.73	S	S	*	*			trans	-130.1	160.3	-157.8	60	0	0	0	0	116.5
32	L	31.8	Very low	39.4	Very low	142 Å²	142	121.6 Å²	121.6	74%	0.743	72%	0.719	S	S	*	*			trans	21.5	126.9	159.8	-78.1	81	0	0	0	120.3
33	R	32.3	Very low	40.8	Very low	254 Å²	254	120.2 Å²	120.2	96%	0.958	70%	0.704	S	S	*	*			trans	-133.2	121.9	132	-71.1	-169.2	174.6	-174.2	-1	110
34	S	35.5	Very low	42.5	Very low	86 Å²	86	119.9 Å²	119.9	60%	0.601	69%	0.689	S	S	*	*			trans	-139.3	49.3	-161.9	64.7	0	0	0	0	114.1
35	A	42	Very low	44	Very low	79 Å²	79	121.4 Å²	121.4	65%	0.653	68%	0.677	S	S	*	*	S	Bend	trans	-108.3	-70.6	-178.8	0	0	0	0	0	112.9	T37 L38	A35-T37 VanDerWaalsContact C-N 3.29Å; A35-T37 PolarHBondContact O-N 3.27Å; A35-L38 PolarHBondContact O-N 3.32Å; A35-L38 VanDerWaalsContact O-N 3.12Å
36	G	45.2	Very low	45.6	Very low	51 Å²	51	111.7 Å²	111.7	53%	0.526	65%	0.647	S	S	.	*	H	α-helix	trans	-59.5	-33.8	-172.6	0	0	0	0	0	114.8	L38 E39 N40	G36-L38 VanDerWaalsContact C-N 3.26Å; G36-L38 PolarHBondContact O-N 2.82Å; G36-E39 PolarHBondContact O-N 3Å; G36-N40 PolarHBondContact O-N 3.33Å; G36-N40 VanDerWaalsContact O-N 3.17Å
37	T	49.4	Very low	47.1	Very low	108 Å²	108	110.1 Å²	110.1	66%	0.663	64%	0.635	S	S	*	*	H	α-helix	trans	-60.4	-34.3	178.8	-25.1	0	0	0	0	112.6	A35 L41	A35-T37 VanDerWaalsContact C-N 3.29Å; A35-T37 PolarHBondContact O-N 3.27Å; T37-L41 VanDerWaalsContact O-CB 3.29Å; T37-L41 WeakPolarHBondContact O-CB 3.14Å; T37-L41 PolarHBondContact O-N 2.87Å
38	L	46.9	Very low	48.8	Very low	114 Å²	114	106.8 Å²	106.8	60%	0.597	62%	0.617	S	S	*	*	H	α-helix	trans	-74.3	-37.2	-177.7	-173	64.9	0	0	0	111.9	A35 G36 K42	A35-L38 PolarHBondContact O-N 3.32Å; A35-L38 VanDerWaalsContact O-N 3.12Å; G36-L38 VanDerWaalsContact C-N 3.26Å; G36-L38 PolarHBondContact O-N 2.82Å; L38-K42 WeakPolarHBondContact O-CB 3.33Å; L38-K42 PolarHBondContact O-N 3.33Å
39	E	56	Low	50.3	Low	96 Å²	96	104.9 Å²	104.9	45%	0.449	59%	0.594	S	S	.	*	H	α-helix	trans	-68	-42.7	176.6	-141.7	67.8	-119	0	0	110.7	G36 K42 N43	G36-E39 PolarHBondContact O-N 3Å; E39-K42 PolarHBondContact O-N 2.82Å; E39-K42 WeakPolarHBondContact OE1-CD 3.26Å; E39-K42 WeakPolarHBondContact OE1-CE 3.36Å; E39-K42 IonicContact OE1-NZ 3.96Å; E39-K42 PolarHBondContact OE1-NZ 3.39Å; E39-N43 WeakPolarHBondContact O-CB 3.46Å; E39-N43 VanDerWaalsContact O-CG 3.29Å; E39-N43 PolarHBondContact O-N 2.86Å; E39-N43 PolarHBondContact O-ND2 3.09Å
40	N	62.1	Low	51.6	Low	113 Å²	113	98.8 Å²	98.8	60%	0.604	56%	0.559	S	S	*	*	H	α-helix	trans	-63.2	-46.5	173.6	-81.1	-0.5	0	0	0	112.4	G36 K42 N43 Q44	G36-N40 PolarHBondContact O-N 3.33Å; G36-N40 VanDerWaalsContact O-N 3.17Å; N40-K42 VanDerWaalsContact C-N 3.29Å; N40-K42 PolarHBondContact O-N 3.35Å; N40-N43 PolarHBondContact O-N 3Å; N40-Q44 PolarHBondContact O-N 3.39Å
41	L	56	Low	52.9	Low	91 Å²	91	97 Å²	97	48%	0.476	55%	0.55	S	S	.	.	H	α-helix	trans	-60.6	-39.7	177.3	-166.5	82.9	0	0	0	111.7	T37 Q44 L45	T37-L41 VanDerWaalsContact O-CB 3.29Å; T37-L41 WeakPolarHBondContact O-CB 3.14Å; T37-L41 PolarHBondContact O-N 2.87Å; L41-Q44 PolarHBondContact O-N 2.97Å; L41-L45 HydrophobicContact CD2-CD1 4.3Å; L41-L45 HydrophobicContact CG-CD1 4.11Å; L41-L45 VanDerWaalsContact O-CB 3.32Å; L41-L45 WeakPolarHBondContact O-CB 3.44Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.44Å; L41-L45 PolarHBondContact O-N 2.65Å
42	K	65.5	Low	54.3	Low	120 Å²	120	100.8 Å²	100.8	52%	0.522	55%	0.549	S	S	.	.	H	α-helix	trans	-68.2	-35.2	178	176.1	-178.6	165.7	-158.2	0	112.3	L38 E39 N40 S46	L38-K42 WeakPolarHBondContact O-CB 3.33Å; L38-K42 PolarHBondContact O-N 3.33Å; E39-K42 PolarHBondContact O-N 2.82Å; E39-K42 WeakPolarHBondContact OE1-CD 3.26Å; E39-K42 WeakPolarHBondContact OE1-CE 3.36Å; E39-K42 IonicContact OE1-NZ 3.96Å; E39-K42 PolarHBondContact OE1-NZ 3.39Å; N40-K42 VanDerWaalsContact C-N 3.29Å; N40-K42 PolarHBondContact O-N 3.35Å; K42-S46 PolarHBondContact O-N 2.66Å
43	N	64	Low	55.3	Low	95 Å²	95	100.7 Å²	100.7	51%	0.508	54%	0.543	S	S	.	.	H	α-helix	trans	-71.3	-46.1	172	-71.4	-19.2	0	0	0	111.4	E39 N40 L45 S46 S47	E39-N43 WeakPolarHBondContact O-CB 3.46Å; E39-N43 VanDerWaalsContact O-CG 3.29Å; E39-N43 PolarHBondContact O-N 2.86Å; E39-N43 PolarHBondContact O-ND2 3.09Å; N40-N43 PolarHBondContact O-N 3Å; N43-L45 PolarHBondContact O-N 3.35Å; N43-S46 CarbonylContact O-C 3.53Å; N43-S46 WeakPolarHBondContact O-CA 3.4Å; N43-S46 WeakPolarHBondContact O-CB 3.4Å; N43-S46 PolarHBondContact O-N 3.38Å; N43-S47 PolarHBondContact O-N 3.17Å; N43-S47 PolarHBondContact O-OG 2.84Å
44	Q	66	Low	55.7	Low	118 Å²	118	91.6 Å²	91.6	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-58	-45.6	173.2	-99.7	-168.2	-30.3	0	0	112.5	N40 L41 S46 S47 N48	N40-Q44 PolarHBondContact O-N 3.39Å; L41-Q44 PolarHBondContact O-N 2.97Å; Q44-S46 PolarHBondContact O-N 2.73Å; Q44-S47 WeakPolarHBondContact CA-OG 3.22Å; Q44-S47 PolarHBondContact O-N 2.89Å; Q44-S47 PolarHBondContact O-OG 3.37Å; Q44-N48 VanDerWaalsContact O-CB 3.23Å; Q44-N48 WeakPolarHBondContact O-CB 3.39Å; Q44-N48 PolarHBondContact O-N 2.97Å; Q44-N48 PolarHBondContact O-OD1 3Å; Q44-N48 VanDerWaalsContact O-OD1 3.13Å
45	L	61.2	Low	56.7	Low	114 Å²	114	90.5 Å²	90.5	60%	0.597	52%	0.515	S	S	*	.	H	α-helix	trans	-62.1	-28.1	175.5	-77.3	165	0	0	0	112.1	L41 N43 A49	L41-L45 HydrophobicContact CD2-CD1 4.3Å; L41-L45 HydrophobicContact CG-CD1 4.11Å; L41-L45 VanDerWaalsContact O-CB 3.32Å; L41-L45 WeakPolarHBondContact O-CB 3.44Å; L41-L45 VanDerWaalsContact O-CG 3.27Å; L41-L45 WeakPolarHBondContact O-CG 3.44Å; L41-L45 PolarHBondContact O-N 2.65Å; N43-L45 PolarHBondContact O-N 3.35Å; L45-A49 WeakPolarHBondContact O-CB 3.46Å; L45-A49 PolarHBondContact O-N 3.48Å
46	S	61.7	Low	57.1	Low	40 Å²	40	93.5 Å²	93.5	28%	0.28	52%	0.519	S	S	.	.	H	α-helix	trans	-79.9	-39.1	175.1	-158.5	0	0	0	0	112.9	K42 N43 Q44 A50	K42-S46 PolarHBondContact O-N 2.66Å; N43-S46 CarbonylContact O-C 3.53Å; N43-S46 WeakPolarHBondContact O-CA 3.4Å; N43-S46 WeakPolarHBondContact O-CB 3.4Å; N43-S46 PolarHBondContact O-N 3.38Å; Q44-S46 PolarHBondContact O-N 2.73Å; S46-A50 WeakPolarHBondContact O-CB 3.35Å; S46-A50 PolarHBondContact O-N 3.45Å; S46-A50 VanDerWaalsContact O-N 3.09Å
47	S	60.2	Low	57.4	Low	61 Å²	61	96.7 Å²	96.7	43%	0.427	53%	0.531	S	S	.	.	H	α-helix	trans	-68.7	-43	174.9	56.8	0	0	0	0	111.6	N43 Q44 A49 A50 S51	N43-S47 PolarHBondContact O-N 3.17Å; N43-S47 PolarHBondContact O-OG 2.84Å; Q44-S47 WeakPolarHBondContact CA-OG 3.22Å; Q44-S47 PolarHBondContact O-N 2.89Å; Q44-S47 PolarHBondContact O-OG 3.37Å; S47-A49 PolarHBondContact O-N 3.18Å; S47-A50 WeakPolarHBondContact O-CB 3.19Å; S47-A50 PolarHBondContact O-N 3.07Å; S47-A50 VanDerWaalsContact O-N 3.15Å; S47-S51 WeakPolarHBondContact O-CB 3.32Å; S47-S51 PolarHBondContact O-N 3.17Å
48	N	63.4	Low	57.2	Low	97 Å²	97	96.9 Å²	96.9	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-70.7	-35.3	-177.7	-62	9.9	0	0	0	110.5	Q44 S51 Y52	Q44-N48 VanDerWaalsContact O-CB 3.23Å; Q44-N48 WeakPolarHBondContact O-CB 3.39Å; Q44-N48 PolarHBondContact O-N 2.97Å; Q44-N48 PolarHBondContact O-OD1 3Å; Q44-N48 VanDerWaalsContact O-OD1 3.13Å; N48-S51 PolarHBondContact O-N 3.12Å; N48-Y52 VanDerWaalsContact O-CB 3.29Å; N48-Y52 WeakPolarHBondContact O-CB 3.36Å; N48-Y52 PolarHBondContact O-N 2.91Å
49	A	62	Low	57.4	Low	35 Å²	35	94.2 Å²	94.2	29%	0.289	53%	0.528	S	S	.	.	H	α-helix	trans	-67.6	-33.9	170	0	0	0	0	0	113.2	L45 S47 F53	L45-A49 WeakPolarHBondContact O-CB 3.46Å; L45-A49 PolarHBondContact O-N 3.48Å; S47-A49 PolarHBondContact O-N 3.18Å; A49-F53 WeakPolarHBondContact O-CD2 3.48Å; A49-F53 PolarHBondContact O-N 3.18Å
50	A	59.9	Low	57.4	Low	22 Å²	22	97.8 Å²	97.8	18%	0.182	54%	0.544	C	S	.	.	H	α-helix	trans	-68.5	-43.8	173.9	0	0	0	0	0	111.5	S46 S47 F53 G54 L55	S46-A50 WeakPolarHBondContact O-CB 3.35Å; S46-A50 PolarHBondContact O-N 3.45Å; S46-A50 VanDerWaalsContact O-N 3.09Å; S47-A50 WeakPolarHBondContact O-CB 3.19Å; S47-A50 PolarHBondContact O-N 3.07Å; S47-A50 VanDerWaalsContact O-N 3.15Å; A50-F53 CarbonylContact O-C 3.58Å; A50-F53 PolarHBondContact O-N 3.3Å; A50-G54 PolarHBondContact O-N 2.87Å; A50-L55 HydrophobicContact CB-CB 4.34Å; A50-L55 WeakPolarHBondContact O-CB 3.4Å; A50-L55 PolarHBondContact O-N 3.42Å
51	S	59	Low	57.3	Low	91 Å²	91	95 Å²	95	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-59	-47.8	174.5	-173.7	0	0	0	0	112.1	S47 N48 F53 G54	S47-S51 WeakPolarHBondContact O-CB 3.32Å; S47-S51 PolarHBondContact O-N 3.17Å; N48-S51 PolarHBondContact O-N 3.12Å; S51-F53 PolarHBondContact O-N 2.89Å; S51-F53 VanDerWaalsContact O-N 3.1Å; S51-G54 PolarHBondContact O-N 3.14Å
52	Y	60.1	Low	57.2	Low	189 Å²	189	93.2 Å²	93.2	74%	0.741	53%	0.532	S	S	*	.	H	α-helix	trans	-57.8	-25.3	176.5	-174.9	-90.2	0	0	0	113.9	N48	N48-Y52 VanDerWaalsContact O-CB 3.29Å; N48-Y52 WeakPolarHBondContact O-CB 3.36Å; N48-Y52 PolarHBondContact O-N 2.91Å
53	F	52.3	Low	56.9	Low	141 Å²	141	93.2 Å²	93.2	62%	0.618	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	20.1	174.6	-68.4	-60.5	0	0	0	113.7	A49 A50 S51 L55	A49-F53 WeakPolarHBondContact O-CD2 3.48Å; A49-F53 PolarHBondContact O-N 3.18Å; A50-F53 CarbonylContact O-C 3.58Å; A50-F53 PolarHBondContact O-N 3.3Å; S51-F53 PolarHBondContact O-N 2.89Å; S51-F53 VanDerWaalsContact O-N 3.1Å; F53-L55 VanDerWaalsContact C-N 3.32Å; F53-L55 PolarHBondContact O-N 3.36Å
54	G	40.8	Very low	57	Low	63 Å²	63	95 Å²	95	65%	0.649	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	19.6	172.1	0	0	0	0	0	115.3	A50 S51 L56	A50-G54 PolarHBondContact O-N 2.87Å; S51-G54 PolarHBondContact O-N 3.14Å; G54-L56 PolarHBondContact O-N 2.95Å
55	L	56.3	Low	56.9	Low	62 Å²	62	96.3 Å²	96.3	33%	0.325	54%	0.544	S	S	.	.			trans	-91.3	91.5	-176.3	-66.3	169.5	0	0	0	111.3	A50 F53 W66	A50-L55 HydrophobicContact CB-CB 4.34Å; A50-L55 WeakPolarHBondContact O-CB 3.4Å; A50-L55 PolarHBondContact O-N 3.42Å; F53-L55 VanDerWaalsContact C-N 3.32Å; F53-L55 PolarHBondContact O-N 3.36Å; L55-W66 HydrophobicContact CD1-CB 4.29Å; L55-W66 HydrophobicContact CD1-CG 3.88Å
56	L	51.4	Low	56.7	Low	142 Å²	142	93.7 Å²	93.7	74%	0.743	53%	0.526	S	S	*	.			trans	-59.4	151.2	174.2	-77.1	152.3	0	0	0	112.4	G54 S58	G54-L56 PolarHBondContact O-N 2.95Å; L56-S58 PolarHBondContact O-N 3.18Å
57	P	52	Low	56.8	Low	119 Å²	119	94.4 Å²	94.4	77%	0.773	53%	0.529	S	S	*	.	S	Bend	trans	-71.9	-0.3	-168.3	-19.7	33.8	0	0	0	116.6	S59	P57-S59 PolarHBondContact O-N 3.22Å
58	S	45.1	Very low	57	Low	112 Å²	112	94.7 Å²	94.7	78%	0.783	53%	0.526	S	S	*	.	S	Bend	trans	-83.6	9	-153.8	53.8	0	0	0	0	117.3	L56	L56-S58 PolarHBondContact O-N 3.18Å
59	S	51.2	Low	56.9	Low	58 Å²	58	99.4 Å²	99.4	41%	0.406	54%	0.536	S	S	.	.			trans	-158.6	130.8	164.1	57.3	0	0	0	0	114.3	P57 A61 C62 M63	P57-S59 PolarHBondContact O-N 3.22Å; S59-A61 PolarHBondContact O-N 2.91Å; S59-C62 PolarHBondContact O-N 3.38Å; S59-C62 VanDerWaalsContact OG-CB 3.32Å; S59-C62 WeakPolarHBondContact OG-CB 3.42Å; S59-M63 PolarHBondContact O-N 2.82Å
60	E	55.6	Low	56.6	Low	170 Å²	170	104.1 Å²	104.1	79%	0.794	55%	0.546	S	S	*	.	H	α-helix	trans	-55.1	-39	171.3	-63.6	-172.2	117.2	0	0	111.6	C62 M63 Q64	E60-C62 PolarHBondContact O-N 3.16Å; E60-M63 PolarHBondContact O-N 3.04Å; E60-M63 VanDerWaalsContact O-N 3.15Å; E60-Q64 VanDerWaalsContact O-CB 3.29Å; E60-Q64 WeakPolarHBondContact O-CB 3.24Å; E60-Q64 PolarHBondContact O-N 3.4Å
61	A	59.4	Low	56.5	Low	56 Å²	56	108 Å²	108	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-59.2	-31.6	177.9	0	0	0	0	0	113.4	S59 K65	S59-A61 PolarHBondContact O-N 2.91Å; A61-K65 WeakPolarHBondContact O-CB 3.49Å; A61-K65 WeakPolarHBondContact O-CD 3.46Å; A61-K65 WeakPolarHBondContact O-CG 3.4Å; A61-K65 PolarHBondContact O-N 3.49Å; A61-K65 VanDerWaalsContact O-N 3.13Å
62	C	53.3	Low	56.3	Low	53 Å²	53	111.9 Å²	111.9	36%	0.358	56%	0.564	S	S	.	*	H	α-helix	trans	-76.9	-44	174.7	-162.8	0	0	0	0	111.3	S59 E60 Q64 K65 W66	S59-C62 PolarHBondContact O-N 3.38Å; S59-C62 VanDerWaalsContact OG-CB 3.32Å; S59-C62 WeakPolarHBondContact OG-CB 3.42Å; E60-C62 PolarHBondContact O-N 3.16Å; C62-Q64 VanDerWaalsContact C-N 3.32Å; C62-Q64 PolarHBondContact O-N 3.24Å; C62-K65 WeakPolarHBondContact O-CB 3.34Å; C62-K65 PolarHBondContact O-N 2.95Å; C62-K65 VanDerWaalsContact O-N 3.16Å; C62-W66 PolarHBondContact O-N 2.93Å
63	M	60.2	Low	55.9	Low	120 Å²	120	108 Å²	108	59%	0.591	55%	0.553	S	S	*	*	H	α-helix	trans	-60.5	-41.4	175.5	-159.3	-167.6	-57.4	0	0	111.6	S59 E60 W66 T67	S59-M63 PolarHBondContact O-N 2.82Å; E60-M63 PolarHBondContact O-N 3.04Å; E60-M63 VanDerWaalsContact O-N 3.15Å; M63-W66 WeakPolarHBondContact O-CB 3.33Å; M63-W66 PolarHBondContact O-N 3.3Å; M63-T67 PolarHBondContact O-N 3.47Å; M63-T67 PolarHBondContact O-OG1 3.24Å
64	Q	66.2	Low	55.7	Low	133 Å²	133	103.8 Å²	103.8	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-69.8	-33.1	177	-155.1	-179.4	38.5	0	0	111.9	E60 C62 N68	E60-Q64 VanDerWaalsContact O-CB 3.29Å; E60-Q64 WeakPolarHBondContact O-CB 3.24Å; E60-Q64 PolarHBondContact O-N 3.4Å; C62-Q64 VanDerWaalsContact C-N 3.32Å; C62-Q64 PolarHBondContact O-N 3.24Å; Q64-N68 VanDerWaalsContact O-CB 3.23Å; Q64-N68 WeakPolarHBondContact O-CB 3.47Å; Q64-N68 PolarHBondContact O-N 3.03Å; Q64-N68 PolarHBondContact O-ND2 2.92Å
65	K	63	Low	56.2	Low	145 Å²	145	103.4 Å²	103.4	63%	0.63	53%	0.528	S	S	*	.	H	α-helix	trans	-65.1	-41	168.2	-79.9	168.8	-176.8	172.5	0	111.8	A61 C62 N68 R69	A61-K65 WeakPolarHBondContact O-CB 3.49Å; A61-K65 WeakPolarHBondContact O-CD 3.46Å; A61-K65 WeakPolarHBondContact O-CG 3.4Å; A61-K65 PolarHBondContact O-N 3.49Å; A61-K65 VanDerWaalsContact O-N 3.13Å; C62-K65 WeakPolarHBondContact O-CB 3.34Å; C62-K65 PolarHBondContact O-N 2.95Å; C62-K65 VanDerWaalsContact O-N 3.16Å; K65-N68 PolarHBondContact O-N 3.16Å; K65-R69 WeakPolarHBondContact O-CG 3.33Å; K65-R69 PolarHBondContact O-N 3.16Å
66	W	57.6	Low	55.7	Low	59 Å²	59	111.2 Å²	111.2	22%	0.223	55%	0.553	C	S	.	*	H	α-helix	trans	-64.7	-48.7	175.4	-179.2	87.5	0	0	0	111.7	L55 C62 M63 N68 R69 R70	L55-W66 HydrophobicContact CD1-CB 4.29Å; L55-W66 HydrophobicContact CD1-CG 3.88Å; C62-W66 PolarHBondContact O-N 2.93Å; M63-W66 WeakPolarHBondContact O-CB 3.33Å; M63-W66 PolarHBondContact O-N 3.3Å; W66-N68 VanDerWaalsContact C-N 3.31Å; W66-N68 PolarHBondContact O-N 3.41Å; W66-R69 CarbonylContact O-C 3.52Å; W66-R69 WeakPolarHBondContact O-CA 3.33Å; W66-R69 WeakPolarHBondContact O-CB 3.32Å; W66-R69 PolarHBondContact O-N 2.95Å; W66-R70 VanDerWaalsContact CH2-NH1 3.35Å; W66-R70 WeakPolarHBondContact O-CB 3.45Å; W66-R70 PolarHBondContact O-N 2.94Å
67	T	63.1	Low	55.2	Low	55 Å²	55	111.4 Å²	111.4	34%	0.337	54%	0.544	S	S	.	.	H	α-helix	trans	-60.9	-39.5	176.4	-61.7	0	0	0	0	111.6	M63 R70 L71	M63-T67 PolarHBondContact O-N 3.47Å; M63-T67 PolarHBondContact O-OG1 3.24Å; T67-R70 PolarHBondContact O-N 3.41Å; T67-L71 HydrophobicContact CG2-CD1 4.03Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 WeakPolarHBondContact O-CG 3.49Å; T67-L71 PolarHBondContact O-N 3.01Å
68	N	66.1	Low	54.6	Low	66 Å²	66	112.9 Å²	112.9	35%	0.353	54%	0.535	S	S	.	.	H	α-helix	trans	-68.9	-31.5	172.7	-84.9	-62.5	0	0	0	114.1	Q64 K65 W66 R72	Q64-N68 VanDerWaalsContact O-CB 3.23Å; Q64-N68 WeakPolarHBondContact O-CB 3.47Å; Q64-N68 PolarHBondContact O-N 3.03Å; Q64-N68 PolarHBondContact O-ND2 2.92Å; K65-N68 PolarHBondContact O-N 3.16Å; W66-N68 VanDerWaalsContact C-N 3.31Å; W66-N68 PolarHBondContact O-N 3.41Å; N68-R72 WeakPolarHBondContact O-CB 3.45Å; N68-R72 VanDerWaalsContact O-CG 3.29Å; N68-R72 WeakPolarHBondContact O-CG 3.33Å; N68-R72 PolarHBondContact O-N 3.17Å; N68-R72 PolarHBondContact O-NE 3.33Å
69	R	60.2	Low	54.1	Low	197 Å²	197	109.7 Å²	109.7	74%	0.743	52%	0.519	S	S	*	.	H	α-helix	trans	-68.4	-45.1	170.1	-81.2	-178.6	172.7	-176.8	-1.4	110.8	K65 W66 R72 H73	K65-R69 WeakPolarHBondContact O-CG 3.33Å; K65-R69 PolarHBondContact O-N 3.16Å; W66-R69 CarbonylContact O-C 3.52Å; W66-R69 WeakPolarHBondContact O-CA 3.33Å; W66-R69 WeakPolarHBondContact O-CB 3.32Å; W66-R69 PolarHBondContact O-N 2.95Å; R69-R72 PolarHBondContact O-N 2.99Å; R69-H73 VanDerWaalsContact O-CB 3.24Å; R69-H73 WeakPolarHBondContact O-CB 3.24Å; R69-H73 PolarHBondContact O-N 3.18Å
70	R	56.7	Low	53.5	Low	133 Å²	133	110.4 Å²	110.4	50%	0.502	54%	0.536	S	S	.	.	H	α-helix	trans	-58.3	-47.1	175	177.1	177	169.4	-176.6	-3.4	111.6	W66 T67 H73 C74	W66-R70 VanDerWaalsContact CH2-NH1 3.35Å; W66-R70 WeakPolarHBondContact O-CB 3.45Å; W66-R70 PolarHBondContact O-N 2.94Å; T67-R70 PolarHBondContact O-N 3.41Å; R70-H73 PolarHBondContact O-N 3Å; R70-C74 PolarHBondContact O-N 3.16Å; R70-C74 PolarHBondContact O-SG 3.36Å
71	L	57.1	Low	52.7	Low	105 Å²	105	108.1 Å²	108.1	55%	0.55	53%	0.534	S	S	.	.	H	α-helix	trans	-66.4	-43.1	176.5	-73.8	168.4	0	0	0	112.6	T67 H73 C74 S75	T67-L71 HydrophobicContact CG2-CD1 4.03Å; T67-L71 WeakPolarHBondContact O-CB 3.45Å; T67-L71 WeakPolarHBondContact O-CG 3.49Å; T67-L71 PolarHBondContact O-N 3.01Å; L71-H73 VanDerWaalsContact C-N 3.31Å; L71-H73 PolarHBondContact O-N 3.22Å; L71-C74 PolarHBondContact O-N 2.97Å; L71-S75 VanDerWaalsContact O-CB 3.31Å; L71-S75 WeakPolarHBondContact O-CB 3.33Å; L71-S75 PolarHBondContact O-N 3.2Å
72	R	54.1	Low	51.5	Low	171 Å²	171	116.8 Å²	116.8	65%	0.645	55%	0.554	S	S	*	*	H	α-helix	trans	-62.4	-36.9	172.6	-78.1	-179.9	-119.8	-167.3	-7	112.5	N68 R69 R76	N68-R72 WeakPolarHBondContact O-CB 3.45Å; N68-R72 VanDerWaalsContact O-CG 3.29Å; N68-R72 WeakPolarHBondContact O-CG 3.33Å; N68-R72 PolarHBondContact O-N 3.17Å; N68-R72 PolarHBondContact O-NE 3.33Å; R69-R72 PolarHBondContact O-N 2.99Å; R72-R76 WeakPolarHBondContact O-CB 3.33Å; R72-R76 WeakPolarHBondContact O-CG 3.31Å; R72-R76 PolarHBondContact O-N 2.95Å
73	H	52.8	Low	50.6	Low	107 Å²	107	121 Å²	121	50%	0.495	57%	0.574	S	S	.	*	H	α-helix	trans	-71.3	-35.5	177.1	-167.7	-83.2	0	0	0	112.1	R69 R70 L71 R77	R69-H73 VanDerWaalsContact O-CB 3.24Å; R69-H73 WeakPolarHBondContact O-CB 3.24Å; R69-H73 PolarHBondContact O-N 3.18Å; R70-H73 PolarHBondContact O-N 3Å; L71-H73 VanDerWaalsContact C-N 3.31Å; L71-H73 PolarHBondContact O-N 3.22Å; H73-R77 WeakPolarHBondContact O-CB 3.15Å; H73-R77 PolarHBondContact O-N 3.16Å
74	C	46.6	Very low	49.2	Very low	53 Å²	53	121.1 Å²	121.1	36%	0.358	58%	0.583	S	S	.	*	H	α-helix	trans	-68.3	-48	170	-74.2	0	0	0	0	111.9	R70 L71 R76 R77 Y78	R70-C74 PolarHBondContact O-N 3.16Å; R70-C74 PolarHBondContact O-SG 3.36Å; L71-C74 PolarHBondContact O-N 2.97Å; C74-R76 VanDerWaalsContact C-N 3.34Å; C74-R76 PolarHBondContact O-N 2.81Å; C74-R77 CarbonylContact O-C 3.25Å; C74-R77 PolarHBondContact O-N 2.72Å; C74-Y78 HydrophobicContact CB-CD2 4.38Å; C74-Y78 WeakPolarHBondContact O-CB 3.35Å; C74-Y78 PolarHBondContact O-N 3.29Å
75	S	52.6	Low	47.7	Very low	56 Å²	56	121.2 Å²	121.2	39%	0.392	59%	0.593	S	S	.	*	H	α-helix	trans	-56	-45.7	178	174.3	0	0	0	0	112	L71 R77 G79	L71-S75 VanDerWaalsContact O-CB 3.31Å; L71-S75 WeakPolarHBondContact O-CB 3.33Å; L71-S75 PolarHBondContact O-N 3.2Å; S75-R77 PolarHBondContact O-N 2.86Å; S75-G79 CarbonylContact O-C 3.26Å; S75-G79 WeakPolarHBondContact O-CA 3.38Å; S75-G79 PolarHBondContact O-N 3.32Å
76	R	46.3	Very low	46.1	Very low	226 Å²	226	123.8 Å²	123.8	85%	0.853	61%	0.607	S	S	*	*	H	α-helix	trans	-65.1	-18.7	174.6	-79	-176.1	169.1	-169.2	-3.5	115.1	R72 C74	R72-R76 WeakPolarHBondContact O-CB 3.33Å; R72-R76 WeakPolarHBondContact O-CG 3.31Å; R72-R76 PolarHBondContact O-N 2.95Å; C74-R76 VanDerWaalsContact C-N 3.34Å; C74-R76 PolarHBondContact O-N 2.81Å
77	R	40.6	Very low	44.8	Very low	145 Å²	145	126.1 Å²	126.1	55%	0.547	63%	0.633	S	S	.	*	H	α-helix	trans	-116.4	-9.9	-170.6	-153.5	-177.8	-141.8	-174.9	9.5	114.1	H73 C74 S75	H73-R77 WeakPolarHBondContact O-CB 3.15Å; H73-R77 PolarHBondContact O-N 3.16Å; C74-R77 CarbonylContact O-C 3.25Å; C74-R77 PolarHBondContact O-N 2.72Å; S75-R77 PolarHBondContact O-N 2.86Å
78	Y	38.8	Very low	43.1	Very low	151 Å²	151	132.3 Å²	132.3	59%	0.592	66%	0.655	S	S	*	*	H	α-helix	trans	-135.1	-3.3	-178.4	-67	-62.5	0	0	0	114.2	C74 K142	C74-Y78 HydrophobicContact CB-CD2 4.38Å; C74-Y78 WeakPolarHBondContact O-CB 3.35Å; C74-Y78 PolarHBondContact O-N 3.29Å; Y78-K142 PolarHBondContact OH-NZ 3.19Å; Y78-K142 VanDerWaalsContact OH-NZ 3.07Å
79	G	34.3	Very low	41.5	Very low	44 Å²	44	135 Å²	135	45%	0.454	67%	0.668	S	S	.	*			trans	91.1	168.3	-175.2	0	0	0	0	0	112.8	S75 V81	S75-G79 CarbonylContact O-C 3.26Å; S75-G79 WeakPolarHBondContact O-CA 3.38Å; S75-G79 PolarHBondContact O-N 3.32Å; G79-V81 PolarHBondContact O-N 3.26Å
80	G	38.1	Very low	40.1	Very low	74 Å²	74	133.4 Å²	133.4	76%	0.763	67%	0.674	S	S	*	*			trans	-67.2	112.7	-173.3	0	0	0	0	0	112.9
81	V	38.7	Very low	38.9	Very low	122 Å²	122	130.8 Å²	130.8	74%	0.739	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-70.9	132.8	160.4	-178.5	0	0	0	0	107.6	G79	G79-V81 PolarHBondContact O-N 3.26Å
82	R	35.8	Very low	37.6	Very low	237 Å²	237	133.6 Å²	133.6	89%	0.894	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-84.3	130	174.3	-125.1	179.5	-178	179.4	-1.1	108.9
83	D	34.3	Very low	36.3	Very low	143 Å²	143	128.2 Å²	128.2	77%	0.765	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-67.5	135.4	175.8	-62.9	-61	0	0	0	111.2	T85	D83-T85 PolarHBondContact O-N 3Å
84	P	30.9	Very low	35.1	Very low	121 Å²	121	127.5 Å²	127.5	79%	0.786	73%	0.729	S	S	*	*			trans	-87.3	91.6	178.4	33.5	-32.7	0	0	0	111.1
85	T	34.2	Very low	34.3	Very low	136 Å²	136	131.4 Å²	131.4	83%	0.834	75%	0.751	S	S	*	*			trans	-66.4	131.1	167.1	47.8	0	0	0	0	110.7	D83	D83-T85 PolarHBondContact O-N 3Å
86	Q	29.8	Very low	33.1	Very low	198 Å²	198	133.3 Å²	133.3	93%	0.925	77%	0.765	S	S	*	*			trans	-74	135.3	-174.2	-64.6	152.5	-75.8	0	0	113
87	S	29.7	Very low	32.2	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	76%	0.764	S	S	*	*			trans	-159.4	125.3	155.8	61.1	0	0	0	0	111.5
88	F	28.3	Very low	31.6	Very low	185 Å²	185	132.2 Å²	132.2	81%	0.811	78%	0.778	S	S	*	*			trans	57.1	100	165.9	-90.9	-108.6	0	0	0	118
89	I	31	Very low	31.3	Very low	122 Å²	122	133 Å²	133	63%	0.626	79%	0.791	S	S	*	*				79.3	127	78.5	-70.7	167.7	0	0	0	113.1
90	D	30.5	Very low	31.1	Very low	164 Å²	164	141.1 Å²	141.1	88%	0.877	81%	0.808	S	S	*	*			trans	60.7	136.3	167.7	-59.4	-19.2	0	0	0	121.1
91	G	31.6	Very low	30.8	Very low	78 Å²	78	143 Å²	143	80%	0.804	80%	0.8	S	S	*	*			trans	140.6	88.2	173.1	0	0	0	0	0	114.4	G93	G91-G93 PolarHBondContact O-N 3.29Å
92	V	29.7	Very low	30.7	Very low	164 Å²	164	143.1 Å²	143.1	99%	0.994	80%	0.804	S	S	*	*			trans	-73.8	118.4	175.8	178.5	0	0	0	0	110.8
93	G	27.9	Very low	30.7	Very low	59 Å²	59	139.4 Å²	139.4	61%	0.608	80%	0.801	S	S	*	*			trans	168.6	121	172	0	0	0	0	0	113.2	G91 V95	G91-G93 PolarHBondContact O-N 3.29Å; G93-V95 PolarHBondContact O-N 3.45Å
94	G	28.4	Very low	30.6	Very low	91 Å²	91	136.2 Å²	136.2	94%	0.938	80%	0.795	S	S	*	*			trans	-62.8	123.5	-168.5	0	0	0	0	0	115.3
95	V	28.2	Very low	30.7	Very low	135 Å²	135	138.3 Å²	138.3	82%	0.818	80%	0.799	S	S	*	*			trans	-102.1	107.3	176.9	-177.8	0	0	0	0	110.9	G93 C97	G93-V95 PolarHBondContact O-N 3.45Å; V95-C97 PolarHBondContact O-N 3.06Å
96	S	29	Very low	30.8	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	80%	0.797	S	S	*	*			trans	-67.4	126.2	171.8	179.6	0	0	0	0	111.1	R98	S96-R98 PolarHBondContact O-N 2.73Å
97	C	26.6	Very low	31.1	Very low	126 Å²	126	138.1 Å²	138.1	85%	0.851	80%	0.798	S	S	*	*			trans	-71.7	73.4	173.8	-76.3	0	0	0	0	112	V95 I99	V95-C97 PolarHBondContact O-N 3.06Å; C97-I99 PolarHBondContact O-N 3.25Å
98	R	27.5	Very low	31.4	Very low	222 Å²	222	137.4 Å²	137.4	84%	0.838	80%	0.799	S	S	*	*			trans	-65.2	103	169.1	-75.1	-175	176.2	172.7	-0.1	110.1	S96 R100	S96-R98 PolarHBondContact O-N 2.73Å; R98-R100 PolarHBondContact O-N 3.42Å; R98-R100 VanDerWaalsContact O-N 3.13Å
99	I	32.8	Very low	31.5	Very low	169 Å²	169	138.2 Å²	138.2	87%	0.867	81%	0.805	S	S	*	*			trans	-62.1	113.3	162.3	-63.6	169.8	0	0	0	107.1	C97	C97-I99 PolarHBondContact O-N 3.25Å
100	R	30.8	Very low	31.6	Very low	214 Å²	214	137.5 Å²	137.5	81%	0.808	81%	0.811	S	S	*	*			trans	-71.3	133.1	177.2	-92.6	-174.9	174.5	165.2	0.1	110.6	R98 P102	R98-R100 PolarHBondContact O-N 3.42Å; R98-R100 VanDerWaalsContact O-N 3.13Å; R100-P102 WeakPolarHBondContact O-CD 3.42Å
101	D	31.2	Very low	31.8	Very low	112 Å²	112	135.4 Å²	135.4	60%	0.599	80%	0.803	S	S	*	*			trans	-68.5	123.8	173.5	-170.6	-3.5	0	0	0	110.7	L103 A104	D101-L103 PolarHBondContact O-N 3.13Å; D101-A104 PolarHBondContact O-N 3.19Å
102	P	35.9	Very low	31.8	Very low	126 Å²	126	142.5 Å²	142.5	82%	0.818	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	4.5	-176.8	-25.2	36.1	0	0	0	117.2	R100	R100-P102 WeakPolarHBondContact O-CD 3.42Å
103	L	35.9	Very low	31.8	Very low	158 Å²	158	140.3 Å²	140.3	83%	0.827	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	-2.8	179.7	-67.2	173.9	0	0	0	114.6	D101 L105	D101-L103 PolarHBondContact O-N 3.13Å; L103-L105 PolarHBondContact O-N 3.41Å
104	A	31.8	Very low	32	Very low	77 Å²	77	142.4 Å²	142.4	64%	0.636	81%	0.81	S	S	*	*			trans	-93	59.1	-172.8	0	0	0	0	0	114.5	D101	D101-A104 PolarHBondContact O-N 3.19Å
105	L	34.2	Very low	32.1	Very low	165 Å²	165	142.8 Å²	142.8	86%	0.864	80%	0.804	S	S	*	*			trans	-152	94.6	172.9	-117.7	125.8	0	0	0	111.8	L103	L103-L105 PolarHBondContact O-N 3.41Å
106	G	36.5	Very low	32.2	Very low	77 Å²	77	140.7 Å²	140.7	79%	0.794	80%	0.8	S	S	*	*			trans	-148.8	4.9	-166	0	0	0	0	0	119
107	R	35.9	Very low	32.4	Very low	252 Å²	252	141 Å²	141	95%	0.951	80%	0.803	S	S	*	*			trans	70.6	146.1	171.7	-108.8	178.2	179.5	160.4	-0.2	120
108	A	35.4	Very low	32.7	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	81%	0.806	S	S	*	*			trans	69.2	95	151.1	0	0	0	0	0	120.8
109	Q	31	Very low	32.8	Very low	203 Å²	203	135.8 Å²	135.8	95%	0.949	80%	0.797	S	S	*	*			trans	-81.4	122.7	142.1	-65.1	167.2	-66.8	0	0	108.7
110	S	32.5	Very low	32.7	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	80%	0.8	S	S	*	*			trans	-167.8	131.4	156.6	-159.7	0	0	0	0	113.1
111	V	34.5	Very low	32.6	Very low	119 Å²	119	134.7 Å²	134.7	72%	0.721	80%	0.799	S	S	*	*			trans	48.2	100.4	153.1	-176.5	0	0	0	0	120.2
112	R	31.1	Very low	32.6	Very low	228 Å²	228	137.6 Å²	137.6	86%	0.86	81%	0.811	S	S	*	*				44.6	129.2	127.1	-59.1	177.3	177	156.6	-2	122.1
113	S	30.9	Very low	32.2	Very low	118 Å²	118	136.8 Å²	136.8	83%	0.825	81%	0.809	S	S	*	*			trans	82.9	172.9	131.9	77	0	0	0	0	120.9
114	A	33	Very low	32.2	Very low	103 Å²	103	135.5 Å²	135.5	85%	0.851	81%	0.808	S	S	*	*			trans	71.2	105.3	174.3	0	0	0	0	0	117.8
115	A	29.6	Very low	32.1	Very low	99 Å²	99	138.7 Å²	138.7	82%	0.818	81%	0.814	S	S	*	*			trans	-76.8	168.9	177.7	0	0	0	0	0	115.4
116	A	30.5	Very low	31.9	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	80%	0.803	S	S	*	*			trans	85.4	146.2	139.3	0	0	0	0	0	121.6
117	S	32.5	Very low	31.7	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	81%	0.808	S	S	*	*			trans	82.7	137.8	158	83.8	0	0	0	0	119
118	L	33.3	Very low	31.5	Very low	176 Å²	176	137.6 Å²	137.6	92%	0.921	81%	0.805	S	S	*	*			trans	63.6	142.1	161.2	-56	162.5	0	0	0	117.2
119	G	28.7	Very low	31.3	Very low	62 Å²	62	138.4 Å²	138.4	64%	0.639	81%	0.805	S	S	*	*			cis	144.8	129.6	-6.6	0	0	0	0	0	112.2
120	R	31.8	Very low	31.3	Very low	244 Å²	244	138.1 Å²	138.1	92%	0.921	80%	0.801	S	S	*	*			trans	74.2	106.4	175.2	-52.4	-177.8	-177.9	-150.1	-0.9	117.3
121	S	27.9	Very low	31.2	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	81%	0.806	S	S	*	*				31.9	110.1	117.2	175.9	0	0	0	0	118.7
122	M	32.8	Very low	31.1	Very low	173 Å²	173	145.9 Å²	145.9	85%	0.852	82%	0.816	S	S	*	*			trans	-129.2	133.7	140.9	-75.9	-168.6	71.8	0	0	109.9
123	S	27.3	Very low	31.3	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	82%	0.815	S	S	*	*			trans	-84.1	135.8	164.7	-174.7	0	0	0	0	108.6
124	V	35.5	Very low	31.4	Very low	132 Å²	132	144.3 Å²	144.3	80%	0.8	82%	0.819	S	S	*	*			trans	-136.5	134.7	169.1	-179.6	0	0	0	0	108.5
125	D	29	Very low	31.6	Very low	143 Å²	143	148.8 Å²	148.8	77%	0.765	82%	0.823	S	S	*	*			trans	-86.9	163.2	-161	-129.9	-50.1	0	0	0	115.4	R127	D125-R127 PolarHBondContact O-N 2.69Å
126	S	30.5	Very low	32	Very low	93 Å²	93	154 Å²	154	65%	0.65	82%	0.821	S	S	*	*			trans	-9.1	109.9	155.4	-176.7	0	0	0	0	117.8
127	R	31.4	Very low	32.6	Very low	233 Å²	233	160.5 Å²	160.5	88%	0.879	83%	0.826	S	S	*	*			trans	177	95.8	139.5	-97.1	154.8	-172.7	-156.4	3.6	113.3	D125	D125-R127 PolarHBondContact O-N 2.69Å
128	T	33.2	Very low	33	Very low	145 Å²	145	161.7 Å²	161.7	89%	0.89	82%	0.82	S	S	*	*			trans	-164.7	28.6	158.2	4.3	0	0	0	0	114	K130	T128-K130 PolarHBondContact O-N 2.95Å; T128-K130 VanDerWaalsContact O-N 3.07Å
129	S	30.4	Very low	33.7	Very low	111 Å²	111	156.7 Å²	156.7	78%	0.776	80%	0.8	S	S	*	*			trans	-86.4	69.6	-171.1	47.5	0	0	0	0	114.7
130	K	30.3	Very low	34.5	Very low	197 Å²	197	156 Å²	156	86%	0.857	78%	0.784	S	S	*	*	S	Bend	trans	-170.9	168.9	158.6	-98	137.5	-168.4	174.6	0	110.7	T128	T128-K130 PolarHBondContact O-N 2.95Å; T128-K130 VanDerWaalsContact O-N 3.07Å
131	V	30.6	Very low	34.9	Very low	142 Å²	142	147.1 Å²	147.1	86%	0.861	76%	0.762	S	S	*	*	S	Bend	trans	66.7	72.5	175.2	-162.1	0	0	0	0	116.3
132	R	33.3	Very low	35.7	Very low	247 Å²	247	146.5 Å²	146.5	93%	0.932	75%	0.745	S	S	*	*			trans	-157.7	26.9	157	-136.1	-176.4	-71.1	-171	1	116.3
133	V	34.8	Very low	36.4	Very low	140 Å²	140	143.7 Å²	143.7	85%	0.848	73%	0.733	S	S	*	*			trans	-103.6	-21.3	-159.9	176.3	0	0	0	0	116.1
134	L	32.9	Very low	37.3	Very low	173 Å²	173	139.5 Å²	139.5	91%	0.906	71%	0.705	S	S	*	*	S	Bend	trans	-103.7	-7	-160.7	-83.4	167.9	0	0	0	118.4
135	Q	37.2	Very low	38	Very low	197 Å²	197	141 Å²	141	92%	0.921	70%	0.696	S	S	*	*	S	Bend	trans	-115	15.8	-166.6	-153.3	170.5	-6.8	0	0	115.8
136	R	38.7	Very low	39.2	Very low	209 Å²	209	138.3 Å²	138.3	79%	0.789	68%	0.682	S	S	*	*			trans	-117.5	15.2	-171.1	-138.3	-178.3	-166.1	-162.6	3.6	115.8
137	R	41.9	Very low	40.2	Very low	225 Å²	225	139.6 Å²	139.6	85%	0.849	68%	0.675	S	S	*	*	S	Bend	trans	-86.8	-36.5	-173.9	-88.1	-174.4	167.2	-179	-3.5	115.4
138	E	40.9	Very low	40.8	Very low	130 Å²	130	132.2 Å²	132.2	61%	0.607	65%	0.65	S	S	*	*	H	α-helix	trans	-84.1	-34.9	-172.8	-60.8	-173	122.5	0	0	113.2	V140 A141 K142	E138-V140 VanDerWaalsContact C-N 3.29Å; E138-V140 PolarHBondContact O-N 3.49Å; E138-A141 WeakPolarHBondContact O-CB 3.48Å; E138-A141 PolarHBondContact O-N 3.25Å; E138-K142 PolarHBondContact O-N 3.48Å
139	S	49	Very low	41.3	Very low	70 Å²	70	127.2 Å²	127.2	49%	0.49	62%	0.621	S	S	.	*	H	α-helix	trans	-62.2	-34.5	177.7	53.1	0	0	0	0	113.1	A141 K142 L143	S139-A141 VanDerWaalsContact C-N 3.34Å; S139-K142 PolarHBondContact O-N 3.47Å; S139-L143 WeakPolarHBondContact O-CB 3.5Å; S139-L143 PolarHBondContact O-N 3.5Å
140	V	44.2	Very low	42.3	Very low	49 Å²	49	125.5 Å²	125.5	30%	0.297	61%	0.609	S	S	.	*	H	α-helix	trans	-71.1	-30.2	175.1	-174.3	0	0	0	0	111.6	E138 A144	E138-V140 VanDerWaalsContact C-N 3.29Å; E138-V140 PolarHBondContact O-N 3.49Å; V140-A144 WeakPolarHBondContact O-CB 3.36Å; V140-A144 PolarHBondContact O-N 2.89Å
141	A	41.5	Very low	42.8	Very low	57 Å²	57	118.4 Å²	118.4	47%	0.471	58%	0.58	S	S	.	*	H	α-helix	trans	-70.8	-40.3	173.4	0	0	0	0	0	111.4	E138 S139 A144 W145	E138-A141 WeakPolarHBondContact O-CB 3.48Å; E138-A141 PolarHBondContact O-N 3.25Å; S139-A141 VanDerWaalsContact C-N 3.34Å; A141-A144 PolarHBondContact O-N 3.14Å; A141-W145 WeakPolarHBondContact O-CB 3.41Å; A141-W145 PolarHBondContact O-N 3.48Å
142	K	44	Very low	43.2	Very low	102 Å²	102	115 Å²	115	44%	0.443	56%	0.557	S	S	.	*	H	α-helix	trans	-68	-45.9	175.2	-169.6	168.5	-178.5	174.1	0	112.4	Y78 E138 S139 A144 W145 D146	Y78-K142 PolarHBondContact OH-NZ 3.19Å; Y78-K142 VanDerWaalsContact OH-NZ 3.07Å; E138-K142 PolarHBondContact O-N 3.48Å; S139-K142 PolarHBondContact O-N 3.47Å; K142-A144 VanDerWaalsContact C-N 3.26Å; K142-A144 PolarHBondContact O-N 2.96Å; K142-W145 CarbonylContact O-C 2.98Å; K142-W145 WeakPolarHBondContact O-CA 3.48Å; K142-W145 WeakPolarHBondContact O-CB 3.34Å; K142-W145 PolarHBondContact O-N 3.39Å; K142-D146 PolarHBondContact O-N 3.46Å
143	L	48	Very low	43.7	Very low	114 Å²	114	111.3 Å²	111.3	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-63.7	-32.4	175.8	-166.5	73.5	0	0	0	112.4	S139 K147	S139-L143 WeakPolarHBondContact O-CB 3.5Å; S139-L143 PolarHBondContact O-N 3.5Å; L143-K147 PolarHBondContact O-N 3.19Å
144	A	45.5	Very low	44.2	Very low	21 Å²	21	108.3 Å²	108.3	17%	0.174	52%	0.524	C	S	.	.	H	α-helix	trans	-66.9	-45.3	169.3	0	0	0	0	0	111.2	V140 A141 K142 D146 K147 F148 F388	V140-A144 WeakPolarHBondContact O-CB 3.36Å; V140-A144 PolarHBondContact O-N 2.89Å; A141-A144 PolarHBondContact O-N 3.14Å; K142-A144 VanDerWaalsContact C-N 3.26Å; K142-A144 PolarHBondContact O-N 2.96Å; A144-D146 PolarHBondContact O-N 2.77Å; A144-K147 PolarHBondContact O-N 3.25Å; A144-F148 WeakPolarHBondContact O-CB 3.49Å; A144-F148 PolarHBondContact O-N 3.34Å; A144-F388 HydrophobicContact CB-CE1 3.77Å; A144-F388 HydrophobicContact CB-CZ 3.71Å
145	W	51.4	Low	44.6	Very low	164 Å²	164	100.6 Å²	100.6	62%	0.621	49%	0.485	S	S	*	.	H	α-helix	trans	-62.8	-40.4	178.2	-169.4	-95.8	0	0	0	113.1	A141 K142 F148 S149	A141-W145 WeakPolarHBondContact O-CB 3.41Å; A141-W145 PolarHBondContact O-N 3.48Å; K142-W145 CarbonylContact O-C 2.98Å; K142-W145 WeakPolarHBondContact O-CA 3.48Å; K142-W145 WeakPolarHBondContact O-CB 3.34Å; K142-W145 PolarHBondContact O-N 3.39Å; W145-F148 HydrophobicContact CE3-CD1 4.35Å; W145-F148 HydrophobicContact CZ3-CD1 4.26Å; W145-F148 CarbonylContact O-C 3.58Å; W145-F148 PolarHBondContact O-N 2.62Å; W145-S149 WeakPolarHBondContact O-CB 3.45Å; W145-S149 PolarHBondContact O-N 2.98Å
146	D	52.8	Low	44.7	Very low	86 Å²	86	95.2 Å²	95.2	46%	0.46	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-36.3	178.7	-62.1	-30.4	0	0	0	111.2	K142 A144 S149 S150	K142-D146 PolarHBondContact O-N 3.46Å; A144-D146 PolarHBondContact O-N 2.77Å; D146-S149 PolarHBondContact O-N 2.71Å; D146-S150 PolarHBondContact O-N 3.25Å; D146-S150 VanDerWaalsContact O-N 3.15Å
147	K	52.3	Low	45	Very low	119 Å²	119	93.8 Å²	93.8	52%	0.517	46%	0.462	S	S	.	.	H	α-helix	trans	-72.3	-34.7	170.1	-71.8	-162.5	174.6	-158.9	0	113.1	L143 A144 S149 S150 L151	L143-K147 PolarHBondContact O-N 3.19Å; A144-K147 PolarHBondContact O-N 3.25Å; K147-S149 VanDerWaalsContact C-N 3.3Å; K147-S150 WeakPolarHBondContact O-CB 3.05Å; K147-S150 PolarHBondContact O-N 2.97Å; K147-L151 PolarHBondContact O-N 2.82Å
148	F	44.7	Very low	45.2	Very low	79 Å²	79	89 Å²	89	35%	0.346	45%	0.447	S	S	.	.	H	α-helix	trans	-68.4	-30.8	173.9	-167.9	-105.3	0	0	0	111.1	A144 W145 L151 L152	A144-F148 WeakPolarHBondContact O-CB 3.49Å; A144-F148 PolarHBondContact O-N 3.34Å; W145-F148 HydrophobicContact CE3-CD1 4.35Å; W145-F148 HydrophobicContact CZ3-CD1 4.26Å; W145-F148 CarbonylContact O-C 3.58Å; W145-F148 PolarHBondContact O-N 2.62Å; F148-L151 CarbonylContact O-C 3.55Å; F148-L151 PolarHBondContact O-N 3.31Å; F148-L152 HydrophobicContact CD1-CD1 3.71Å; F148-L152 HydrophobicContact CD1-CG 4.34Å; F148-L152 HydrophobicContact CE1-CD1 3.7Å; F148-L152 HydrophobicContact CE1-CG 4.24Å; F148-L152 VanDerWaalsContact O-CB 3.25Å; F148-L152 WeakPolarHBondContact O-CB 3.44Å; F148-L152 WeakPolarHBondContact O-CG 3.5Å; F148-L152 PolarHBondContact O-N 3.23Å
149	S	42.4	Very low	45.3	Very low	40 Å²	40	85 Å²	85	28%	0.28	43%	0.432	S	S	.	.	H	α-helix	trans	-67.3	-40.4	169.3	-178.4	0	0	0	0	111.7	W145 D146 K147 L152 R153	W145-S149 WeakPolarHBondContact O-CB 3.45Å; W145-S149 PolarHBondContact O-N 2.98Å; D146-S149 PolarHBondContact O-N 2.71Å; K147-S149 VanDerWaalsContact C-N 3.3Å; S149-L152 PolarHBondContact O-N 3.46Å; S149-R153 PolarHBondContact O-N 2.75Å
150	S	51.3	Low	44.9	Very low	74 Å²	74	87.3 Å²	87.3	52%	0.517	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-43.3	172	-166.9	0	0	0	0	111.7	D146 K147 L152 R153 V154	D146-S150 PolarHBondContact O-N 3.25Å; D146-S150 VanDerWaalsContact O-N 3.15Å; K147-S150 WeakPolarHBondContact O-CB 3.05Å; K147-S150 PolarHBondContact O-N 2.97Å; S150-L152 VanDerWaalsContact C-N 3.34Å; S150-R153 PolarHBondContact O-N 3.34Å; S150-V154 PolarHBondContact O-N 3.04Å
151	L	41.2	Very low	44.8	Very low	48 Å²	48	88 Å²	88	25%	0.251	44%	0.44	S	S	.	.	H	α-helix	trans	-68.4	-31.5	174.7	-73.6	169.3	0	0	0	112.3	K147 F148 V154 S155 W666	K147-L151 PolarHBondContact O-N 2.82Å; F148-L151 CarbonylContact O-C 3.55Å; F148-L151 PolarHBondContact O-N 3.31Å; L151-V154 PolarHBondContact O-N 3.18Å; L151-S155 VanDerWaalsContact O-CB 3.32Å; L151-S155 WeakPolarHBondContact O-CB 3.3Å; L151-S155 PolarHBondContact O-N 3.22Å; L151-S155 PolarHBondContact O-OG 2.84Å; L151-W666 HydrophobicContact CD1-CE3 4.44Å; L151-W666 HydrophobicContact CD1-CZ3 4.14Å; L151-W666 HydrophobicContact CD2-CH2 4.41Å; L151-W666 HydrophobicContact CD2-CZ3 3.93Å
152	L	38.7	Very low	44.7	Very low	71 Å²	71	87.3 Å²	87.3	37%	0.372	43%	0.427	S	S	.	.	H	α-helix	trans	-68.3	-31.6	173.2	-93.8	164	0	0	0	112.2	F148 S149 S150 S155 L156	F148-L152 HydrophobicContact CD1-CD1 3.71Å; F148-L152 HydrophobicContact CD1-CG 4.34Å; F148-L152 HydrophobicContact CE1-CD1 3.7Å; F148-L152 HydrophobicContact CE1-CG 4.24Å; F148-L152 VanDerWaalsContact O-CB 3.25Å; F148-L152 WeakPolarHBondContact O-CB 3.44Å; F148-L152 WeakPolarHBondContact O-CG 3.5Å; F148-L152 PolarHBondContact O-N 3.23Å; S149-L152 PolarHBondContact O-N 3.46Å; S150-L152 VanDerWaalsContact C-N 3.34Å; L152-S155 PolarHBondContact O-N 3.23Å; L152-L156 VanDerWaalsContact O-CB 3.27Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CD1 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.41Å; L152-L156 PolarHBondContact O-N 2.94Å
153	R	44.1	Very low	44.6	Very low	170 Å²	170	87.1 Å²	87.1	64%	0.642	43%	0.429	S	S	*	.	H	α-helix	trans	-69.5	-41.4	171.6	-67.6	-178.7	-146.4	-165.2	4.3	111.9	S149 S150 S155 L156 F157	S149-R153 PolarHBondContact O-N 2.75Å; S150-R153 PolarHBondContact O-N 3.34Å; R153-S155 VanDerWaalsContact C-N 3.34Å; R153-L156 PolarHBondContact O-N 3.18Å; R153-F157 PolarHBondContact O-N 3.37Å
154	V	45.8	Very low	44.1	Very low	76 Å²	76	85.8 Å²	85.8	46%	0.461	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-40.9	172.8	177.4	0	0	0	0	110.6	S150 L151 F157 F158	S150-V154 PolarHBondContact O-N 3.04Å; L151-V154 PolarHBondContact O-N 3.18Å; V154-F157 WeakPolarHBondContact O-CB 3.37Å; V154-F157 PolarHBondContact O-N 3.04Å; V154-F158 HydrophobicContact CG1-CD2 4.1Å; V154-F158 HydrophobicContact CG1-CE2 3.73Å; V154-F158 WeakPolarHBondContact O-CD2 3.22Å; V154-F158 PolarHBondContact O-N 2.84Å
155	S	40.8	Very low	44	Very low	11 Å²	11	92.3 Å²	92.3	8%	0.077	45%	0.447	C	S	.	.	H	α-helix	trans	-60.9	-47.5	173.9	-54.5	0	0	0	0	110.1	L151 L152 R153 F157 F158 V159 W392	L151-S155 VanDerWaalsContact O-CB 3.32Å; L151-S155 WeakPolarHBondContact O-CB 3.3Å; L151-S155 PolarHBondContact O-N 3.22Å; L151-S155 PolarHBondContact O-OG 2.84Å; L152-S155 PolarHBondContact O-N 3.23Å; R153-S155 VanDerWaalsContact C-N 3.34Å; S155-F157 VanDerWaalsContact C-N 3.29Å; S155-F157 PolarHBondContact O-N 3.3Å; S155-F158 CarbonylContact O-C 3.58Å; S155-F158 WeakPolarHBondContact O-CA 3Å; S155-F158 PolarHBondContact O-N 3.48Å; S155-V159 WeakPolarHBondContact O-CA 3.24Å; S155-V159 WeakPolarHBondContact O-CB 3.07Å; S155-V159 WeakPolarHBondContact O-CG2 3.2Å; S155-V159 PolarHBondContact O-N 3.28Å; S155-W392 PolarHBondContact OG-NE1 3.04Å
156	L	38.7	Very low	43.3	Very low	85 Å²	85	87.6 Å²	87.6	45%	0.445	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-37.5	174.9	-77.2	162.5	0	0	0	111.6	L152 R153 F158 V159 H160	L152-L156 VanDerWaalsContact O-CB 3.27Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 WeakPolarHBondContact O-CD1 3.27Å; L152-L156 WeakPolarHBondContact O-CG 3.41Å; L152-L156 PolarHBondContact O-N 2.94Å; R153-L156 PolarHBondContact O-N 3.18Å; L156-F158 PolarHBondContact O-N 3.05Å; L156-V159 PolarHBondContact O-N 3.37Å; L156-H160 WeakPolarHBondContact O-CA 3.45Å; L156-H160 WeakPolarHBondContact O-CB 3.4Å; L156-H160 PolarHBondContact O-N 3.3Å
157	F	45.7	Very low	42	Very low	178 Å²	178	88.3 Å²	88.3	78%	0.781	44%	0.441	S	S	*	.	H	α-helix	trans	-60.3	-27.8	172.6	-100.2	-86	0	0	0	114	R153 V154 S155	R153-F157 PolarHBondContact O-N 3.37Å; V154-F157 WeakPolarHBondContact O-CB 3.37Å; V154-F157 PolarHBondContact O-N 3.04Å; S155-F157 VanDerWaalsContact C-N 3.29Å; S155-F157 PolarHBondContact O-N 3.3Å
158	F	45.6	Very low	41	Very low	125 Å²	125	87.9 Å²	87.9	55%	0.548	45%	0.451	S	S	.	.	H	α-helix	trans	-97.5	-20	175	-64.7	-63.6	0	0	0	114.4	V154 S155 L156 L634	V154-F158 HydrophobicContact CG1-CD2 4.1Å; V154-F158 HydrophobicContact CG1-CE2 3.73Å; V154-F158 WeakPolarHBondContact O-CD2 3.22Å; V154-F158 PolarHBondContact O-N 2.84Å; S155-F158 CarbonylContact O-C 3.58Å; S155-F158 WeakPolarHBondContact O-CA 3Å; S155-F158 PolarHBondContact O-N 3.48Å; L156-F158 PolarHBondContact O-N 3.05Å; F158-L634 HydrophobicContact CE1-CD2 4.24Å
159	V	43.5	Very low	40.3	Very low	47 Å²	47	89.1 Å²	89.1	29%	0.285	48%	0.476	S	S	.	.	H	α-helix	trans	-109.6	-15.7	-171.8	177.2	0	0	0	0	112.1	S155 L156 F162 I163	S155-V159 WeakPolarHBondContact O-CA 3.24Å; S155-V159 WeakPolarHBondContact O-CB 3.07Å; S155-V159 WeakPolarHBondContact O-CG2 3.2Å; S155-V159 PolarHBondContact O-N 3.28Å; L156-V159 PolarHBondContact O-N 3.37Å; V159-F162 HydrophobicContact CG1-CB 4.48Å; V159-F162 CarbonylContact O-C 3.46Å; V159-F162 VanDerWaalsContact O-C 3.26Å; V159-F162 WeakPolarHBondContact O-CA 3.34Å; V159-F162 PolarHBondContact O-N 3.14Å; V159-F162 VanDerWaalsContact O-N 3.14Å; V159-I163 HydrophobicContact CG1-CD1 3.67Å; V159-I163 HydrophobicContact CG1-CG1 3.95Å; V159-I163 WeakPolarHBondContact O-CB 3.18Å; V159-I163 WeakPolarHBondContact O-CG1 3.09Å; V159-I163 PolarHBondContact O-N 2.97Å
160	H	40	Very low	39.6	Very low	118 Å²	118	93.7 Å²	93.7	55%	0.546	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-35.7	170.5	-165.3	-83	0	0	0	112.1	L156 I163 V164	L156-H160 WeakPolarHBondContact O-CA 3.45Å; L156-H160 WeakPolarHBondContact O-CB 3.4Å; L156-H160 PolarHBondContact O-N 3.3Å; H160-I163 PolarHBondContact O-N 3.37Å; H160-V164 VanDerWaalsContact CE1-CG2 3.46Å; H160-V164 WeakPolarHBondContact CE1-CG2 3.2Å; H160-V164 WeakPolarHBondContact ND1-CG2 3.46Å; H160-V164 WeakPolarHBondContact O-CB 3.42Å; H160-V164 WeakPolarHBondContact O-CG2 3.03Å; H160-V164 PolarHBondContact O-N 3.07Å
161	P	42.9	Very low	38.5	Very low	62 Å²	62	96.1 Å²	96.1	40%	0.403	51%	0.508	S	S	.	.	H	α-helix	trans	-56.7	-53	162.9	-24.4	35.4	0	0	0	111.7	I163 V164 Y165	P161-I163 PolarHBondContact O-N 2.87Å; P161-V164 PolarHBondContact O-N 3.07Å; P161-Y165 WeakPolarHBondContact O-CD2 3.27Å; P161-Y165 PolarHBondContact O-N 2.8Å; P161-Y165 VanDerWaalsContact O-N 3.17Å
162	F	40.3	Very low	37.8	Very low	44 Å²	44	100.7 Å²	100.7	19%	0.193	53%	0.532	C	S	.	.	H	α-helix	trans	-65.8	3.1	176.5	-84.1	-85.3	0	0	0	116.3	V159 F166 I635	V159-F162 HydrophobicContact CG1-CB 4.48Å; V159-F162 CarbonylContact O-C 3.46Å; V159-F162 VanDerWaalsContact O-C 3.26Å; V159-F162 WeakPolarHBondContact O-CA 3.34Å; V159-F162 PolarHBondContact O-N 3.14Å; V159-F162 VanDerWaalsContact O-N 3.14Å; F162-F166 AromaticContact CD1-CE2 3.8Å; F162-F166 HydrophobicContact CD1-CE2 3.8Å; F162-F166 HydrophobicContact CD1-CZ 4.44Å; F162-F166 HydrophobicContact CE1-CE2 4.39Å; F162-F166 VanDerWaalsContact O-CD2 3.24Å; F162-F166 WeakPolarHBondContact O-CD2 3.34Å; F162-I635 HydrophobicContact CE2-CD1 3.88Å; F162-I635 HydrophobicContact CE2-CG1 4.18Å; F162-I635 HydrophobicContact CE2-CG2 4.29Å; F162-I635 HydrophobicContact CZ-CD1 4.24Å; F162-I635 HydrophobicContact CZ-CG1 4.48Å; F162-I635 HydrophobicContact CZ-CG2 3.76Å
163	I	40.4	Very low	37.2	Very low	98 Å²	98	101 Å²	101	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-123.9	-35.8	176.8	-73.8	179.6	0	0	0	111.1	V159 H160 P161	V159-I163 HydrophobicContact CG1-CD1 3.67Å; V159-I163 HydrophobicContact CG1-CG1 3.95Å; V159-I163 WeakPolarHBondContact O-CB 3.18Å; V159-I163 WeakPolarHBondContact O-CG1 3.09Å; V159-I163 PolarHBondContact O-N 2.97Å; H160-I163 PolarHBondContact O-N 3.37Å; P161-I163 PolarHBondContact O-N 2.87Å
164	V	39.2	Very low	36.4	Very low	86 Å²	86	100.2 Å²	100.2	52%	0.521	56%	0.561	S	S	.	*	H	α-helix	trans	-73.6	-33.6	177	172.8	0	0	0	0	111.8	H160 P161	H160-V164 VanDerWaalsContact CE1-CG2 3.46Å; H160-V164 WeakPolarHBondContact CE1-CG2 3.2Å; H160-V164 WeakPolarHBondContact ND1-CG2 3.46Å; H160-V164 WeakPolarHBondContact O-CB 3.42Å; H160-V164 WeakPolarHBondContact O-CG2 3.03Å; H160-V164 PolarHBondContact O-N 3.07Å; P161-V164 PolarHBondContact O-N 3.07Å
165	Y	41.5	Very low	35.6	Very low	158 Å²	158	102.6 Å²	102.6	62%	0.62	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	2	176.8	-73.7	-92.2	0	0	0	114.2	P161	P161-Y165 WeakPolarHBondContact O-CD2 3.27Å; P161-Y165 PolarHBondContact O-N 2.8Å; P161-Y165 VanDerWaalsContact O-N 3.17Å
166	F	36.9	Very low	34.9	Very low	65 Å²	65	108.3 Å²	108.3	29%	0.285	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.8	17.3	-176.5	-90.5	-93	0	0	0	114.3	F162 I403 L454	F162-F166 AromaticContact CD1-CE2 3.8Å; F162-F166 HydrophobicContact CD1-CE2 3.8Å; F162-F166 HydrophobicContact CD1-CZ 4.44Å; F162-F166 HydrophobicContact CE1-CE2 4.39Å; F162-F166 VanDerWaalsContact O-CD2 3.24Å; F162-F166 WeakPolarHBondContact O-CD2 3.34Å; F166-I403 HydrophobicContact CD1-CG2 3.55Å; F166-I403 HydrophobicContact CE1-CG2 3.48Å; F166-I403 VanDerWaalsContact CE1-CG2 3.48Å; F166-I403 HydrophobicContact CG-CG2 4.35Å; F166-I403 HydrophobicContact CZ-CG2 4.22Å; F166-L454 HydrophobicContact CZ-CD2 3.9Å
167	C	27	Very low	34.3	Very low	100 Å²	100	109.4 Å²	109.4	68%	0.676	62%	0.616	S	S	*	*	S	Bend	trans	-103.5	122.6	160.5	-73.1	0	0	0	0	108.3	A169	C167-A169 PolarHBondContact O-N 3.49Å
168	P	30.9	Very low	33.4	Very low	110 Å²	110	110.7 Å²	110.7	71%	0.714	62%	0.621	S	S	*	*			trans	-65.9	124.9	170.6	28	-32.6	0	0	0	109.1
169	A	29.7	Very low	32.5	Very low	106 Å²	106	113.3 Å²	113.3	88%	0.876	64%	0.635	S	S	*	*			trans	-97.9	74.6	170.3	0	0	0	0	0	108.3	C167	C167-A169 PolarHBondContact O-N 3.49Å
170	D	27.5	Very low	31.7	Very low	135 Å²	135	115.8 Å²	115.8	72%	0.722	65%	0.65	S	S	*	*			trans	-64.8	137	172.1	-77.9	-52.5	0	0	0	111
171	V	27.7	Very low	31.2	Very low	125 Å²	125	117.6 Å²	117.6	76%	0.758	66%	0.664	S	S	*	*	S	Bend	trans	74.9	140.1	155.5	171.8	0	0	0	0	117.8
172	I	28	Very low	30.3	Very low	145 Å²	145	124.7 Å²	124.7	74%	0.744	68%	0.683	S	S	*	*			trans	71.9	105.7	-179.5	-62.4	149.4	0	0	0	114	D174	I172-D174 HydrophobicContact CG2-CB 4.38Å
173	G	26.4	Very low	29.7	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	72%	0.716	S	S	*	*			trans	-77	141.1	152.4	0	0	0	0	0	109.7
174	D	27.1	Very low	29.1	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	74%	0.735	S	S	*	*			trans	-146.5	132	172.6	-145.4	-7.2	0	0	0	107.1	I172 T176	I172-D174 HydrophobicContact CG2-CB 4.38Å; D174-T176 PolarHBondContact O-N 3.1Å
175	D	28.1	Very low	28.5	Very low	125 Å²	125	131.6 Å²	131.6	67%	0.668	75%	0.747	S	S	*	*			trans	-68.5	132.7	-176.4	-79.4	-74.7	0	0	0	111.4
176	T	26.5	Very low	28	Very low	131 Å²	131	133.8 Å²	133.8	80%	0.804	76%	0.763	S	S	*	*			trans	-171.6	132	135.5	15.9	0	0	0	0	114.2	D174	D174-T176 PolarHBondContact O-N 3.1Å
177	V	25.9	Very low	27.6	Very low	109 Å²	109	134.3 Å²	134.3	66%	0.661	79%	0.786	S	S	*	*			trans	55	97.7	149.3	-170.4	0	0	0	0	118
178	F	27.4	Very low	27.9	Very low	205 Å²	205	135.9 Å²	135.9	90%	0.899	80%	0.795	S	S	*	*				-127.3	71.9	129.9	-107	-79.3	0	0	0	110.2	V180	F178-V180 HydrophobicContact CD1-CG2 4.2Å; F178-V180 PolarHBondContact O-N 3.41Å
179	E	25	Very low	27.6	Very low	179 Å²	179	134 Å²	134	84%	0.836	80%	0.796	S	S	*	*			trans	-82.4	88.6	172.7	-174.4	-175.7	178.3	0	0	109.7
180	V	27.4	Very low	27.5	Very low	100 Å²	100	136.9 Å²	136.9	61%	0.606	80%	0.795	S	S	*	*			trans	-139.1	133.9	174.6	-175.2	0	0	0	0	110.2	F178	F178-V180 HydrophobicContact CD1-CG2 4.2Å; F178-V180 PolarHBondContact O-N 3.41Å
181	D	28.9	Very low	27.4	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	80%	0.796	S	S	*	*			trans	59.2	60.7	167.8	-61.5	-12.9	0	0	0	118.8
182	R	25.7	Very low	27.6	Very low	211 Å²	211	138 Å²	138	80%	0.796	80%	0.801	S	S	*	*			trans	-102.7	45.4	158.1	-157	-180	-172.2	172.4	2.7	112.5	L543	R182-L543 VanDerWaalsContact NH2-CD2 3.27Å
183	L	27.6	Very low	27.5	Very low	171 Å²	171	136.2 Å²	136.2	90%	0.895	80%	0.797	S	S	*	*			trans	-141.1	73.9	-178.3	-80.9	176.9	0	0	0	113.1
184	A	28	Very low	27.7	Very low	108 Å²	108	139 Å²	139	89%	0.893	79%	0.793	S	S	*	*			trans	-158.2	57.2	168.8	0	0	0	0	0	112.7
185	A	26.6	Very low	27.9	Very low	93 Å²	93	137.8 Å²	137.8	77%	0.769	80%	0.796	S	S	*	*			trans	-107	159.1	163	0	0	0	0	0	109.5
186	E	30	Very low	28.4	Very low	205 Å²	205	138 Å²	138	96%	0.958	80%	0.802	S	S	*	*			trans	71.7	111.1	-175.1	-53.3	-174.4	177.5	0	0	116.1
187	G	28.8	Very low	28.9	Very low	75 Å²	75	136.6 Å²	136.6	77%	0.773	80%	0.795	S	S	*	*			trans	156.4	111.7	175.2	0	0	0	0	0	112
188	P	33.4	Very low	29.1	Very low	134 Å²	134	138.5 Å²	138.5	87%	0.87	80%	0.799	S	S	*	*			trans	-99.4	142.2	-162.3	35.9	-34.6	0	0	0	115.7
189	G	24.9	Very low	29.5	Very low	70 Å²	70	134.9 Å²	134.9	72%	0.722	79%	0.789	S	S	*	*			trans	74.7	126.3	144	0	0	0	0	0	119.4
190	I	27.8	Very low	29.7	Very low	167 Å²	167	132.2 Å²	132.2	86%	0.856	79%	0.785	S	S	*	*			trans	-172.7	137.2	135.1	-98	153.7	0	0	0	108.1
191	D	24.4	Very low	29.9	Very low	141 Å²	141	135.7 Å²	135.7	75%	0.754	80%	0.798	S	S	*	*			trans	-82.6	144.5	-169.3	-41.8	-89.8	0	0	0	113.9	V193	D191-V193 HydrophobicContact CB-CG2 4.48Å
192	V	31.4	Very low	29.9	Very low	143 Å²	143	132.8 Å²	132.8	87%	0.867	79%	0.79	S	S	*	*			trans	-137.9	66.6	153.8	-168.1	0	0	0	0	110.5
193	V	27.5	Very low	30	Very low	107 Å²	107	130.7 Å²	130.7	65%	0.648	79%	0.789	S	S	*	*			trans	13.7	112.5	140.1	-179.5	0	0	0	0	117.9	D191	D191-V193 HydrophobicContact CB-CG2 4.48Å
194	D	28.7	Very low	30.1	Very low	136 Å²	136	130.6 Å²	130.6	73%	0.727	78%	0.784	S	S	*	*			trans	41.9	135.2	130	-46	-33.3	0	0	0	122.9
195	S	31.8	Very low	30.1	Very low	127 Å²	127	132 Å²	132	89%	0.888	78%	0.777	S	S	*	*				-156.9	81.2	108.8	3.2	0	0	0	0	113.6
196	V	39.6	Very low	30.1	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	78%	0.776	S	S	*	*			trans	-91.1	-165.6	133.1	-144.5	0	0	0	0	106
197	P	37.3	Very low	30	Very low	102 Å²	102	128.2 Å²	128.2	66%	0.662	77%	0.768	S	S	*	*			cis	-153.2	-163.5	43.2	40.3	-14.4	0	0	0	116
198	M	30.1	Very low	30	Very low	150 Å²	150	133.2 Å²	133.2	74%	0.739	77%	0.772	S	S	*	*			trans	77.5	145.1	153.6	-72.5	-5.2	-149.2	0	0	120.1
199	D	34.1	Very low	29.8	Very low	129 Å²	129	131.5 Å²	131.5	69%	0.69	76%	0.763	S	S	*	*			cis	-143.5	160.5	4.4	-125	-34.7	0	0	0	113.7
200	T	29.6	Very low	29.9	Very low	123 Å²	123	137.8 Å²	137.8	76%	0.755	77%	0.771	S	S	*	*			trans	-109.5	159.9	177	54.1	0	0	0	0	112
201	I	32.9	Very low	30.1	Very low	173 Å²	173	133.6 Å²	133.6	89%	0.887	77%	0.769	S	S	*	*			trans	-170.2	156.7	144.2	-100.1	152	0	0	0	108.8
202	S	27.9	Very low	30.4	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	78%	0.775	S	S	*	*			trans	-109.1	-174.1	-166.5	50.5	0	0	0	0	114.2
203	E	28.6	Very low	30.6	Very low	168 Å²	168	139.3 Å²	139.3	79%	0.785	78%	0.776	S	S	*	*			trans	94	115.6	157	-66.6	172.5	159	0	0	120
204	E	28.4	Very low	30.9	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	78%	0.78	S	S	*	*			trans	69.1	117.5	132.8	-60.6	-170	151.5	0	0	123.1
205	D	27.9	Very low	31.3	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	78%	0.779	S	S	*	*				61.9	120.5	127.8	-73.6	17.4	0	0	0	124
206	T	28.2	Very low	31.5	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	78%	0.775	S	S	*	*			trans	66	92.7	140.9	62.5	0	0	0	0	120
207	A	27.3	Very low	31.3	Very low	96 Å²	96	143.9 Å²	143.9	79%	0.793	78%	0.78	S	S	*	*				69.6	158.3	118.7	0	0	0	0	0	122
208	Q	28.3	Very low	31.1	Very low	180 Å²	180	150.1 Å²	150.1	84%	0.841	79%	0.791	S	S	*	*			trans	67.5	79	161.2	-60.1	-171.6	5.7	0	0	120.4
209	S	28.6	Very low	31.3	Very low	98 Å²	98	147.4 Å²	147.4	69%	0.685	79%	0.792	S	S	*	*				88.9	160.6	109.1	80.1	0	0	0	0	122.4
210	F	27.7	Very low	31.2	Very low	202 Å²	202	149.1 Å²	149.1	89%	0.886	79%	0.793	S	S	*	*			trans	58.2	119.4	163.2	-80.5	-81.3	0	0	0	120.2
211	G	32.4	Very low	31.5	Very low	79 Å²	79	148.7 Å²	148.7	81%	0.814	78%	0.783	S	S	*	*			trans	175.6	43.1	170.4	0	0	0	0	0	118.9
212	R	31.4	Very low	31.5	Very low	236 Å²	236	148.1 Å²	148.1	89%	0.891	78%	0.776	S	S	*	*			trans	-53.2	142.3	179	-60.8	170.3	175.9	169.1	-2.5	114
213	L	33.7	Very low	31.8	Very low	168 Å²	168	148.7 Å²	148.7	88%	0.88	78%	0.78	S	S	*	*			trans	176.7	101.9	130.5	-92.4	153.3	0	0	0	108.6
214	A	34.8	Very low	31.8	Very low	90 Å²	90	145 Å²	145	74%	0.744	77%	0.773	S	S	*	*				80.4	138.2	82	0	0	0	0	0	115.2
215	A	36.3	Very low	31.9	Very low	86 Å²	86	145.2 Å²	145.2	71%	0.711	77%	0.774	S	S	*	*			cis	-170.7	-153.6	-12	0	0	0	0	0	108.2
216	K	36.4	Very low	31.8	Very low	185 Å²	185	146.3 Å²	146.3	80%	0.804	77%	0.773	S	S	*	*			cis	-168.9	91	14.5	-151.6	161.8	-167.7	170.7	0	116.5
217	R	34.8	Very low	32	Very low	234 Å²	234	146.5 Å²	146.5	88%	0.883	77%	0.768	S	S	*	*			trans	-169.5	155.2	154.3	-98.5	147.5	-113.4	-113.5	5.1	107.4
218	R	34.8	Very low	31.9	Very low	233 Å²	233	149.2 Å²	149.2	88%	0.879	76%	0.762	S	S	*	*			cis	90.5	132.4	22.6	-66.1	-178.8	179.1	-175.3	-1.8	114.1
219	A	33.4	Very low	31.7	Very low	92 Å²	92	146.5 Å²	146.5	76%	0.76	75%	0.753	S	S	*	*			cis	-170	169.6	2.2	0	0	0	0	0	107.8
220	K	33.1	Very low	31.7	Very low	166 Å²	166	149.9 Å²	149.9	72%	0.722	76%	0.758	S	S	*	*			cis	-165.4	161.2	0.9	-118	-167.9	-172.1	-80.6	0	104.5
221	E	34.2	Very low	31.6	Very low	114 Å²	114	144 Å²	144	53%	0.533	74%	0.742	S	S	.	*			cis	-170.1	159.2	-13.9	-138.7	163.4	-134.9	0	0	108.9
222	E	33.8	Very low	31.3	Very low	160 Å²	160	146 Å²	146	75%	0.748	74%	0.741	S	S	*	*			trans	56	147.6	152.6	-76.2	145.3	-151.5	0	0	120.2
223	S	33.5	Very low	31	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	74%	0.739	S	S	*	*			cis	-171.6	157.1	-1.9	44.1	0	0	0	0	108.2
224	S	29.2	Very low	30.8	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	73%	0.726	S	S	*	*			cis	-168.3	173.1	-8.3	44.3	0	0	0	0	109.4
225	E	29.4	Very low	30.3	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	72%	0.72	S	S	*	*			trans	70.9	149	161	-87.7	165.2	138.2	0	0	117.2
226	F	27.7	Very low	29.7	Very low	161 Å²	161	143.9 Å²	143.9	71%	0.706	72%	0.715	S	S	*	*			cis	-159.7	143.7	-1.9	-174.7	-134.1	0	0	0	111.3
227	L	31.1	Very low	29.2	Very low	127 Å²	127	138.8 Å²	138.8	67%	0.665	70%	0.699	S	S	*	*			trans	60.8	175.4	169.6	-62.7	177.2	0	0	0	118.7
228	K	24.5	Very low	28.6	Very low	152 Å²	152	134.4 Å²	134.4	66%	0.661	69%	0.686	S	S	*	*				-171	142.9	-62.2	-137.9	174.9	162.2	-84.3	0	111.6
229	D	25.2	Very low	28.1	Very low	124 Å²	124	126.9 Å²	126.9	66%	0.663	66%	0.66	S	S	*	*			trans	58.8	-176.2	161.5	-52.9	-38.2	0	0	0	117.9
230	E	28.9	Very low	27.6	Very low	168 Å²	168	124.9 Å²	124.9	79%	0.785	64%	0.637	S	S	*	*			trans	74	113	176	-57.1	-76.8	85.8	0	0	119.4
231	S	25.6	Very low	27.3	Very low	79 Å²	79	121.7 Å²	121.7	55%	0.552	62%	0.623	S	S	*	*			trans	54.3	141.5	136.1	-47.5	0	0	0	0	123.4	L233	S231-L233 PolarHBondContact O-N 2.85Å; S231-L233 VanDerWaalsContact O-N 3.1Å
232	P	24.9	Very low	27.2	Very low	122 Å²	122	119.5 Å²	119.5	79%	0.792	62%	0.615	S	S	*	*			trans	-75.4	92.7	159.8	32.8	-30.3	0	0	0	109.1	Q234	P232-Q234 PolarHBondContact O-N 3.3Å
233	L	26.9	Very low	27.7	Very low	159 Å²	159	111.9 Å²	111.9	83%	0.832	58%	0.579	S	S	*	*			trans	-64	124	172.4	-102	81.8	0	0	0	110.1	S231	S231-L233 PolarHBondContact O-N 2.85Å; S231-L233 VanDerWaalsContact O-N 3.1Å
234	Q	27.7	Very low	27.9	Very low	130 Å²	130	106.9 Å²	106.9	61%	0.607	54%	0.544	S	S	*	.			trans	-77	-176.5	168.9	-61.1	166.2	-141.9	0	0	110.1	P232	P232-Q234 PolarHBondContact O-N 3.3Å
235	D	24.4	Very low	28	Very low	116 Å²	116	104.1 Å²	104.1	62%	0.62	53%	0.525	S	S	*	.			trans	81.9	152.4	157.5	-43.4	-35.5	0	0	0	117.7
236	E	24.4	Very low	28.1	Very low	130 Å²	130	98.4 Å²	98.4	61%	0.607	51%	0.507	S	S	*	.			trans	63.8	43.1	167.2	-57.6	-53.1	105.4	0	0	121.2	R500	E236-R500 IonicContact OE1-NH2 2.72Å; E236-R500 PolarHBondContact OE1-NH2 2.87Å; E236-R500 IonicContact OE2-NH2 3.35Å
237	V	25	Very low	28.3	Very low	77 Å²	77	96.2 Å²	96.2	47%	0.467	51%	0.507	S	S	.	.			trans	-142.4	120.1	145	-162.7	0	0	0	0	111.9	E904	V237-E904 HydrophobicContact CG1-CB 4.23Å; V237-E904 HydrophobicContact CG1-CG 4.31Å
238	F	23.2	Very low	28.3	Very low	142 Å²	142	95.2 Å²	95.2	62%	0.623	51%	0.51	S	S	*	.	S	Bend		164.3	109.6	128.4	-105.5	-100.1	0	0	0	110.9	L907	F238-L907 HydrophobicContact CD1-CD2 4.49Å; F238-L907 HydrophobicContact CE1-CD2 3.46Å; F238-L907 VanDerWaalsContact CE1-CD2 3.46Å; F238-L907 HydrophobicContact CZ-CD2 3.62Å
239	F	23.6	Very low	28.5	Very low	75 Å²	75	91.9 Å²	91.9	33%	0.329	51%	0.511	S	S	.	.			trans	56.3	74.9	174.3	-64.8	-73.2	0	0	0	118.1	R585 L907	F239-R585 PolarHBondContact O-NH2 3.3Å; F239-L907 HydrophobicContact CE1-CB 4.46Å; F239-L907 WeakPolarHBondContact CE1-O 3.41Å; F239-L907 HydrophobicContact CZ-CB 4.06Å; F239-L907 WeakPolarHBondContact CZ-O 2.96Å
240	D	23.8	Very low	28.6	Very low	51 Å²	51	93.3 Å²	93.3	27%	0.273	51%	0.514	S	S	.	.			trans	-120.6	107.7	157.5	-100.6	-35.7	0	0	0	112.1	L242 R500 R585	D240-L242 HydrophobicContact CB-CD1 4.21Å; D240-L242 HydrophobicContact CB-CG 4.28Å; D240-L242 VanDerWaalsContact OD1-CD1 3.25Å; D240-L242 WeakPolarHBondContact OD1-CD1 3.26Å; D240-L242 WeakPolarHBondContact OD1-CG 3.3Å; D240-R500 IonicContact OD2-CZ 3.99Å; D240-R500 IonicContact OD2-NH1 2.8Å; D240-R500 PolarHBondContact OD2-NH1 3.47Å; D240-R500 IonicContact OD2-NH2 2.84Å; D240-R500 PolarHBondContact OD2-NH2 3.13Å; D240-R585 IonicContact OD1-CZ 3.87Å; D240-R585 VanDerWaalsContact OD1-CZ 3.23Å; D240-R585 IonicContact OD1-NE 3.48Å; D240-R585 IonicContact OD1-NH1 3.58Å; D240-R585 PolarHBondContact OD1-NH1 2.95Å; D240-R585 IonicContact OD1-NH2 2.78Å
241	F	27.1	Very low	28.4	Very low	99 Å²	99	95 Å²	95	43%	0.434	51%	0.513	S	S	.	.			trans	-116.3	128.1	148.8	-90.1	-66.5	0	0	0	107.2	R585 Q905	F241-R585 PolarHBondContact O-NH1 3.33Å; F241-Q905 HydrophobicContact CE2-CB 3.73Å; F241-Q905 HydrophobicContact CE2-CG 4.47Å; F241-Q905 WeakPolarHBondContact CE2-O 3.41Å; F241-Q905 HydrophobicContact CZ-CB 3.93Å; F241-Q905 HydrophobicContact CZ-CG 4.4Å
242	L	31.8	Very low	28.5	Very low	67 Å²	67	98.4 Å²	98.4	35%	0.351	52%	0.524	S	S	.	.			trans	-145.8	145.7	-153.9	-92.4	-174.7	0	0	0	114.5	D240 V434	D240-L242 HydrophobicContact CB-CD1 4.21Å; D240-L242 HydrophobicContact CB-CG 4.28Å; D240-L242 VanDerWaalsContact OD1-CD1 3.25Å; D240-L242 WeakPolarHBondContact OD1-CD1 3.26Å; D240-L242 WeakPolarHBondContact OD1-CG 3.3Å; L242-V434 WeakPolarHBondContact O-CG2 3.29Å
243	P	43.2	Very low	28.5	Very low	1 Å²	1	97.3 Å²	97.3	1%	0.006	52%	0.519	C	S	.	.			trans	68.8	-155.2	-160.2	-5	26	0	0	0	124	Q426 V434 Y591	P243-Q426 VanDerWaalsContact CD-NE2 3.27Å; P243-Q426 VanDerWaalsContact CG-OE1 3.28Å; P243-V434 VanDerWaalsContact CA-CG2 3.49Å; P243-V434 WeakPolarHBondContact O-CB 3.35Å; P243-V434 WeakPolarHBondContact O-CG1 3.32Å; P243-V434 VanDerWaalsContact O-CG2 3.25Å; P243-V434 WeakPolarHBondContact O-CG2 3.29Å; P243-Y591 HydrophobicContact CB-CD1 4.32Å; P243-Y591 HydrophobicContact CB-CD2 3.43Å; P243-Y591 VanDerWaalsContact CB-CD2 3.43Å; P243-Y591 HydrophobicContact CB-CE2 3.91Å; P243-Y591 HydrophobicContact CB-CG 3.61Å; P243-Y591 HydrophobicContact CG-CD1 3.6Å; P243-Y591 HydrophobicContact CG-CD2 3.49Å; P243-Y591 VanDerWaalsContact CG-CD2 3.49Å; P243-Y591 HydrophobicContact CG-CE1 3.79Å; P243-Y591 HydrophobicContact CG-CE2 3.68Å; P243-Y591 HydrophobicContact CG-CG 3.4Å; P243-Y591 WeakPolarHBondContact O-CD2 3.4Å; P243-Y591 WeakPolarHBondContact O-CE2 3.27Å
244	P	37.4	Very low	28.5	Very low	0 Å²	0	98.1 Å²	98.1	0%	0	52%	0.519	C	S	.	.				-142.8	140.6	-86.1	40.1	-22.9	0	0	0	118.7	A422 M423 V424 E432	P244-A422 CarbonylContact O-C 3.45Å; P244-A422 VanDerWaalsContact O-O 3.09Å; P244-M423 WeakPolarHBondContact O-CA 3.49Å; P244-M423 PolarHBondContact O-N 3.18Å; P244-V424 HydrophobicContact CB-CB 3.28Å; P244-V424 HydrophobicContact CB-CG1 3.12Å; P244-V424 WeakPolarHBondContact CB-O 3.44Å; P244-V424 HydrophobicContact CG-CB 4.43Å; P244-V424 HydrophobicContact CG-CG1 4.48Å; P244-V424 PolarHBondContact O-N 2.75Å; P244-E432 HydrophobicContact CG-CB 4.2Å; P244-E432 WeakPolarHBondContact CG-O 3.45Å
245	S	31.6	Very low	28.7	Very low	34 Å²	34	98.4 Å²	98.4	24%	0.238	52%	0.524	C	S	.	.			trans	164.5	145.8	136.2	132.3	0	0	0	0	118.9	A422 M423 V424 F594	S245-A422 WeakPolarHBondContact OG-CB 2.96Å; S245-M423 VanDerWaalsContact CB-N 3.31Å; S245-V424 VanDerWaalsContact CA-CG2 3.42Å; S245-F594 WeakPolarHBondContact O-CB 3.25Å; S245-F594 WeakPolarHBondContact O-CD2 3.47Å; S245-F594 WeakPolarHBondContact O-CG 3.29Å
246	A	32.6	Very low	28.9	Very low	52 Å²	52	101.9 Å²	101.9	43%	0.43	53%	0.534	S	S	.	.			cis	171.3	168.8	-9.9	0	0	0	0	0	106.4	V424	A246-V424 HydrophobicContact CB-CG2 3.79Å
247	T	30.6	Very low	29.2	Very low	116 Å²	116	100.7 Å²	100.7	71%	0.712	54%	0.538	S	S	*	.			cis	-154.8	-167.6	0.6	-18.8	0	0	0	0	110.3	E590	T247-E590 WeakPolarHBondContact CA-OE1 3.31Å; T247-E590 WeakPolarHBondContact CG2-OE1 3.15Å
248	S	31	Very low	29.2	Very low	105 Å²	105	106 Å²	106	73%	0.734	56%	0.555	S	S	*	*			trans	-88.4	179.5	-173.5	68	0	0	0	0	117.2
249	A	28.6	Very low	29.4	Very low	82 Å²	82	107.4 Å²	107.4	68%	0.678	57%	0.569	S	S	*	*			cis	-165.5	178.4	15.2	0	0	0	0	0	116.3
250	H	28.6	Very low	29.4	Very low	154 Å²	154	113.6 Å²	113.6	71%	0.713	60%	0.596	S	S	*	*			trans	95.9	95.9	144.7	-99.5	-97.2	0	0	0	125.4
251	R	25.1	Very low	29.5	Very low	203 Å²	203	115.6 Å²	115.6	77%	0.766	62%	0.62	S	S	*	*				53.8	126.7	126.1	-61.5	-169.7	-162.6	-152.6	-0	125
252	L	26.6	Very low	29.4	Very low	152 Å²	152	121.6 Å²	121.6	80%	0.796	64%	0.64	S	S	*	*			trans	86.6	128.4	131.1	-74.5	167.6	0	0	0	123.8
253	S	26.1	Very low	29.1	Very low	99 Å²	99	125.7 Å²	125.7	69%	0.692	67%	0.667	S	S	*	*			trans	67.4	112.2	146.3	60.9	0	0	0	0	122.8
254	E	26.6	Very low	28.3	Very low	175 Å²	175	130.3 Å²	130.3	82%	0.818	70%	0.699	S	S	*	*			trans	75.8	133.7	136.7	-63.7	-172.1	-165.2	0	0	122.8
255	N	31.5	Very low	27.6	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	74%	0.738	S	S	*	*			trans	80.6	101	158.2	-59.1	-52.2	0	0	0	120.8
256	F	27.8	Very low	27.5	Very low	189 Å²	189	143 Å²	143	83%	0.829	76%	0.761	S	S	*	*			trans	-3.4	161.5	134.4	-69.9	-85	0	0	0	120.2
257	P	30.7	Very low	27.1	Very low	105 Å²	105	144.7 Å²	144.7	68%	0.682	77%	0.766	S	S	*	*			cis	-138.2	167.4	-11.5	33.3	-12.7	0	0	0	116.8
258	F	25.1	Very low	27.1	Very low	189 Å²	189	145 Å²	145	83%	0.829	77%	0.769	S	S	*	*			trans	23.3	114.7	150.5	-76.9	-87.7	0	0	0	120.5
259	N	28.7	Very low	27.1	Very low	171 Å²	171	148 Å²	148	91%	0.914	77%	0.772	S	S	*	*			trans	-154.8	147.2	140	-102.6	-54	0	0	0	112.5
260	F	23.4	Very low	27.1	Very low	206 Å²	206	150.7 Å²	150.7	90%	0.904	78%	0.78	S	S	*	*			trans	-80.9	129.8	173	-87.1	-110.5	0	0	0	111
261	A	26	Very low	27.1	Very low	92 Å²	92	148.9 Å²	148.9	76%	0.76	78%	0.78	S	S	*	*			trans	177.1	149.6	134	0	0	0	0	0	114.2
262	R	25.2	Very low	27.3	Very low	226 Å²	226	146.3 Å²	146.3	85%	0.853	78%	0.78	S	S	*	*			trans	50.2	110.1	154.5	-74.5	-178.1	173.1	142.5	-2.4	119.4	S264	R262-S264 PolarHBondContact O-N 3.38Å
263	V	25.1	Very low	27.2	Very low	152 Å²	152	146.6 Å²	146.6	92%	0.921	78%	0.779	S	S	*	*			trans	-64.2	116.8	141.2	178.2	0	0	0	0	108.5
264	S	25.6	Very low	27.3	Very low	98 Å²	98	149.7 Å²	149.7	69%	0.685	78%	0.783	S	S	*	*			trans	-128.2	151.1	162.3	-97.4	0	0	0	0	108.4	R262	R262-S264 PolarHBondContact O-N 3.38Å
265	R	24	Very low	27.5	Very low	214 Å²	214	145.5 Å²	145.5	81%	0.808	77%	0.773	S	S	*	*			trans	-74.2	145.3	179.8	-55.1	169.9	-173.9	133.4	-0.8	109.9
266	A	27.6	Very low	27.5	Very low	88 Å²	88	145.7 Å²	145.7	73%	0.727	78%	0.779	S	S	*	*			trans	-149.1	140.5	160.2	0	0	0	0	0	109.8
267	T	25.4	Very low	27.8	Very low	87 Å²	87	143 Å²	143	53%	0.534	78%	0.78	S	S	.	*			trans	-101.8	134.9	-175.4	-39.9	0	0	0	0	109.7	D1108	T267-D1108 PolarHBondContact OG1-O 2.91Å
268	P	31.3	Very low	27.7	Very low	121 Å²	121	141.7 Å²	141.7	79%	0.786	79%	0.786	S	S	*	*			trans	-76.8	135.6	175.2	30.6	-33.3	0	0	0	111.5
269	Q	30.4	Very low	27.8	Very low	168 Å²	168	139.6 Å²	139.6	79%	0.785	78%	0.779	S	S	*	*			trans	-110.1	136.8	166.1	-78.1	-169.3	-16.5	0	0	110.6
270	T	27.8	Very low	27.9	Very low	139 Å²	139	137.6 Å²	137.6	85%	0.853	76%	0.764	S	S	*	*			trans	-93.3	118.3	178.3	51.1	0	0	0	0	111.6
271	T	30	Very low	28.1	Very low	117 Å²	117	134.5 Å²	134.5	72%	0.718	75%	0.754	S	S	*	*			trans	-148.2	106.7	160.9	-42.8	0	0	0	0	112.5
272	I	28.6	Very low	28.2	Very low	148 Å²	148	135.5 Å²	135.5	76%	0.759	75%	0.747	S	S	*	*			trans	42.9	136.8	136.2	-49.1	175	0	0	0	120.4
273	M	25.1	Very low	28.4	Very low	159 Å²	159	130.4 Å²	130.4	78%	0.783	74%	0.74	S	S	*	*			trans	-16	148.9	153.5	-54.5	154	67.6	0	0	116
274	E	27.3	Very low	28.8	Very low	163 Å²	163	131.2 Å²	131.2	76%	0.762	74%	0.738	S	S	*	*			cis	-171.5	158.4	47.5	-156.5	171.4	174	0	0	113.5
275	S	30.5	Very low	29	Very low	87 Å²	87	132.8 Å²	132.8	61%	0.608	74%	0.738	S	S	*	*			trans	44.4	104.2	154.7	65.2	0	0	0	0	123.7
276	T	31.8	Very low	29.3	Very low	140 Å²	140	126.1 Å²	126.1	86%	0.859	74%	0.736	S	S	*	*			trans	71	156.3	132.3	52.7	0	0	0	0	122.7
277	P	34.8	Very low	29.3	Very low	132 Å²	132	131.9 Å²	131.9	86%	0.857	74%	0.739	S	S	*	*			trans	-119.5	169.7	-156.1	42.4	-30.5	0	0	0	116.9
278	G	28.7	Very low	29.6	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	76%	0.757	S	S	*	*			trans	-162.9	126.1	172.5	0	0	0	0	0	115.4
279	E	27.6	Very low	29.3	Very low	145 Å²	145	136 Å²	136	68%	0.678	76%	0.759	S	S	*	*			trans	-48	170.2	-172	-50.8	-178.4	119.7	0	0	121.9	M1	M1-E279 PolarHBondContact N-OE1 3.24Å; M1-E279 PolarHBondContact N-OE2 3.48Å
280	H	29.3	Very low	29.5	Very low	130 Å²	130	135.2 Å²	135.2	60%	0.602	77%	0.765	S	S	*	*			trans	94.4	102.9	144.1	-97	-74.5	0	0	0	121.4	M1	M1-H280 WeakPolarHBondContact CB-NE2 3.22Å; M1-H280 PolarHBondContact N-NE2 3.46Å
281	M	28.2	Very low	29.5	Very low	140 Å²	140	137.3 Å²	137.3	69%	0.69	77%	0.765	S	S	*	*				22.9	142.1	109.1	-86.4	160.4	59.4	0	0	118.4
282	D	28.2	Very low	29.8	Very low	114 Å²	114	136.6 Å²	136.6	61%	0.61	76%	0.763	S	S	*	*			cis	-157	146.7	41.7	-102.5	-45.5	0	0	0	115.8
283	V	30	Very low	29.8	Very low	119 Å²	119	139.2 Å²	139.2	72%	0.721	77%	0.772	S	S	*	*				23.2	132.6	129.8	-176.2	0	0	0	0	121.1
284	I	32.7	Very low	30	Very low	168 Å²	168	136 Å²	136	86%	0.862	77%	0.771	S	S	*	*				-165.9	144.5	122.7	-99.4	158.4	0	0	0	113.5
285	D	28.9	Very low	30.1	Very low	131 Å²	131	135.9 Å²	135.9	70%	0.701	77%	0.774	S	S	*	*			trans	-74.3	162.5	-173	-168.7	1.7	0	0	0	114.6
286	G	31.3	Very low	30.1	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	78%	0.778	S	S	*	*			trans	-172.3	75.2	-174.9	0	0	0	0	0	117.1
287	R	28.5	Very low	30.2	Very low	210 Å²	210	141 Å²	141	79%	0.792	78%	0.778	S	S	*	*			trans	-74.7	148.8	176.2	-53.1	170.3	-176.8	163.8	-1.4	113.5
288	Q	30.9	Very low	30	Very low	196 Å²	196	137.7 Å²	137.7	92%	0.916	77%	0.768	S	S	*	*				-179.6	168.6	107.5	-100.2	177	-13.6	0	0	113.4
289	A	25.5	Very low	30.3	Very low	98 Å²	98	143 Å²	143	81%	0.81	77%	0.771	S	S	*	*			trans	-134	148.7	-177.8	0	0	0	0	0	111.6
290	V	33.2	Very low	30.5	Very low	151 Å²	151	144.7 Å²	144.7	92%	0.915	78%	0.784	S	S	*	*			trans	-142.3	144.1	174.9	-176.4	0	0	0	0	109.2
291	E	28.2	Very low	30.4	Very low	183 Å²	183	141.4 Å²	141.4	86%	0.855	79%	0.785	S	S	*	*			trans	-107.3	-178.8	-179.6	-117.1	-145	123.9	0	0	111.5
292	P	36.4	Very low	30.5	Very low	103 Å²	103	140.1 Å²	140.1	67%	0.669	79%	0.79	S	S	*	*			trans	-105.8	166.7	-143.5	40.7	-38.8	0	0	0	116.4
293	E	29.5	Very low	30.8	Very low	203 Å²	203	141.9 Å²	141.9	95%	0.949	80%	0.8	S	S	*	*			trans	-129.3	166.9	159.2	-73.6	-158.9	123.3	0	0	111.7
294	A	28	Very low	31	Very low	92 Å²	92	144.5 Å²	144.5	76%	0.76	81%	0.808	S	S	*	*			trans	-142.2	159.1	-172.2	0	0	0	0	0	111.3
295	L	29.5	Very low	31	Very low	159 Å²	159	148.1 Å²	148.1	83%	0.832	81%	0.811	S	S	*	*			trans	-153.8	168.9	155.2	-137.2	67.7	0	0	0	114.9
296	H	31.4	Very low	31.2	Very low	148 Å²	148	153.3 Å²	153.3	69%	0.685	82%	0.821	S	S	*	*			trans	-63.7	179	-171.5	-53.3	-44.8	0	0	0	115.1
297	H	33.3	Very low	31.4	Very low	187 Å²	187	157.8 Å²	157.8	87%	0.866	83%	0.827	S	S	*	*			cis	-163.4	165	34.1	-121.2	-74	0	0	0	112.1
298	G	31.4	Very low	31.7	Very low	62 Å²	62	157 Å²	157	64%	0.639	83%	0.829	S	S	*	*			trans	139	94.9	153	0	0	0	0	0	118.9
299	Q	33.7	Very low	31.8	Very low	189 Å²	189	155.5 Å²	155.5	88%	0.883	83%	0.827	S	S	*	*			trans	10.1	112	153.1	-64.7	139.9	-80.6	0	0	121.1
300	L	31.4	Very low	32.1	Very low	182 Å²	182	154.5 Å²	154.5	95%	0.953	82%	0.819	S	S	*	*				-151.8	136.4	99.2	-157.3	65.2	0	0	0	110.8
301	G	29.3	Very low	32	Very low	60 Å²	60	154 Å²	154	62%	0.619	82%	0.816	S	S	*	*			trans	-104.1	160.7	-160.7	0	0	0	0	0	116.9
302	S	28.8	Very low	32.2	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	81%	0.813	S	S	*	*			trans	50.2	104.2	155.8	56.4	0	0	0	0	119.2
303	N	34.3	Very low	31.8	Very low	152 Å²	152	156.6 Å²	156.6	81%	0.813	82%	0.822	S	S	*	*			trans	-161.6	-37.7	135.2	-104.1	-41.4	0	0	0	114.4	R305	N303-R305 VanDerWaalsContact C-N 3.3Å; N303-R305 PolarHBondContact O-N 3.43Å
304	L	35.7	Very low	31.9	Very low	173 Å²	173	153.2 Å²	153.2	91%	0.906	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	67	-177.9	-85	75.2	0	0	0	113.8
305	R	31.9	Very low	32	Very low	245 Å²	245	155.5 Å²	155.5	93%	0.925	82%	0.822	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.3	19	166.7	-135.3	178.1	-78.3	-159.3	0.7	115.6	N303	N303-R305 VanDerWaalsContact C-N 3.3Å; N303-R305 PolarHBondContact O-N 3.43Å
306	R	34	Very low	31.8	Very low	240 Å²	240	159 Å²	159	91%	0.906	83%	0.826	S	S	*	*	S	Bend	trans	-123.1	13.4	176.8	-72.8	-168.7	179	-175.3	2.3	115.7
307	L	35.5	Very low	31.7	Very low	167 Å²	167	159.7 Å²	159.7	87%	0.874	83%	0.833	S	S	*	*			trans	-120.6	51.5	-176.4	-82.3	167.7	0	0	0	113.4
308	K	33.1	Very low	31.4	Very low	195 Å²	195	155.2 Å²	155.2	85%	0.848	82%	0.823	S	S	*	*	S	Bend	trans	-124.6	-10.1	172.2	-139.3	169.2	-173.9	173.9	0	115
309	D	32.9	Very low	31.1	Very low	164 Å²	164	157.2 Å²	157.2	88%	0.877	82%	0.819	S	S	*	*	S	Bend	trans	-122.6	56.1	-173.9	-61.2	-69.5	0	0	0	112.3
310	A	32	Very low	30.9	Very low	77 Å²	77	157.9 Å²	157.9	64%	0.636	81%	0.813	S	S	*	*			trans	-147.3	167.4	178	0	0	0	0	0	113.1
311	V	32.5	Very low	30.7	Very low	139 Å²	139	159.6 Å²	159.6	84%	0.842	81%	0.809	S	S	*	*			trans	64.6	58.3	173.5	-159	0	0	0	0	115
312	S	30.7	Very low	30.8	Very low	114 Å²	114	161.7 Å²	161.7	80%	0.797	82%	0.82	S	S	*	*			trans	-96.7	132.6	145.6	-79.5	0	0	0	0	109.9
313	R	29.5	Very low	30.8	Very low	227 Å²	227	163.2 Å²	163.2	86%	0.857	83%	0.825	S	S	*	*			trans	79.2	129.7	-177.7	-49.8	175.1	-174.1	174.8	4.9	115.5
314	P	30.3	Very low	30.7	Very low	132 Å²	132	159.4 Å²	159.4	86%	0.857	82%	0.821	S	S	*	*			trans	-92.2	150.6	161.7	36.1	-30.9	0	0	0	111.4
315	T	30.2	Very low	30.5	Very low	140 Å²	140	160.1 Å²	160.1	86%	0.859	82%	0.82	S	S	*	*			trans	-119.7	155.7	171.1	-22.2	0	0	0	0	109.6
316	Y	26.8	Very low	30.6	Very low	233 Å²	233	154 Å²	154	91%	0.914	81%	0.812	S	S	*	*			trans	-114.7	105.3	-164.7	-154.6	-83.7	0	0	0	109.8
317	I	29.2	Very low	30.8	Very low	162 Å²	162	148 Å²	148	83%	0.831	80%	0.802	S	S	*	*			trans	-138.4	142.6	175.8	-62.5	-177.1	0	0	0	108
318	S	26.4	Very low	30.9	Very low	93 Å²	93	145.8 Å²	145.8	65%	0.65	80%	0.8	S	S	*	*			trans	-105.7	-167.9	179.4	64	0	0	0	0	112
319	D	25.6	Very low	31.4	Very low	105 Å²	105	139.4 Å²	139.4	56%	0.561	78%	0.778	S	S	*	*			trans	86.4	116.8	157.4	-78.3	44	0	0	0	120.1
320	R	29.6	Very low	32	Very low	202 Å²	202	134 Å²	134	76%	0.762	75%	0.752	S	S	*	*			trans	89.1	119.6	136.1	-65.7	169.6	-149.4	-140.1	-0.4	120.6
321	Y	26.8	Very low	32.8	Very low	219 Å²	219	134.3 Å²	134.3	86%	0.859	75%	0.748	S	S	*	*			trans	35.8	103.8	136.5	-61.2	-79.4	0	0	0	118.8
322	A	31.8	Very low	33.3	Very low	104 Å²	104	134.1 Å²	134.1	86%	0.86	73%	0.732	S	S	*	*			trans	-126.2	119.6	140.6	0	0	0	0	0	107.8
323	T	28.3	Very low	34.1	Very low	145 Å²	145	130.9 Å²	130.9	89%	0.89	71%	0.71	S	S	*	*			trans	-80.4	120	174.2	44.1	0	0	0	0	109.5
324	G	33.1	Very low	35	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	69%	0.693	S	S	*	*			trans	-138.1	141.9	174.3	0	0	0	0	0	110.2
325	Q	29.6	Very low	36.1	Very low	189 Å²	189	124.9 Å²	124.9	88%	0.883	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-72.7	147.7	-173.2	-69	161.3	-71.9	0	0	111.9	V327	Q325-V327 PolarHBondContact O-N 3.06Å
326	P	35.9	Very low	36.9	Very low	117 Å²	117	125.1 Å²	125.1	76%	0.76	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-76	116.4	175.3	30.7	-32.4	0	0	0	110.4
327	V	38.1	Very low	38	Very low	114 Å²	114	117.5 Å²	117.5	69%	0.691	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-64.4	137.4	162.6	178.7	0	0	0	0	108.4	Q325 T329 R334	Q325-V327 PolarHBondContact O-N 3.06Å; V327-T329 HydrophobicContact CG1-CG2 4.2Å; V327-T329 PolarHBondContact O-N 3.13Å; V327-R334 PolarHBondContact O-NH2 3.46Å
328	S	37.2	Very low	39.3	Very low	120 Å²	120	111 Å²	111	84%	0.839	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-66.2	123.8	171.4	-166.3	0	0	0	0	108.8
329	T	43.5	Very low	40.8	Very low	61 Å²	61	108 Å²	108	37%	0.374	59%	0.589	S	S	.	*			trans	-140.9	130.8	177.9	63	0	0	0	0	107.2	V327 S333 R334	V327-T329 HydrophobicContact CG1-CG2 4.2Å; V327-T329 PolarHBondContact O-N 3.13Å; T329-S333 WeakPolarHBondContact CB-OG 3.36Å; T329-R334 WeakPolarHBondContact OG1-CG 3.4Å; T329-R334 PolarHBondContact OG1-NE 2.8Å
330	S	45.8	Very low	42.1	Very low	49 Å²	49	106 Å²	106	34%	0.343	58%	0.582	S	S	.	*			trans	-53.8	150.2	-169.5	69.9	0	0	0	0	112.1	W332 S333 R334	S330-W332 PolarHBondContact O-N 3.36Å; S330-W332 VanDerWaalsContact O-N 3.16Å; S330-S333 PolarHBondContact N-OG 3.46Å; S330-S333 VanDerWaalsContact N-OG 3.17Å; S330-S333 PolarHBondContact O-N 3.11Å; S330-S333 PolarHBondContact O-OG 3.38Å; S330-S333 PolarHBondContact OG-N 3.04Å; S330-R334 PolarHBondContact O-N 3.36Å
331	P	48.7	Very low	43.3	Very low	85 Å²	85	99.8 Å²	99.8	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-51.7	-40.6	179.1	-27.7	35.9	0	0	0	112.5	R334 F335 I1035	P331-R334 PolarHBondContact O-N 3.47Å; P331-F335 WeakPolarHBondContact O-CB 3.36Å; P331-F335 PolarHBondContact O-N 2.75Å; P331-I1035 HydrophobicContact CG-CG2 4.26Å
332	W	41.9	Very low	44.5	Very low	134 Å²	134	91.1 Å²	91.1	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-59.7	-47.1	173.4	-66.8	118.6	0	0	0	113.1	S330 R334 F335 W336 I1035	S330-W332 PolarHBondContact O-N 3.36Å; S330-W332 VanDerWaalsContact O-N 3.16Å; W332-R334 VanDerWaalsContact C-N 3.27Å; W332-R334 PolarHBondContact O-N 3.4Å; W332-F335 HydrophobicContact CE3-CD1 4.33Å; W332-F335 WeakPolarHBondContact O-CB 3.46Å; W332-F335 PolarHBondContact O-N 2.79Å; W332-F335 VanDerWaalsContact O-N 3.16Å; W332-W336 WeakPolarHBondContact O-CB 3.35Å; W332-W336 PolarHBondContact O-N 3.43Å; W332-I1035 VanDerWaalsContact CD1-CD1 3.49Å; W332-I1035 VanDerWaalsContact NE1-CD1 3.28Å
333	S	47.5	Very low	45.4	Very low	47 Å²	47	88.5 Å²	88.5	33%	0.329	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-35.2	179.1	73.7	0	0	0	0	112.8	T329 S330 S337	T329-S333 WeakPolarHBondContact CB-OG 3.36Å; S330-S333 PolarHBondContact N-OG 3.46Å; S330-S333 VanDerWaalsContact N-OG 3.17Å; S330-S333 PolarHBondContact O-N 3.11Å; S330-S333 PolarHBondContact O-OG 3.38Å; S330-S333 PolarHBondContact OG-N 3.04Å; S333-S337 VanDerWaalsContact O-CB 3.24Å; S333-S337 WeakPolarHBondContact O-CB 3.49Å; S333-S337 PolarHBondContact O-N 2.78Å; S333-S337 PolarHBondContact O-OG 2.56Å
334	R	47.8	Very low	46.5	Very low	132 Å²	132	87.5 Å²	87.5	50%	0.498	50%	0.498	S	S	.	.	H	α-helix	trans	-72.2	-40	174.6	-66.7	-173.8	178.5	177.5	1.2	112	V327 T329 S330 P331 W332 S337 G338	V327-R334 PolarHBondContact O-NH2 3.46Å; T329-R334 WeakPolarHBondContact OG1-CG 3.4Å; T329-R334 PolarHBondContact OG1-NE 2.8Å; S330-R334 PolarHBondContact O-N 3.36Å; P331-R334 PolarHBondContact O-N 3.47Å; W332-R334 VanDerWaalsContact C-N 3.27Å; W332-R334 PolarHBondContact O-N 3.4Å; R334-S337 PolarHBondContact O-OG 2.88Å; R334-G338 PolarHBondContact O-N 3.31Å
335	F	54	Low	47.3	Very low	101 Å²	101	91.4 Å²	91.4	44%	0.443	49%	0.491	S	S	.	.	H	α-helix	trans	-60.3	-55.2	172.8	176.1	-102.2	0	0	0	111.1	P331 W332 G338 L339	P331-F335 WeakPolarHBondContact O-CB 3.36Å; P331-F335 PolarHBondContact O-N 2.75Å; W332-F335 HydrophobicContact CE3-CD1 4.33Å; W332-F335 WeakPolarHBondContact O-CB 3.46Å; W332-F335 PolarHBondContact O-N 2.79Å; W332-F335 VanDerWaalsContact O-N 3.16Å; F335-G338 PolarHBondContact O-N 3.1Å; F335-L339 HydrophobicContact CD1-CD1 4.12Å; F335-L339 HydrophobicContact CE1-CD1 3.48Å; F335-L339 VanDerWaalsContact CE1-CD1 3.48Å; F335-L339 HydrophobicContact CE2-CD1 4.02Å; F335-L339 HydrophobicContact CZ-CD1 3.42Å; F335-L339 VanDerWaalsContact CZ-CD1 3.42Å; F335-L339 WeakPolarHBondContact O-CB 3.36Å; F335-L339 PolarHBondContact O-N 2.9Å
336	W	46.8	Very low	48.2	Very low	145 Å²	145	93.4 Å²	93.4	55%	0.549	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-43.4	-178.9	-73.6	119	0	0	0	113.2	W332 G338 L339 C340	W332-W336 WeakPolarHBondContact O-CB 3.35Å; W332-W336 PolarHBondContact O-N 3.43Å; W336-G338 VanDerWaalsContact C-N 3.35Å; W336-G338 PolarHBondContact O-N 2.95Å; W336-L339 PolarHBondContact O-N 3.46Å; W336-C340 VanDerWaalsContact O-CB 3.29Å; W336-C340 WeakPolarHBondContact O-CB 3.43Å; W336-C340 PolarHBondContact O-N 3.13Å
337	S	51.2	Low	48.9	Very low	73 Å²	73	97.9 Å²	97.9	51%	0.51	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-37.2	175.2	58.2	0	0	0	0	112.3	S333 R334 C340 S341	S333-S337 VanDerWaalsContact O-CB 3.24Å; S333-S337 WeakPolarHBondContact O-CB 3.49Å; S333-S337 PolarHBondContact O-N 2.78Å; S333-S337 PolarHBondContact O-OG 2.56Å; R334-S337 PolarHBondContact O-OG 2.88Å; S337-C340 PolarHBondContact O-N 2.96Å; S337-S341 WeakPolarHBondContact O-CB 3.44Å; S337-S341 PolarHBondContact O-N 3Å
338	G	56.3	Low	49.5	Very low	26 Å²	26	95.7 Å²	95.7	27%	0.268	50%	0.498	S	S	.	.	H	α-helix	trans	-58	-53.1	169.5	0	0	0	0	0	111.9	R334 F335 W336 C340 S341 I342	R334-G338 PolarHBondContact O-N 3.31Å; F335-G338 PolarHBondContact O-N 3.1Å; W336-G338 VanDerWaalsContact C-N 3.35Å; W336-G338 PolarHBondContact O-N 2.95Å; G338-C340 PolarHBondContact O-N 3.44Å; G338-S341 PolarHBondContact O-N 2.76Å; G338-S341 PolarHBondContact O-OG 3.2Å; G338-I342 WeakPolarHBondContact O-CG1 3.49Å; G338-I342 PolarHBondContact O-N 3.17Å
339	L	56.5	Low	50.3	Low	29 Å²	29	99.6 Å²	99.6	15%	0.152	49%	0.494	C	S	.	.	H	α-helix	trans	-57.1	-47.2	177.2	-124.9	150.9	0	0	0	111.6	F335 W336 S341 I342 L343 I651	F335-L339 HydrophobicContact CD1-CD1 4.12Å; F335-L339 HydrophobicContact CE1-CD1 3.48Å; F335-L339 VanDerWaalsContact CE1-CD1 3.48Å; F335-L339 HydrophobicContact CE2-CD1 4.02Å; F335-L339 HydrophobicContact CZ-CD1 3.42Å; F335-L339 VanDerWaalsContact CZ-CD1 3.42Å; F335-L339 WeakPolarHBondContact O-CB 3.36Å; F335-L339 PolarHBondContact O-N 2.9Å; W336-L339 PolarHBondContact O-N 3.46Å; L339-S341 PolarHBondContact O-N 3.23Å; L339-I342 WeakPolarHBondContact O-CB 3.3Å; L339-I342 PolarHBondContact O-N 3.13Å; L339-I342 VanDerWaalsContact O-N 3.14Å; L339-L343 HydrophobicContact CD2-CD1 3.74Å; L339-L343 HydrophobicContact CD2-CG 4.03Å; L339-L343 VanDerWaalsContact O-CG 3.3Å; L339-L343 WeakPolarHBondContact O-CG 3.46Å; L339-L343 PolarHBondContact O-N 2.85Å; L339-I651 HydrophobicContact CD2-CG2 4.03Å
340	C	53	Low	51.3	Low	62 Å²	62	98 Å²	98	42%	0.419	48%	0.482	S	S	.	.	H	α-helix	trans	-63.7	-42.6	178.6	-144.4	0	0	0	0	111.5	W336 S337 G338 I342 L343 L344	W336-C340 VanDerWaalsContact O-CB 3.29Å; W336-C340 WeakPolarHBondContact O-CB 3.43Å; W336-C340 PolarHBondContact O-N 3.13Å; S337-C340 PolarHBondContact O-N 2.96Å; G338-C340 PolarHBondContact O-N 3.44Å; C340-I342 PolarHBondContact O-N 2.81Å; C340-L343 PolarHBondContact O-N 2.93Å; C340-L344 WeakPolarHBondContact O-CB 3.32Å; C340-L344 VanDerWaalsContact O-CG 3.26Å; C340-L344 WeakPolarHBondContact O-CG 3.46Å; C340-L344 PolarHBondContact O-N 2.62Å
341	S	55.1	Low	52	Low	73 Å²	73	101 Å²	101	51%	0.51	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-29.1	175	83.2	0	0	0	0	113.3	S337 G338 L339 R345	S337-S341 WeakPolarHBondContact O-CB 3.44Å; S337-S341 PolarHBondContact O-N 3Å; G338-S341 PolarHBondContact O-N 2.76Å; G338-S341 PolarHBondContact O-OG 3.2Å; L339-S341 PolarHBondContact O-N 3.23Å; S341-R345 WeakPolarHBondContact O-CB 3.44Å; S341-R345 PolarHBondContact O-N 2.72Å
342	I	52.6	Low	52.6	Low	37 Å²	37	97.5 Å²	97.5	19%	0.19	46%	0.464	C	S	.	.	H	α-helix	trans	-80.2	-50.2	177.2	-72.5	166.8	0	0	0	110.9	G338 L339 C340 L344 R345 V356 F360 F655	G338-I342 WeakPolarHBondContact O-CG1 3.49Å; G338-I342 PolarHBondContact O-N 3.17Å; L339-I342 WeakPolarHBondContact O-CB 3.3Å; L339-I342 PolarHBondContact O-N 3.13Å; L339-I342 VanDerWaalsContact O-N 3.14Å; C340-I342 PolarHBondContact O-N 2.81Å; I342-L344 VanDerWaalsContact C-N 3.31Å; I342-L344 PolarHBondContact O-N 3.39Å; I342-R345 VanDerWaalsContact O-CB 3.31Å; I342-R345 WeakPolarHBondContact O-CB 3.09Å; I342-R345 PolarHBondContact O-N 2.78Å; I342-V356 HydrophobicContact CG2-CG1 3.41Å; I342-V356 VanDerWaalsContact CG2-CG1 3.41Å; I342-F360 HydrophobicContact CD1-CD2 4.35Å; I342-F655 HydrophobicContact CG2-CD2 4.01Å; I342-F655 HydrophobicContact CG2-CE2 4.03Å
343	L	49.6	Very low	53.4	Low	49 Å²	49	91.2 Å²	91.2	26%	0.257	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-41.9	179.1	-68.7	173.1	0	0	0	111.4	L339 C340 R345 H654	L339-L343 HydrophobicContact CD2-CD1 3.74Å; L339-L343 HydrophobicContact CD2-CG 4.03Å; L339-L343 VanDerWaalsContact O-CG 3.3Å; L339-L343 WeakPolarHBondContact O-CG 3.46Å; L339-L343 PolarHBondContact O-N 2.85Å; C340-L343 PolarHBondContact O-N 2.93Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.31Å; L343-H654 PolarHBondContact O-NE2 3.16Å; L343-H654 VanDerWaalsContact O-NE2 3.16Å
344	L	51.4	Low	54.1	Low	124 Å²	124	91.9 Å²	91.9	65%	0.649	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.3	-179.7	-62.7	175.6	0	0	0	114.3	C340 I342 R346	C340-L344 WeakPolarHBondContact O-CB 3.32Å; C340-L344 VanDerWaalsContact O-CG 3.26Å; C340-L344 WeakPolarHBondContact O-CG 3.46Å; C340-L344 PolarHBondContact O-N 2.62Å; I342-L344 VanDerWaalsContact C-N 3.31Å; I342-L344 PolarHBondContact O-N 3.39Å; L344-R346 VanDerWaalsContact C-N 3.34Å; L344-R346 PolarHBondContact O-N 3.4Å
345	R	51.4	Low	55	Low	153 Å²	153	85.9 Å²	85.9	58%	0.577	42%	0.419	S	S	*	.			trans	-69.8	80.8	-171.9	-143.5	170.6	-177.3	-171.9	1	113.3	S341 I342 L343 H359	S341-R345 WeakPolarHBondContact O-CB 3.44Å; S341-R345 PolarHBondContact O-N 2.72Å; I342-R345 VanDerWaalsContact O-CB 3.31Å; I342-R345 WeakPolarHBondContact O-CB 3.09Å; I342-R345 PolarHBondContact O-N 2.78Å; L343-R345 VanDerWaalsContact C-N 3.33Å; L343-R345 PolarHBondContact O-N 3.31Å; R345-H359 PolarHBondContact NH1-CD2 3.13Å; R345-H359 PolarHBondContact NH1-CE1 3.42Å; R345-H359 PolarHBondContact NH1-NE2 2.61Å; R345-H359 PolarHBondContact NH2-NE2 2.98Å; R345-H359 VanDerWaalsContact NH2-NE2 3.12Å
346	R	47.8	Very low	55.6	Low	230 Å²	230	82.9 Å²	82.9	87%	0.868	41%	0.408	S	S	*	.			trans	-70.5	128.6	-179.1	-76.1	174.8	168.4	176.7	-2.5	112	L344	L344-R346 VanDerWaalsContact C-N 3.34Å; L344-R346 PolarHBondContact O-N 3.4Å
347	K	50.2	Low	56.6	Low	212 Å²	212	76.5 Å²	76.5	92%	0.922	39%	0.385	S	S	*	.	S	Bend	trans	73.6	56.4	163.4	-51.7	170.3	-175.9	167.5	0	117.9
348	G	51.3	Low	57.3	Low	68 Å²	68	73 Å²	73	70%	0.701	36%	0.361	S	S	*	.			trans	-109.8	148.9	155.2	0	0	0	0	0	111.5
349	R	54.5	Low	57.9	Low	202 Å²	202	77.2 Å²	77.2	76%	0.762	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-71.2	147	161.1	-63.3	-165.5	164.1	167.3	-10.4	109.2	D384	R349-D384 WeakPolarHBondContact CA-OD1 3.38Å; R349-D384 WeakPolarHBondContact CB-OD2 3.49Å; R349-D384 WeakPolarHBondContact CG-OD2 3.39Å; R349-D384 IonicContact NE-OD2 3.38Å
350	R	63	Low	58.4	Low	28 Å²	28	82.3 Å²	82.3	11%	0.106	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-83.3	125	168.1	-167.3	-176.8	-164	-129.5	3.5	108.6	D384 D659 K662 L663 D710	R350-D384 PolarHBondContact N-OD1 3.27Å; R350-D659 WeakPolarHBondContact CD-O 3.47Å; R350-D659 WeakPolarHBondContact CD-OD1 3.18Å; R350-D659 VanDerWaalsContact CZ-O 3.28Å; R350-D659 IonicContact CZ-OD2 3.25Å; R350-D659 PolarHBondContact NE-O 3.29Å; R350-D659 VanDerWaalsContact NE-O 3.1Å; R350-D659 IonicContact NE-OD1 3.59Å; R350-D659 PolarHBondContact NE-OD1 3.36Å; R350-D659 VanDerWaalsContact NE-OD1 3.13Å; R350-D659 IonicContact NE-OD2 2.74Å; R350-D659 PolarHBondContact NE-OD2 2.79Å; R350-D659 PolarHBondContact NH1-O 3.47Å; R350-D659 IonicContact NH2-OD2 3.94Å; R350-D659 PolarHBondContact NH2-OD2 3.5Å; R350-K662 HydrophobicContact CB-CB 4.25Å; R350-K662 HydrophobicContact CB-CD 4.14Å; R350-L663 VanDerWaalsContact NH1-CB 3.25Å; R350-D710 IonicContact NH1-OD2 3.03Å; R350-D710 IonicContact NH2-OD2 3.34Å
351	K	61.2	Low	59.2	Low	110 Å²	110	81.1 Å²	81.1	48%	0.478	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-89.7	147.2	170.7	-51.9	-176.9	-151.8	148.6	0	109.8	G353 E354 L365	K351-G353 PolarHBondContact O-N 3.48Å; K351-E354 HydrophobicContact CB-CB 3.8Å; K351-E354 WeakPolarHBondContact CD-OE2 3.41Å; K351-E354 WeakPolarHBondContact CE-OE2 3.43Å; K351-E354 IonicContact NZ-OE1 2.97Å; K351-E354 PolarHBondContact NZ-OE1 3.1Å; K351-E354 IonicContact NZ-OE2 3.07Å; K351-E354 PolarHBondContact NZ-OE2 3.02Å; K351-E354 CarbonylContact O-C 3.48Å; K351-E354 PolarHBondContact O-N 3.21Å; K351-L365 HydrophobicContact CB-CD1 4.39Å; K351-L365 HydrophobicContact CD-CD1 4.22Å
352	F	61.7	Low	59.8	Low	13 Å²	13	80.3 Å²	80.3	6%	0.057	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	130.4	172.4	-154.9	-69.2	0	0	0	110.1	E354 L663 S714 M717 P765 I767	F352-E354 PolarHBondContact O-N 2.82Å; F352-E354 VanDerWaalsContact O-N 3.16Å; F352-L663 HydrophobicContact CD2-CD1 3.61Å; F352-L663 HydrophobicContact CE2-CD1 3.98Å; F352-L663 HydrophobicContact CG-CD1 4.24Å; F352-S714 VanDerWaalsContact CD1-OG 3.24Å; F352-S714 WeakPolarHBondContact CD1-OG 3.48Å; F352-S714 VanDerWaalsContact CE1-OG 3.3Å; F352-S714 WeakPolarHBondContact CE1-OG 3.44Å; F352-M717 HydrophobicContact CB-CE 4.43Å; F352-M717 HydrophobicContact CD1-CE 3.43Å; F352-M717 VanDerWaalsContact CD1-CE 3.43Å; F352-M717 HydrophobicContact CE1-CE 3.92Å; F352-M717 HydrophobicContact CG-CE 4.11Å; F352-P765 HydrophobicContact CE2-CG 4.16Å; F352-I767 HydrophobicContact CD1-CD1 3.99Å; F352-I767 HydrophobicContact CD2-CD1 3.8Å; F352-I767 HydrophobicContact CE1-CD1 3.97Å; F352-I767 HydrophobicContact CE2-CD1 3.78Å; F352-I767 HydrophobicContact CE2-CG1 4.26Å; F352-I767 HydrophobicContact CG-CD1 3.92Å; F352-I767 HydrophobicContact CZ-CD1 3.87Å; F352-I767 HydrophobicContact CZ-CG1 4.43Å
353	G	58.4	Low	60.8	Low	2 Å²	2	79.8 Å²	79.8	2%	0.021	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	-6.5	-174.2	0	0	0	0	0	116.5	K351 D710 S714	K351-G353 PolarHBondContact O-N 3.48Å; G353-D710 PolarHBondContact N-OD1 3.47Å; G353-S714 WeakPolarHBondContact CA-OG 3.41Å
354	E	63	Low	61.8	Low	60 Å²	60	81.3 Å²	81.3	28%	0.28	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-117.6	56.1	-178.5	-124.8	-174.7	-119.1	0	0	110.4	K351 F352 L365	K351-E354 HydrophobicContact CB-CB 3.8Å; K351-E354 WeakPolarHBondContact CD-OE2 3.41Å; K351-E354 WeakPolarHBondContact CE-OE2 3.43Å; K351-E354 IonicContact NZ-OE1 2.97Å; K351-E354 PolarHBondContact NZ-OE1 3.1Å; K351-E354 IonicContact NZ-OE2 3.07Å; K351-E354 PolarHBondContact NZ-OE2 3.02Å; K351-E354 CarbonylContact O-C 3.48Å; K351-E354 PolarHBondContact O-N 3.21Å; F352-E354 PolarHBondContact O-N 2.82Å; F352-E354 VanDerWaalsContact O-N 3.16Å; E354-L365 HydrophobicContact CB-CD1 4.04Å; E354-L365 HydrophobicContact CB-CG 4.4Å; E354-L365 HydrophobicContact CG-CD1 4.13Å; E354-L365 HydrophobicContact CG-CG 4.14Å; E354-L365 WeakPolarHBondContact OE1-CD1 3.35Å; E354-L365 WeakPolarHBondContact OE1-CG 3.33Å
355	G	65.3	Low	62.8	Low	7 Å²	7	77.5 Å²	77.5	7%	0.072	38%	0.375	C	S	.	.			trans	-73.9	174.1	170.7	0	0	0	0	0	113.7	V357 G358 H359 D659	G355-V357 VanDerWaalsContact C-N 3.35Å; G355-V357 PolarHBondContact O-N 3.38Å; G355-G358 CarbonylContact O-C 3.58Å; G355-G358 WeakPolarHBondContact O-CA 3.21Å; G355-G358 PolarHBondContact O-N 3.39Å; G355-H359 PolarHBondContact O-N 3.28Å; G355-D659 WeakPolarHBondContact CA-OD2 3.36Å
356	V	66.8	Low	63.9	Low	37 Å²	37	75.4 Å²	75.4	22%	0.224	37%	0.367	C	S	.	.	H	α-helix	trans	-58.6	-45.9	179.3	179.2	0	0	0	0	111.2	I342 G358 H359 F360 F655 D659	I342-V356 HydrophobicContact CG2-CG1 3.41Å; I342-V356 VanDerWaalsContact CG2-CG1 3.41Å; V356-G358 PolarHBondContact O-N 3.46Å; V356-H359 PolarHBondContact O-N 3.34Å; V356-H359 VanDerWaalsContact O-N 3.16Å; V356-F360 PolarHBondContact O-N 3Å; V356-F655 HydrophobicContact CB-CE2 4.42Å; V356-F655 HydrophobicContact CG1-CD2 3.76Å; V356-F655 HydrophobicContact CG1-CE2 3.39Å; V356-F655 HydrophobicContact CG1-CZ 4.14Å; V356-D659 HydrophobicContact CG2-CB 4.49Å; V356-D659 PolarHBondContact N-OD2 2.84Å
357	V	67.9	Low	64.9	Low	11 Å²	11	73.2 Å²	73.2	7%	0.067	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-34.8	173.3	-165.8	0	0	0	0	111.6	G355 F360 L361 F655 L656 L707	G355-V357 VanDerWaalsContact C-N 3.35Å; G355-V357 PolarHBondContact O-N 3.38Å; V357-F360 PolarHBondContact O-N 3.42Å; V357-L361 HydrophobicContact CG1-CD1 4.05Å; V357-L361 HydrophobicContact CG1-CG 4.44Å; V357-L361 WeakPolarHBondContact O-CB 3.12Å; V357-L361 WeakPolarHBondContact O-CG 3.36Å; V357-L361 PolarHBondContact O-N 2.8Å; V357-F655 HydrophobicContact CG2-CD1 4.37Å; V357-F655 HydrophobicContact CG2-CE1 3.7Å; V357-F655 HydrophobicContact CG2-CZ 4.13Å; V357-L656 HydrophobicContact CG2-CD2 3.79Å; V357-L707 HydrophobicContact CG2-CD1 3.8Å
358	G	66.3	Low	65.9	Low	1 Å²	1	70.2 Å²	70.2	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-67.5	-41.6	175.8	0	0	0	0	0	112.8	G355 V356 L361 G362 R363	G355-G358 CarbonylContact O-C 3.58Å; G355-G358 WeakPolarHBondContact O-CA 3.21Å; G355-G358 PolarHBondContact O-N 3.39Å; V356-G358 PolarHBondContact O-N 3.46Å; G358-L361 PolarHBondContact O-N 3.41Å; G358-G362 PolarHBondContact O-N 3.28Å; G358-R363 WeakPolarHBondContact O-CB 3.45Å; G358-R363 WeakPolarHBondContact O-CG 3.37Å; G358-R363 PolarHBondContact O-N 3.43Å
359	H	68.4	Low	66.5	Low	114 Å²	114	71.9 Å²	71.9	53%	0.528	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-36.1	173.6	-172.7	-49.4	0	0	0	111.9	R345 G355 V356 G362	R345-H359 PolarHBondContact NH1-CD2 3.13Å; R345-H359 PolarHBondContact NH1-CE1 3.42Å; R345-H359 PolarHBondContact NH1-NE2 2.61Å; R345-H359 PolarHBondContact NH2-NE2 2.98Å; R345-H359 VanDerWaalsContact NH2-NE2 3.12Å; G355-H359 PolarHBondContact O-N 3.28Å; V356-H359 PolarHBondContact O-N 3.34Å; V356-H359 VanDerWaalsContact O-N 3.16Å; H359-G362 PolarHBondContact O-N 3.23Å
360	F	66.8	Low	67.3	Low	135 Å²	135	67.2 Å²	67.2	59%	0.592	33%	0.329	S	S	*	.	H	α-helix	trans	-65.3	-44.5	175.3	-175.7	-102	0	0	0	111.7	I342 V356 V357 G362	I342-F360 HydrophobicContact CD1-CD2 4.35Å; V356-F360 PolarHBondContact O-N 3Å; V357-F360 PolarHBondContact O-N 3.42Å; F360-G362 PolarHBondContact O-N 3.45Å
361	L	71.3	Confident	67.7	Low	37 Å²	37	67.4 Å²	67.4	19%	0.194	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	7.8	177.3	-65	176.4	0	0	0	114.5	V357 G358 R363 Q727	V357-L361 HydrophobicContact CG1-CD1 4.05Å; V357-L361 HydrophobicContact CG1-CG 4.44Å; V357-L361 WeakPolarHBondContact O-CB 3.12Å; V357-L361 WeakPolarHBondContact O-CG 3.36Å; V357-L361 PolarHBondContact O-N 2.8Å; G358-L361 PolarHBondContact O-N 3.41Å; L361-R363 VanDerWaalsContact C-N 3.33Å; L361-R363 HydrophobicContact CB-CG 4.34Å; L361-R363 PolarHBondContact O-N 2.92Å; L361-Q727 HydrophobicContact CD1-CB 4.04Å; L361-Q727 HydrophobicContact CD2-CB 4.23Å; L361-Q727 PolarHBondContact O-NE2 2.87Å
362	G	67.3	Low	68.4	Low	57 Å²	57	65 Å²	65	59%	0.588	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	26.1	177.6	0	0	0	0	0	115.1	G358 H359 F360	G358-G362 PolarHBondContact O-N 3.28Å; H359-G362 PolarHBondContact O-N 3.23Å; F360-G362 PolarHBondContact O-N 3.45Å
363	R	72.7	Confident	69	Low	26 Å²	26	69.7 Å²	69.7	10%	0.098	36%	0.361	C	S	.	.			trans	-68.9	137.6	-179.5	-60.7	-174.6	-176.1	161	-7.1	111.2	G358 L361 V711 A724	G358-R363 WeakPolarHBondContact O-CB 3.45Å; G358-R363 WeakPolarHBondContact O-CG 3.37Å; G358-R363 PolarHBondContact O-N 3.43Å; L361-R363 VanDerWaalsContact C-N 3.33Å; L361-R363 HydrophobicContact CB-CG 4.34Å; L361-R363 PolarHBondContact O-N 2.92Å; R363-V711 VanDerWaalsContact NH1-CG2 3.26Å; R363-A724 HydrophobicContact CG-CB 4Å; R363-A724 PolarHBondContact NH2-O 3.4Å
364	T	72.1	Confident	69.9	Low	81 Å²	81	76.5 Å²	76.5	50%	0.497	39%	0.392	S	S	.	.			trans	-118.8	129.1	175.9	44.3	0	0	0	0	110.8	A719	T364-A719 WeakPolarHBondContact O-CB 3.41Å; T364-A719 PolarHBondContact O-N 2.81Å
365	L	70.6	Confident	70.5	Confident	44 Å²	44	73.8 Å²	73.8	23%	0.23	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-72.3	152.8	165.4	-72.9	177.2	0	0	0	110.6	K351 E354 M717 I718	K351-L365 HydrophobicContact CB-CD1 4.39Å; K351-L365 HydrophobicContact CD-CD1 4.22Å; E354-L365 HydrophobicContact CB-CD1 4.04Å; E354-L365 HydrophobicContact CB-CG 4.4Å; E354-L365 HydrophobicContact CG-CD1 4.13Å; E354-L365 HydrophobicContact CG-CG 4.14Å; E354-L365 WeakPolarHBondContact OE1-CD1 3.35Å; E354-L365 WeakPolarHBondContact OE1-CG 3.33Å; L365-M717 HydrophobicContact CD2-CB 4.2Å; L365-I718 HydrophobicContact CD2-CG1 4.35Å
366	R	74.9	Confident	71	Confident	109 Å²	109	74.4 Å²	74.4	41%	0.411	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-61.5	153.9	165.6	-72.6	-177	-172.9	-144.5	-2.5	110.6	E370 L371 K716 M717 I718 A719	R366-E370 HydrophobicContact CB-CB 4.41Å; R366-E370 VanDerWaalsContact CB-OE2 3.29Å; R366-E370 WeakPolarHBondContact CB-OE2 3.49Å; R366-L371 HydrophobicContact CB-CD1 3.99Å; R366-K716 WeakPolarHBondContact CD-O 3.47Å; R366-K716 PolarHBondContact NE-O 3.37Å; R366-M717 WeakPolarHBondContact CB-O 3.38Å; R366-M717 WeakPolarHBondContact CG-O 3.49Å; R366-M717 PolarHBondContact N-O 2.97Å; R366-I718 PolarHBondContact NE-O 3.45Å; R366-A719 HydrophobicContact CG-CB 4.44Å
367	R	69.4	Low	71.4	Confident	183 Å²	183	78.5 Å²	78.5	69%	0.691	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-64.4	145.8	179.9	-56.9	179.2	-149.9	-144.2	1.7	109.6	S369 E370 L371	R367-S369 WeakPolarHBondContact CB-OG 3.43Å; R367-S369 PolarHBondContact O-N 2.85Å; R367-E370 HydrophobicContact CB-CG 4.13Å; R367-E370 WeakPolarHBondContact CB-OE1 3.17Å; R367-E370 VanDerWaalsContact CD-OE1 3.26Å; R367-E370 WeakPolarHBondContact CD-OE1 3.36Å; R367-E370 WeakPolarHBondContact CG-OE1 3.37Å; R367-E370 PolarHBondContact N-OE2 3.07Å; R367-E370 IonicContact NE-OE1 2.68Å; R367-E370 PolarHBondContact NE-OE1 3.34Å; R367-E370 WeakPolarHBondContact O-CB 3.44Å; R367-E370 PolarHBondContact O-N 3.13Å; R367-L371 WeakPolarHBondContact O-CD1 3.39Å
368	R	71.4	Confident	71.7	Confident	150 Å²	150	81.1 Å²	81.1	57%	0.566	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-57.3	-21.2	178	-173.2	169.1	165.7	132.6	-0.5	113.7	V376 D380	R368-V376 HydrophobicContact CG-CG1 3.96Å; R368-V376 HydrophobicContact CG-CG2 4.16Å; R368-V376 VanDerWaalsContact CZ-CG1 3.41Å; R368-V376 VanDerWaalsContact NE-CG1 3.33Å; R368-V376 VanDerWaalsContact NH2-CG1 3.33Å; R368-D380 IonicContact CZ-OD1 2.65Å; R368-D380 IonicContact CZ-OD2 3.32Å; R368-D380 IonicContact NH1-OD1 2.66Å; R368-D380 PolarHBondContact NH1-OD1 2.93Å; R368-D380 IonicContact NH1-OD2 3.51Å; R368-D380 IonicContact NH2-OD1 3.55Å; R368-D380 PolarHBondContact NH2-OD1 3.1Å; R368-D380 IonicContact NH2-OD2 3.35Å; R368-D380 PolarHBondContact NH2-OD2 3.37Å
369	S	63.9	Low	72	Confident	103 Å²	103	83.6 Å²	83.6	72%	0.72	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-75.5	-15	172.2	53	0	0	0	0	115.2	R367	R367-S369 WeakPolarHBondContact CB-OG 3.43Å; R367-S369 PolarHBondContact O-N 2.85Å
370	E	70.6	Confident	72.1	Confident	103 Å²	103	82.1 Å²	82.1	48%	0.481	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-96.4	-4.2	-178.5	-62.1	160.9	-156.9	0	0	112.2	R366 R367	R366-E370 HydrophobicContact CB-CB 4.41Å; R366-E370 VanDerWaalsContact CB-OE2 3.29Å; R366-E370 WeakPolarHBondContact CB-OE2 3.49Å; R367-E370 HydrophobicContact CB-CG 4.13Å; R367-E370 WeakPolarHBondContact CB-OE1 3.17Å; R367-E370 VanDerWaalsContact CD-OE1 3.26Å; R367-E370 WeakPolarHBondContact CD-OE1 3.36Å; R367-E370 WeakPolarHBondContact CG-OE1 3.37Å; R367-E370 PolarHBondContact N-OE2 3.07Å; R367-E370 IonicContact NE-OE1 2.68Å; R367-E370 PolarHBondContact NE-OE1 3.34Å; R367-E370 WeakPolarHBondContact O-CB 3.44Å; R367-E370 PolarHBondContact O-N 3.13Å
371	L	72.2	Confident	72.3	Confident	32 Å²	32	81.3 Å²	81.3	17%	0.168	42%	0.421	C	S	.	.	S	Bend	trans	-102.4	149.5	177.7	-73	83.5	0	0	0	110.5	R366 R367 V375 V376 M717	R366-L371 HydrophobicContact CB-CD1 3.99Å; R367-L371 WeakPolarHBondContact O-CD1 3.39Å; L371-V375 HydrophobicContact CD2-CG1 3.93Å; L371-V376 HydrophobicContact CB-CG2 3.75Å; L371-M717 HydrophobicContact CD2-CB 4.37Å; L371-M717 HydrophobicContact CD2-CG 3.85Å; L371-M717 HydrophobicContact CD2-SD 3.96Å
372	S	74.8	Confident	72.2	Confident	59 Å²	59	83.7 Å²	83.7	41%	0.413	43%	0.43	S	S	.	.			trans	-67.7	144.3	177.3	61.9	0	0	0	0	111.3	Q374 V375 V376	S372-Q374 PolarHBondContact O-N 3.45Å; S372-Q374 VanDerWaalsContact O-N 3.09Å; S372-V375 PolarHBondContact O-N 3.27Å; S372-V375 WeakPolarHBondContact OG-CG2 3.4Å; S372-V376 PolarHBondContact O-N 3.4Å
373	P	74.3	Confident	72.2	Confident	112 Å²	112	87.8 Å²	87.8	73%	0.727	44%	0.438	S	S	*	.	H	α-helix	trans	-55.3	-33	-177.1	-29.5	36	0	0	0	114.4	V376 Q377	P373-V376 PolarHBondContact O-N 3.08Å; P373-Q377 WeakPolarHBondContact O-CB 3.33Å; P373-Q377 PolarHBondContact O-N 3.29Å
374	Q	77.5	Confident	71.9	Confident	146 Å²	146	89.7 Å²	89.7	68%	0.682	45%	0.45	S	S	*	.	H	α-helix	trans	-64.2	-41.2	176.1	-67.2	175.9	-9	0	0	112.5	S372 Q378	S372-Q374 PolarHBondContact O-N 3.45Å; S372-Q374 VanDerWaalsContact O-N 3.09Å; Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 2.97Å
375	V	75.5	Confident	72.2	Confident	2 Å²	2	91 Å²	91	1%	0.012	45%	0.447	C	S	.	.	H	α-helix	trans	-72.5	-38.1	176.4	172.8	0	0	0	0	110.3	L371 S372 Q377 Q378 L379 M717 I767 F769	L371-V375 HydrophobicContact CD2-CG1 3.93Å; S372-V375 PolarHBondContact O-N 3.27Å; S372-V375 WeakPolarHBondContact OG-CG2 3.4Å; V375-Q377 VanDerWaalsContact C-N 3.34Å; V375-Q377 PolarHBondContact O-N 3.32Å; V375-Q378 PolarHBondContact O-N 2.75Å; V375-L379 HydrophobicContact CG1-CD1 3.97Å; V375-L379 WeakPolarHBondContact O-CD1 3.2Å; V375-L379 PolarHBondContact O-N 3.49Å; V375-M717 HydrophobicContact CG1-SD 4.2Å; V375-I767 HydrophobicContact CG1-CG2 3.93Å; V375-I767 HydrophobicContact CG2-CG2 4.13Å; V375-F769 HydrophobicContact CG1-CE1 4.22Å; V375-F769 HydrophobicContact CG2-CD1 3.81Å; V375-F769 HydrophobicContact CG2-CE1 3.79Å
376	V	75.8	Confident	72.7	Confident	20 Å²	20	95.3 Å²	95.3	12%	0.121	46%	0.46	C	S	.	.	H	α-helix	trans	-61.5	-41.4	174.9	174.5	0	0	0	0	111.6	R368 L371 S372 P373 L379 D380	R368-V376 HydrophobicContact CG-CG1 3.96Å; R368-V376 HydrophobicContact CG-CG2 4.16Å; R368-V376 VanDerWaalsContact CZ-CG1 3.41Å; R368-V376 VanDerWaalsContact NE-CG1 3.33Å; R368-V376 VanDerWaalsContact NH2-CG1 3.33Å; L371-V376 HydrophobicContact CB-CG2 3.75Å; S372-V376 PolarHBondContact O-N 3.4Å; P373-V376 PolarHBondContact O-N 3.08Å; V376-L379 PolarHBondContact O-N 2.91Å; V376-D380 PolarHBondContact O-N 2.85Å
377	Q	76.2	Confident	73.2	Confident	124 Å²	124	91 Å²	91	58%	0.579	45%	0.446	S	S	*	.	H	α-helix	trans	-64.8	-47.5	173.6	-176.9	178.4	-7.6	0	0	111.5	P373 V375 L379 D380 D381	P373-Q377 WeakPolarHBondContact O-CB 3.33Å; P373-Q377 PolarHBondContact O-N 3.29Å; V375-Q377 VanDerWaalsContact C-N 3.34Å; V375-Q377 PolarHBondContact O-N 3.32Å; Q377-L379 PolarHBondContact O-N 3.34Å; Q377-D380 PolarHBondContact O-N 3.29Å; Q377-D381 PolarHBondContact O-N 2.94Å
378	Q	74.1	Confident	74.2	Confident	66 Å²	66	86.2 Å²	86.2	31%	0.308	43%	0.43	S	S	.	.	H	α-helix	trans	-56.1	-33.6	174.9	-75.3	173	-0.5	0	0	112.5	Q374 V375 F382	Q374-Q378 WeakPolarHBondContact O-CG 3.26Å; Q374-Q378 PolarHBondContact O-N 2.97Å; V375-Q378 PolarHBondContact O-N 2.75Å; Q378-F382 WeakPolarHBondContact O-CD2 3.3Å; Q378-F382 WeakPolarHBondContact O-CE2 3.46Å
379	L	72.4	Confident	75.2	Confident	52 Å²	52	79.7 Å²	79.7	27%	0.272	41%	0.406	S	S	.	.	H	α-helix	trans	-72.4	-30.4	175	-100.6	70	0	0	0	114	V375 V376 Q377 M717 I767	V375-L379 HydrophobicContact CG1-CD1 3.97Å; V375-L379 WeakPolarHBondContact O-CD1 3.2Å; V375-L379 PolarHBondContact O-N 3.49Å; V376-L379 PolarHBondContact O-N 2.91Å; Q377-L379 PolarHBondContact O-N 3.34Å; L379-M717 HydrophobicContact CD1-SD 3.95Å; L379-M717 HydrophobicContact CD2-SD 4.31Å; L379-I767 HydrophobicContact CD1-CD1 3.69Å
380	D	70.3	Confident	76.5	Confident	84 Å²	84	74.8 Å²	74.8	45%	0.449	37%	0.372	S	S	.	.	H	α-helix	trans	-78.7	-28.6	175.3	-75.6	-19.9	0	0	0	112.3	R368 V376 Q377 F382	R368-D380 IonicContact CZ-OD1 2.65Å; R368-D380 IonicContact CZ-OD2 3.32Å; R368-D380 IonicContact NH1-OD1 2.66Å; R368-D380 PolarHBondContact NH1-OD1 2.93Å; R368-D380 IonicContact NH1-OD2 3.51Å; R368-D380 IonicContact NH2-OD1 3.55Å; R368-D380 PolarHBondContact NH2-OD1 3.1Å; R368-D380 IonicContact NH2-OD2 3.35Å; R368-D380 PolarHBondContact NH2-OD2 3.37Å; V376-D380 PolarHBondContact O-N 2.85Å; Q377-D380 PolarHBondContact O-N 3.29Å; D380-F382 VanDerWaalsContact C-N 3.29Å; D380-F382 PolarHBondContact O-N 3.28Å
381	D	71	Confident	77.4	Confident	117 Å²	117	74.5 Å²	74.5	63%	0.626	37%	0.367	S	S	*	.	S	Bend	trans	-76.7	-6.3	-179.4	-72.1	-27.7	0	0	0	113.9	Q377 D383	Q377-D381 PolarHBondContact O-N 2.94Å; D381-D383 PolarHBondContact O-N 3.49Å
382	F	70	Confident	78.4	Confident	88 Å²	88	75.4 Å²	75.4	39%	0.386	37%	0.368	S	S	.	.			trans	-82.4	109	174.6	-80.9	-71.5	0	0	0	112.2	Q378 D380 P765 I767	Q378-F382 WeakPolarHBondContact O-CD2 3.3Å; Q378-F382 WeakPolarHBondContact O-CE2 3.46Å; D380-F382 VanDerWaalsContact C-N 3.29Å; D380-F382 PolarHBondContact O-N 3.28Å; F382-P765 HydrophobicContact CE1-CB 3.85Å; F382-P765 HydrophobicContact CE1-CG 4.39Å; F382-P765 HydrophobicContact CZ-CB 4Å; F382-I767 HydrophobicContact CE2-CG1 4.35Å
383	D	65.8	Low	79.3	Confident	143 Å²	143	72.6 Å²	72.6	77%	0.765	35%	0.349	S	S	*	.			trans	-69.2	132.3	168.3	-91.7	-40.6	0	0	0	112	D381 Y385	D381-D383 PolarHBondContact O-N 3.49Å; D383-Y385 PolarHBondContact O-N 3.33Å
384	D	66.4	Low	80.2	Confident	65 Å²	65	68 Å²	68	35%	0.348	32%	0.319	S	S	.	.			trans	-62.1	115.6	169.3	-73.7	-82.2	0	0	0	110.3	R349 R350	R349-D384 WeakPolarHBondContact CA-OD1 3.38Å; R349-D384 WeakPolarHBondContact CB-OD2 3.49Å; R349-D384 WeakPolarHBondContact CG-OD2 3.39Å; R349-D384 IonicContact NE-OD2 3.38Å; R350-D384 PolarHBondContact N-OD1 3.27Å
385	Y	80	Confident	81	Confident	109 Å²	109	64.8 Å²	64.8	43%	0.427	31%	0.309	S	S	.	.			trans	-69.5	145	170.7	-68.3	-74.4	0	0	0	111.3	D383 E661 K662 G665	D383-Y385 PolarHBondContact O-N 3.33Å; Y385-E661 WeakPolarHBondContact CB-O 3.42Å; Y385-K662 PolarHBondContact N-O 3.23Å; Y385-K662 WeakPolarHBondContact O-CA 3.43Å; Y385-G665 VanDerWaalsContact CD2-CA 3.48Å
386	R	81	Confident	81.8	Confident	134 Å²	134	65.9 Å²	65.9	51%	0.506	32%	0.316	S	S	.	.			trans	-79.7	134.1	170.2	-67.9	-175.4	179.8	-159.8	2.3	109.4	F388	R386-F388 VanDerWaalsContact C-N 3.32Å; R386-F388 HydrophobicContact CB-CD2 3.99Å; R386-F388 HydrophobicContact CB-CE1 4.38Å; R386-F388 HydrophobicContact CB-CE2 3.65Å; R386-F388 HydrophobicContact CB-CZ 3.87Å; R386-F388 HydrophobicContact CG-CE2 4.46Å; R386-F388 HydrophobicContact CG-CZ 4.42Å; R386-F388 WeakPolarHBondContact O-CD2 3.33Å; R386-F388 PolarHBondContact O-N 3.49Å
387	P	85.7	Confident	82.8	Confident	18 Å²	18	65 Å²	65	12%	0.117	31%	0.31	C	S	.	.			trans	-78.9	79.8	-178.7	31.2	-34.3	0	0	0	110.8	Y391 R658 E661	P387-Y391 HydrophobicContact CG-CE2 3.92Å; P387-Y391 WeakPolarHBondContact O-CD2 3.31Å; P387-Y391 WeakPolarHBondContact O-CE2 3.38Å; P387-R658 HydrophobicContact CB-CG 4.02Å; P387-R658 HydrophobicContact CG-CG 4Å; P387-E661 VanDerWaalsContact C-OE2 3.27Å; P387-E661 WeakPolarHBondContact CA-OE1 3.31Å; P387-E661 WeakPolarHBondContact CA-OE2 3.32Å; P387-E661 HydrophobicContact CB-CB 4.23Å; P387-E661 WeakPolarHBondContact CB-OE2 3.31Å
388	F	89.2	Confident	83.7	Confident	83 Å²	83	62 Å²	62	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-81.7	-41.8	-179.8	-69.4	-65.4	0	0	0	111.9	A144 R386 W392 E661	A144-F388 HydrophobicContact CB-CE1 3.77Å; A144-F388 HydrophobicContact CB-CZ 3.71Å; R386-F388 VanDerWaalsContact C-N 3.32Å; R386-F388 HydrophobicContact CB-CD2 3.99Å; R386-F388 HydrophobicContact CB-CE1 4.38Å; R386-F388 HydrophobicContact CB-CE2 3.65Å; R386-F388 HydrophobicContact CB-CZ 3.87Å; R386-F388 HydrophobicContact CG-CE2 4.46Å; R386-F388 HydrophobicContact CG-CZ 4.42Å; R386-F388 WeakPolarHBondContact O-CD2 3.33Å; R386-F388 PolarHBondContact O-N 3.49Å; F388-W392 WeakPolarHBondContact O-CB 3.29Å; F388-W392 PolarHBondContact O-N 3.1Å; F388-E661 PolarHBondContact N-OE1 3.35Å
389	F	92.1	Very high	84.6	Confident	14 Å²	14	63.2 Å²	63.2	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-43.8	179.7	178.1	-103.4	0	0	0	110.6	Y391 W392 I393 L657 E661 W666 A670 Y673	F389-Y391 PolarHBondContact O-N 2.99Å; F389-W392 AromaticContact CD2-CE3 3.82Å; F389-W392 HydrophobicContact CD2-CE3 3.82Å; F389-W392 HydrophobicContact CD2-CZ3 4.13Å; F389-W392 AromaticContact CE2-CE3 3.75Å; F389-W392 HydrophobicContact CE2-CE3 3.75Å; F389-W392 AromaticContact CE2-CZ3 3.59Å; F389-W392 HydrophobicContact CE2-CZ3 3.59Å; F389-W392 HydrophobicContact CZ-CZ3 4.4Å; F389-W392 PolarHBondContact O-N 3.08Å; F389-W392 VanDerWaalsContact O-N 3.14Å; F389-I393 HydrophobicContact CD1-CG2 4.48Å; F389-I393 HydrophobicContact CE1-CG2 4.25Å; F389-I393 HydrophobicContact CZ-CB 4.4Å; F389-I393 WeakPolarHBondContact O-CG2 3.34Å; F389-I393 PolarHBondContact O-N 3.46Å; F389-L657 HydrophobicContact CD1-CD1 4.16Å; F389-L657 HydrophobicContact CD1-CD2 4.13Å; F389-L657 HydrophobicContact CE1-CD1 4.19Å; F389-L657 HydrophobicContact CE1-CD2 4.13Å; F389-E661 WeakPolarHBondContact CB-OE1 3.34Å; F389-E661 PolarHBondContact N-OE1 3.25Å; F389-E661 PolarHBondContact N-OE2 3.03Å; F389-W666 HydrophobicContact CB-CB 4.25Å; F389-A670 HydrophobicContact CD1-CB 4.33Å; F389-A670 HydrophobicContact CD2-CB 3.54Å; F389-A670 HydrophobicContact CE1-CB 4.32Å; F389-A670 HydrophobicContact CE2-CB 3.51Å; F389-A670 HydrophobicContact CG-CB 3.97Å; F389-A670 HydrophobicContact CZ-CB 3.93Å; F389-Y673 HydrophobicContact CE1-CD1 4Å; F389-Y673 HydrophobicContact CE1-CD2 4.3Å; F389-Y673 AromaticContact CE1-CG 3.82Å; F389-Y673 HydrophobicContact CE1-CG 3.82Å; F389-Y673 AromaticContact CZ-CD1 3.73Å; F389-Y673 HydrophobicContact CZ-CD1 3.73Å; F389-Y673 HydrophobicContact CZ-CE1 4.31Å; F389-Y673 HydrophobicContact CZ-CG 4.02Å
390	T	91.4	Very high	85.6	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-53.4	-53.4	176.4	-51.4	0	0	0	0	111.5	W392 I393 T394 L657 R658 E661	T390-W392 VanDerWaalsContact C-N 3.31Å; T390-W392 PolarHBondContact O-N 2.96Å; T390-I393 WeakPolarHBondContact O-CG2 3.37Å; T390-T394 WeakPolarHBondContact O-CG2 3.38Å; T390-T394 PolarHBondContact O-N 3.46Å; T390-T394 VanDerWaalsContact O-N 3.13Å; T390-T394 PolarHBondContact O-OG1 3.33Å; T390-T394 VanDerWaalsContact O-OG1 3.08Å; T390-L657 HydrophobicContact CG2-CB 4.46Å; T390-L657 HydrophobicContact CG2-CD2 4.2Å; T390-L657 HydrophobicContact CG2-CG 4.33Å; T390-R658 HydrophobicContact CG2-CB 3.89Å; T390-R658 HydrophobicContact CG2-CG 4.31Å; T390-R658 WeakPolarHBondContact OG1-CA 3.34Å; T390-R658 PolarHBondContact OG1-N 3.08Å; T390-E661 WeakPolarHBondContact CB-OE2 3.39Å; T390-E661 PolarHBondContact N-OE2 3.5Å; T390-E661 PolarHBondContact OG1-OE2 3.41Å
391	Y	90.9	Very high	86.8	Confident	97 Å²	97	58.5 Å²	58.5	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-68.9	-30.6	-179.1	-61.7	-47	0	0	0	112.5	P387 F389 T394 T395 H654 R658	P387-Y391 HydrophobicContact CG-CE2 3.92Å; P387-Y391 WeakPolarHBondContact O-CD2 3.31Å; P387-Y391 WeakPolarHBondContact O-CE2 3.38Å; F389-Y391 PolarHBondContact O-N 2.99Å; Y391-T394 PolarHBondContact O-OG1 2.96Å; Y391-T395 VanDerWaalsContact O-CB 3.3Å; Y391-T395 WeakPolarHBondContact O-CB 3.3Å; Y391-T395 PolarHBondContact O-N 3.38Å; Y391-T395 PolarHBondContact O-OG1 3.05Å; Y391-H654 AromaticContact CE1-CE1 3.46Å; Y391-H654 VanDerWaalsContact CE1-CE1 3.46Å; Y391-H654 WeakPolarHBondContact CE1-CE1 3.42Å; Y391-R658 PolarHBondContact OH-NE 3.04Å; Y391-R658 PolarHBondContact OH-NH2 3.14Å
392	W	93.1	Very high	87.9	Confident	50 Å²	50	57.2 Å²	57.2	19%	0.189	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-53.7	174.5	173	84	0	0	0	111.2	S155 F388 F389 T390 T394 T395 V396 F638	S155-W392 PolarHBondContact OG-NE1 3.04Å; F388-W392 WeakPolarHBondContact O-CB 3.29Å; F388-W392 PolarHBondContact O-N 3.1Å; F389-W392 AromaticContact CD2-CE3 3.82Å; F389-W392 HydrophobicContact CD2-CE3 3.82Å; F389-W392 HydrophobicContact CD2-CZ3 4.13Å; F389-W392 AromaticContact CE2-CE3 3.75Å; F389-W392 HydrophobicContact CE2-CE3 3.75Å; F389-W392 AromaticContact CE2-CZ3 3.59Å; F389-W392 HydrophobicContact CE2-CZ3 3.59Å; F389-W392 HydrophobicContact CZ-CZ3 4.4Å; F389-W392 PolarHBondContact O-N 3.08Å; F389-W392 VanDerWaalsContact O-N 3.14Å; T390-W392 VanDerWaalsContact C-N 3.31Å; T390-W392 PolarHBondContact O-N 2.96Å; W392-T394 PolarHBondContact O-N 3.14Å; W392-T395 PolarHBondContact O-N 3.08Å; W392-T395 VanDerWaalsContact O-N 3.1Å; W392-V396 HydrophobicContact CD2-CG2 4.36Å; W392-V396 HydrophobicContact CZ2-CG2 4.25Å; W392-V396 WeakPolarHBondContact O-CG2 3.45Å; W392-V396 PolarHBondContact O-N 3.24Å; W392-F638 AromaticContact CH2-CE1 3.94Å; W392-F638 HydrophobicContact CH2-CE1 3.94Å; W392-F638 HydrophobicContact CH2-CZ 4.31Å; W392-F638 HydrophobicContact CZ3-CE1 4.3Å
393	I	93.4	Very high	89	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-42.1	-175.8	-171	60.4	0	0	0	112	F389 T390 T395 V396 Q397 F638 L657 Y673	F389-I393 HydrophobicContact CD1-CG2 4.48Å; F389-I393 HydrophobicContact CE1-CG2 4.25Å; F389-I393 HydrophobicContact CZ-CB 4.4Å; F389-I393 WeakPolarHBondContact O-CG2 3.34Å; F389-I393 PolarHBondContact O-N 3.46Å; T390-I393 WeakPolarHBondContact O-CG2 3.37Å; I393-T395 VanDerWaalsContact C-N 3.28Å; I393-T395 PolarHBondContact O-N 3.09Å; I393-V396 PolarHBondContact O-N 2.88Å; I393-Q397 HydrophobicContact CD1-CG 4.29Å; I393-Q397 HydrophobicContact CG1-CG 4.43Å; I393-Q397 WeakPolarHBondContact O-CB 3.42Å; I393-Q397 VanDerWaalsContact O-CG 3.29Å; I393-Q397 WeakPolarHBondContact O-CG 3.35Å; I393-Q397 PolarHBondContact O-N 2.84Å; I393-Q397 PolarHBondContact O-OE1 2.75Å; I393-F638 HydrophobicContact CD1-CD1 3.58Å; I393-F638 HydrophobicContact CD1-CE1 3.32Å; I393-F638 HydrophobicContact CD1-CZ 4.25Å; I393-L657 HydrophobicContact CG2-CD2 3.62Å; I393-Y673 HydrophobicContact CD1-CE1 4.19Å; I393-Y673 HydrophobicContact CG1-CE1 3.96Å; I393-Y673 WeakPolarHBondContact CG1-OH 3.49Å
394	T	93.2	Very high	90.2	Very high	17 Å²	17	49.9 Å²	49.9	10%	0.104	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-35.1	174.4	57.4	0	0	0	0	112.1	T390 Y391 W392 V398 V650 Q653	T390-T394 WeakPolarHBondContact O-CG2 3.38Å; T390-T394 PolarHBondContact O-N 3.46Å; T390-T394 VanDerWaalsContact O-N 3.13Å; T390-T394 PolarHBondContact O-OG1 3.33Å; T390-T394 VanDerWaalsContact O-OG1 3.08Å; Y391-T394 PolarHBondContact O-OG1 2.96Å; W392-T394 PolarHBondContact O-N 3.14Å; T394-V398 WeakPolarHBondContact O-CB 3.22Å; T394-V398 VanDerWaalsContact O-CG2 3.28Å; T394-V398 WeakPolarHBondContact O-CG2 3.41Å; T394-V398 PolarHBondContact O-N 3.08Å; T394-V398 VanDerWaalsContact O-N 3.1Å; T394-V650 HydrophobicContact CG2-CG1 4.26Å; T394-V650 HydrophobicContact CG2-CG2 4.26Å; T394-Q653 HydrophobicContact CG2-CB 4.25Å
395	T	93.3	Very high	91.5	Very high	78 Å²	78	48 Å²	48	48%	0.479	23%	0.231	S	C	.	.	H	α-helix	trans	-70.8	-43.2	178.3	-57.1	0	0	0	0	111	Y391 W392 I393 V398 L399	Y391-T395 VanDerWaalsContact O-CB 3.3Å; Y391-T395 WeakPolarHBondContact O-CB 3.3Å; Y391-T395 PolarHBondContact O-N 3.38Å; Y391-T395 PolarHBondContact O-OG1 3.05Å; W392-T395 PolarHBondContact O-N 3.08Å; W392-T395 VanDerWaalsContact O-N 3.1Å; I393-T395 VanDerWaalsContact C-N 3.28Å; I393-T395 PolarHBondContact O-N 3.09Å; T395-V398 PolarHBondContact O-N 3.28Å; T395-L399 HydrophobicContact CG2-CD1 3.95Å; T395-L399 HydrophobicContact CG2-CG 4.43Å; T395-L399 WeakPolarHBondContact O-CB 3.1Å; T395-L399 VanDerWaalsContact O-CG 3.28Å; T395-L399 WeakPolarHBondContact O-CG 3.25Å; T395-L399 PolarHBondContact O-N 3.47Å
396	V	93.3	Very high	92.1	Very high	25 Å²	25	48.7 Å²	48.7	15%	0.152	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-46	176.4	176.7	0	0	0	0	110.6	W392 I393 V398 L399 V400 F638	W392-V396 HydrophobicContact CD2-CG2 4.36Å; W392-V396 HydrophobicContact CZ2-CG2 4.25Å; W392-V396 WeakPolarHBondContact O-CG2 3.45Å; W392-V396 PolarHBondContact O-N 3.24Å; I393-V396 PolarHBondContact O-N 2.88Å; V396-V398 PolarHBondContact O-N 3.28Å; V396-L399 PolarHBondContact O-N 3.08Å; V396-V400 HydrophobicContact CG1-CG2 4.15Å; V396-V400 WeakPolarHBondContact O-CB 3.31Å; V396-V400 VanDerWaalsContact O-CG2 3.31Å; V396-V400 WeakPolarHBondContact O-CG2 3.5Å; V396-V400 PolarHBondContact O-N 3.48Å; V396-F638 HydrophobicContact CB-CD1 4.41Å; V396-F638 HydrophobicContact CG1-CD1 3.63Å; V396-F638 HydrophobicContact CG1-CE1 4.2Å
397	Q	95.6	Very high	92.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-40.7	179.9	-73.8	168.3	-25.4	0	0	113.2	I393 M401 L637 Y673	I393-Q397 HydrophobicContact CD1-CG 4.29Å; I393-Q397 HydrophobicContact CG1-CG 4.43Å; I393-Q397 WeakPolarHBondContact O-CB 3.42Å; I393-Q397 VanDerWaalsContact O-CG 3.29Å; I393-Q397 WeakPolarHBondContact O-CG 3.35Å; I393-Q397 PolarHBondContact O-N 2.84Å; I393-Q397 PolarHBondContact O-OE1 2.75Å; Q397-M401 WeakPolarHBondContact O-CB 3.44Å; Q397-M401 PolarHBondContact O-N 3.31Å; Q397-L637 PolarHBondContact NE2-O 3.25Å; Q397-Y673 PolarHBondContact NE2-OH 3.48Å
398	V	95.1	Very high	92.7	Very high	61 Å²	61	47.7 Å²	47.7	37%	0.37	25%	0.25	S	C	.	.	H	α-helix	trans	-67.9	-39.8	174.8	169.8	0	0	0	0	111.4	T394 T395 V396 M401 I402 V650	T394-V398 WeakPolarHBondContact O-CB 3.22Å; T394-V398 VanDerWaalsContact O-CG2 3.28Å; T394-V398 WeakPolarHBondContact O-CG2 3.41Å; T394-V398 PolarHBondContact O-N 3.08Å; T394-V398 VanDerWaalsContact O-N 3.1Å; T395-V398 PolarHBondContact O-N 3.28Å; V396-V398 PolarHBondContact O-N 3.28Å; V398-M401 PolarHBondContact O-N 2.8Å; V398-I402 HydrophobicContact CG1-CD1 3.93Å; V398-I402 WeakPolarHBondContact O-CD1 3.4Å; V398-I402 VanDerWaalsContact O-CG1 3.28Å; V398-I402 WeakPolarHBondContact O-CG1 3.44Å; V398-I402 PolarHBondContact O-N 3.18Å; V398-V650 HydrophobicContact CG2-CG2 4.06Å
399	L	94.2	Very high	92.8	Very high	93 Å²	93	45 Å²	45	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-66.7	-42.5	176.4	-72.6	171.7	0	0	0	112.4	T395 V396 I402 I403	T395-L399 HydrophobicContact CG2-CD1 3.95Å; T395-L399 HydrophobicContact CG2-CG 4.43Å; T395-L399 WeakPolarHBondContact O-CB 3.1Å; T395-L399 VanDerWaalsContact O-CG 3.28Å; T395-L399 WeakPolarHBondContact O-CG 3.25Å; T395-L399 PolarHBondContact O-N 3.47Å; V396-L399 PolarHBondContact O-N 3.08Å; L399-I402 PolarHBondContact O-N 3.3Å; L399-I403 VanDerWaalsContact O-CG1 3.3Å; L399-I403 WeakPolarHBondContact O-CG1 3.27Å; L399-I403 PolarHBondContact O-N 3.04Å
400	V	93.2	Very high	92.8	Very high	24 Å²	24	49.9 Å²	49.9	15%	0.145	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-40.7	176.7	169.3	0	0	0	0	111.1	V396 I403 A404 L639	V396-V400 HydrophobicContact CG1-CG2 4.15Å; V396-V400 WeakPolarHBondContact O-CB 3.31Å; V396-V400 VanDerWaalsContact O-CG2 3.31Å; V396-V400 WeakPolarHBondContact O-CG2 3.5Å; V396-V400 PolarHBondContact O-N 3.48Å; V400-I403 PolarHBondContact O-N 3.31Å; V400-A404 WeakPolarHBondContact O-CB 3.37Å; V400-A404 PolarHBondContact O-N 3.36Å; V400-L639 HydrophobicContact CG1-CD2 3.81Å
401	M	94.3	Very high	92.5	Very high	13 Å²	13	50.2 Å²	50.2	6%	0.064	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-44.4	172.2	173.4	51.8	54.9	0	0	112	Q397 V398 L405 H640 G642 I643 C646	Q397-M401 WeakPolarHBondContact O-CB 3.44Å; Q397-M401 PolarHBondContact O-N 3.31Å; V398-M401 PolarHBondContact O-N 2.8Å; M401-L405 HydrophobicContact CG-CD1 4.23Å; M401-L405 WeakPolarHBondContact O-CB 3.37Å; M401-L405 VanDerWaalsContact O-CG 3.3Å; M401-L405 WeakPolarHBondContact O-CG 3.33Å; M401-L405 PolarHBondContact O-N 3.21Å; M401-L405 VanDerWaalsContact O-N 3.12Å; M401-L405 HydrophobicContact SD-CD1 3.67Å; M401-L405 HydrophobicContact SD-CD2 4.48Å; M401-L405 HydrophobicContact SD-CG 3.84Å; M401-H640 HydrophobicContact CE-CB 3.61Å; M401-H640 VanDerWaalsContact CE-O 3.25Å; M401-H640 WeakPolarHBondContact CE-O 3.43Å; M401-G642 VanDerWaalsContact CE-C 3.5Å; M401-I643 HydrophobicContact SD-CG1 4.4Å; M401-C646 HydrophobicContact CG-CB 4.21Å
402	I	94.3	Very high	92.2	Very high	89 Å²	89	46.5 Å²	46.5	46%	0.456	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-43.5	176.3	-68.7	163.2	0	0	0	111.2	V398 L399 L405 V406	V398-I402 HydrophobicContact CG1-CD1 3.93Å; V398-I402 WeakPolarHBondContact O-CD1 3.4Å; V398-I402 VanDerWaalsContact O-CG1 3.28Å; V398-I402 WeakPolarHBondContact O-CG1 3.44Å; V398-I402 PolarHBondContact O-N 3.18Å; L399-I402 PolarHBondContact O-N 3.3Å; I402-L405 PolarHBondContact O-N 3Å; I402-V406 HydrophobicContact CG2-CG2 4.45Å; I402-V406 WeakPolarHBondContact O-CB 3.36Å; I402-V406 VanDerWaalsContact O-CG2 3.25Å; I402-V406 WeakPolarHBondContact O-CG2 3.45Å; I402-V406 PolarHBondContact O-N 3.17Å
403	I	92.9	Very high	92	Very high	72 Å²	72	48.9 Å²	48.9	37%	0.369	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-48.7	179.3	-69.3	163.6	0	0	0	110.6	F166 L399 V400 L405 V406 S407	F166-I403 HydrophobicContact CD1-CG2 3.55Å; F166-I403 HydrophobicContact CE1-CG2 3.48Å; F166-I403 VanDerWaalsContact CE1-CG2 3.48Å; F166-I403 HydrophobicContact CG-CG2 4.35Å; F166-I403 HydrophobicContact CZ-CG2 4.22Å; L399-I403 VanDerWaalsContact O-CG1 3.3Å; L399-I403 WeakPolarHBondContact O-CG1 3.27Å; L399-I403 PolarHBondContact O-N 3.04Å; V400-I403 PolarHBondContact O-N 3.31Å; I403-L405 VanDerWaalsContact C-N 3.32Å; I403-L405 PolarHBondContact O-N 3.29Å; I403-V406 PolarHBondContact O-N 3.1Å; I403-S407 PolarHBondContact O-N 3.13Å; I403-S407 PolarHBondContact O-OG 3.46Å
404	A	91.4	Very high	91.3	Very high	5 Å²	5	49.7 Å²	49.7	4%	0.041	28%	0.282	C	S	.	.	H	α-helix	trans	-58.5	-41.3	179.3	0	0	0	0	0	112.8	V400 V406 S407 Y408 P446 L454	V400-A404 WeakPolarHBondContact O-CB 3.37Å; V400-A404 PolarHBondContact O-N 3.36Å; A404-V406 VanDerWaalsContact C-N 3.33Å; A404-S407 PolarHBondContact O-N 3.43Å; A404-S407 PolarHBondContact O-OG 3.44Å; A404-Y408 PolarHBondContact O-N 3.06Å; A404-P446 HydrophobicContact CB-CG 4.21Å; A404-L454 HydrophobicContact CB-CD1 3.7Å
405	L	93.9	Very high	90.6	Very high	25 Å²	25	55.1 Å²	55.1	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-69.2	-28.2	175.2	-71.7	175.2	0	0	0	113.6	M401 I402 I403 G409 F410 P446 I643	M401-L405 HydrophobicContact CG-CD1 4.23Å; M401-L405 WeakPolarHBondContact O-CB 3.37Å; M401-L405 VanDerWaalsContact O-CG 3.3Å; M401-L405 WeakPolarHBondContact O-CG 3.33Å; M401-L405 PolarHBondContact O-N 3.21Å; M401-L405 VanDerWaalsContact O-N 3.12Å; M401-L405 HydrophobicContact SD-CD1 3.67Å; M401-L405 HydrophobicContact SD-CD2 4.48Å; M401-L405 HydrophobicContact SD-CG 3.84Å; I402-L405 PolarHBondContact O-N 3Å; I403-L405 VanDerWaalsContact C-N 3.32Å; I403-L405 PolarHBondContact O-N 3.29Å; L405-G409 WeakPolarHBondContact CD2-O 3.42Å; L405-G409 VanDerWaalsContact O-CA 3.23Å; L405-G409 WeakPolarHBondContact O-CA 3.25Å; L405-G409 PolarHBondContact O-N 2.87Å; L405-F410 HydrophobicContact CD1-CE1 4.01Å; L405-F410 HydrophobicContact CD1-CZ 4.13Å; L405-F410 HydrophobicContact CD2-CD1 3.58Å; L405-F410 HydrophobicContact CD2-CE1 3.36Å; L405-F410 HydrophobicContact CD2-CE2 4.5Å; L405-F410 HydrophobicContact CD2-CG 4.25Å; L405-F410 HydrophobicContact CD2-CZ 3.87Å; L405-F410 HydrophobicContact CG-CE1 4.26Å; L405-F410 HydrophobicContact CG-CZ 4.44Å; L405-P446 HydrophobicContact CD2-CG 4.42Å; L405-I643 HydrophobicContact CD1-CD1 3.9Å; L405-I643 HydrophobicContact CD1-CG1 3.72Å
406	V	92.9	Very high	89.7	Confident	124 Å²	124	61.1 Å²	61.1	75%	0.752	32%	0.318	S	S	*	.	H	α-helix	trans	-80.2	-30.3	177.3	167.2	0	0	0	0	111.8	I402 I403 A404	I402-V406 HydrophobicContact CG2-CG2 4.45Å; I402-V406 WeakPolarHBondContact O-CB 3.36Å; I402-V406 VanDerWaalsContact O-CG2 3.25Å; I402-V406 WeakPolarHBondContact O-CG2 3.45Å; I402-V406 PolarHBondContact O-N 3.17Å; I403-V406 PolarHBondContact O-N 3.1Å; A404-V406 VanDerWaalsContact C-N 3.33Å
407	S	90.4	Very high	88.8	Confident	60 Å²	60	66 Å²	66	42%	0.42	33%	0.334	S	S	.	.	H	α-helix	trans	-93.2	-35.7	-179.3	62.5	0	0	0	0	114.6	I403 A404	I403-S407 PolarHBondContact O-N 3.13Å; I403-S407 PolarHBondContact O-OG 3.46Å; A404-S407 PolarHBondContact O-N 3.43Å; A404-S407 PolarHBondContact O-OG 3.44Å
408	Y	89.3	Confident	87.7	Confident	71 Å²	71	68 Å²	68	28%	0.278	35%	0.346	S	S	.	.	S	Bend	trans	-110.6	-8.5	-178.6	-62.4	-87.1	0	0	0	113.7	A404 D450 H453 L454	A404-Y408 PolarHBondContact O-N 3.06Å; Y408-D450 HydrophobicContact CD1-CB 3.67Å; Y408-D450 HydrophobicContact CE1-CB 4.39Å; Y408-D450 HydrophobicContact CG-CB 3.85Å; Y408-H453 PolarHBondContact OH-CD2 3.01Å; Y408-L454 HydrophobicContact CD2-CD1 3.85Å; Y408-L454 HydrophobicContact CD2-CD2 4.14Å; Y408-L454 HydrophobicContact CD2-CG 4.01Å; Y408-L454 HydrophobicContact CE2-CD1 4.03Å; Y408-L454 HydrophobicContact CE2-CD2 3.56Å; Y408-L454 HydrophobicContact CE2-CG 3.64Å
409	G	90.2	Very high	86.9	Confident	26 Å²	26	70.1 Å²	70.1	27%	0.268	35%	0.352	S	S	.	.			trans	72.7	-145.4	-178.9	0	0	0	0	0	113.6	L405	L405-G409 WeakPolarHBondContact CD2-O 3.42Å; L405-G409 VanDerWaalsContact O-CA 3.23Å; L405-G409 WeakPolarHBondContact O-CA 3.25Å; L405-G409 PolarHBondContact O-N 2.87Å
410	F	91.8	Very high	86.4	Confident	117 Å²	117	68.9 Å²	68.9	51%	0.513	34%	0.341	S	S	.	.			trans	-121.7	133.2	178.8	-62.5	-89	0	0	0	109.8	L405 I444 G445 I643	L405-F410 HydrophobicContact CD1-CE1 4.01Å; L405-F410 HydrophobicContact CD1-CZ 4.13Å; L405-F410 HydrophobicContact CD2-CD1 3.58Å; L405-F410 HydrophobicContact CD2-CE1 3.36Å; L405-F410 HydrophobicContact CD2-CE2 4.5Å; L405-F410 HydrophobicContact CD2-CG 4.25Å; L405-F410 HydrophobicContact CD2-CZ 3.87Å; L405-F410 HydrophobicContact CG-CE1 4.26Å; L405-F410 HydrophobicContact CG-CZ 4.44Å; F410-I444 HydrophobicContact CD1-CG2 3.84Å; F410-I444 HydrophobicContact CE1-CG2 3.79Å; F410-G445 WeakPolarHBondContact CA-O 3.41Å; F410-I643 HydrophobicContact CE1-CD1 3.97Å; F410-I643 HydrophobicContact CZ-CD1 4.41Å
411	G	85.8	Confident	85.9	Confident	7 Å²	7	70.4 Å²	70.4	7%	0.072	35%	0.352	C	S	.	.			trans	-74	175.1	165.6	0	0	0	0	0	112.4	I413 G445	G411-I413 PolarHBondContact O-N 3.35Å; G411-G445 PolarHBondContact N-O 2.93Å
412	P	84.6	Confident	85.3	Confident	19 Å²	19	71 Å²	71	12%	0.123	36%	0.36	C	S	.	.			trans	-57.5	137.7	175.5	21.8	-30.7	0	0	0	111.4	T418 E438 D440 N441	P412-T418 WeakPolarHBondContact CB-OG1 3.37Å; P412-E438 VanDerWaalsContact CD-OE2 3.23Å; P412-E438 WeakPolarHBondContact CD-OE2 3.37Å; P412-E438 HydrophobicContact CG-CB 4.46Å; P412-E438 HydrophobicContact CG-CG 4.19Å; P412-D440 WeakPolarHBondContact O-CA 3.41Å; P412-N441 PolarHBondContact O-N 3.38Å
413	I	88.2	Confident	85	Confident	101 Å²	101	71.2 Å²	71.2	52%	0.518	36%	0.36	S	S	.	.			trans	-106.1	106.4	-172.9	-55.3	172	0	0	0	110.1	G411 I444	G411-I413 PolarHBondContact O-N 3.35Å; I413-I444 HydrophobicContact CD1-CG1 4.43Å; I413-I444 HydrophobicContact CD1-CG2 3.98Å; I413-I444 HydrophobicContact CG2-CG1 4Å
414	G	79.5	Confident	84.6	Confident	17 Å²	17	67.9 Å²	67.9	18%	0.175	34%	0.343	C	S	.	.	S	Bend	trans	-178.8	-164.8	-177.7	0	0	0	0	0	110.6	D440 F442	G414-D440 VanDerWaalsContact CA-OD2 3.31Å; G414-D440 WeakPolarHBondContact CA-OD2 3.32Å; G414-D440 VanDerWaalsContact O-CB 3.31Å; G414-D440 WeakPolarHBondContact O-CB 3.29Å; G414-F442 WeakPolarHBondContact O-CA 3.34Å; G414-F442 WeakPolarHBondContact O-CB 3.5Å; G414-F442 PolarHBondContact O-N 3.48Å; G414-F442 VanDerWaalsContact O-N 3.11Å
415	F	77.8	Confident	84.3	Confident	131 Å²	131	70.6 Å²	70.6	58%	0.575	36%	0.356	S	S	*	.	S	Bend	trans	-118	1.8	175.8	-69.5	-87.9	0	0	0	112.5	D440 F442	F415-D440 PolarHBondContact N-OD2 3.39Å; F415-F442 HydrophobicContact CD1-CB 3.58Å; F415-F442 HydrophobicContact CD1-CD1 4.05Å; F415-F442 HydrophobicContact CD1-CD2 4.33Å; F415-F442 AromaticContact CD1-CG 3.78Å; F415-F442 HydrophobicContact CD1-CG 3.78Å; F415-F442 HydrophobicContact CD2-CB 4.39Å; F415-F442 HydrophobicContact CE1-CB 3.43Å; F415-F442 VanDerWaalsContact CE1-CB 3.43Å; F415-F442 HydrophobicContact CE1-CD1 4.02Å; F415-F442 AromaticContact CE1-CD2 3.52Å; F415-F442 HydrophobicContact CE1-CD2 3.52Å; F415-F442 HydrophobicContact CE1-CE2 4.17Å; F415-F442 AromaticContact CE1-CG 3.41Å; F415-F442 HydrophobicContact CE1-CG 3.41Å; F415-F442 VanDerWaalsContact CE1-CG 3.41Å; F415-F442 HydrophobicContact CE2-CB 4.27Å; F415-F442 HydrophobicContact CG-CB 4.08Å; F415-F442 HydrophobicContact CZ-CB 3.8Å; F415-F442 AromaticContact CZ-CD2 4Å; F415-F442 HydrophobicContact CZ-CD2 4Å; F415-F442 HydrophobicContact CZ-CG 4.11Å
416	W	76.2	Confident	83.9	Confident	203 Å²	203	70 Å²	70	77%	0.769	35%	0.353	S	S	*	.	S	Bend	trans	-110.7	-158.4	-166	-52.7	114	0	0	0	110.2	Q439 D440	W416-Q439 PolarHBondContact O-NE2 3.16Å; W416-D440 WeakPolarHBondContact CA-OD2 3.37Å; W416-D440 PolarHBondContact N-OD2 3.21Å; W416-D440 VanDerWaalsContact O-CB 3.31Å; W416-D440 WeakPolarHBondContact O-CB 3.42Å; W416-D440 PolarHBondContact O-N 3.18Å
417	R	74.1	Confident	83.4	Confident	129 Å²	129	64.9 Å²	64.9	49%	0.487	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.9	166.9	-65	176.6	-176.8	171.6	1.3	108.2	F437 E438 S909	R417-F437 HydrophobicContact CB-CB 4.26Å; R417-F437 HydrophobicContact CB-CD1 4.19Å; R417-E438 CarbonylContact C-O 3.56Å; R417-E438 WeakPolarHBondContact CA-O 3.14Å; R417-S909 PolarHBondContact NH1-OG 3.13Å; R417-S909 PolarHBondContact NH2-OG 3.37Å
418	T	72.7	Confident	82.9	Confident	42 Å²	42	64.4 Å²	64.4	26%	0.258	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	125.7	169.9	-67.6	0	0	0	0	109.1	P412 Y420 E438 D440	P412-T418 WeakPolarHBondContact CB-OG1 3.37Å; T418-Y420 HydrophobicContact CG2-CD1 4.38Å; T418-Y420 HydrophobicContact CG2-CD2 4.18Å; T418-Y420 HydrophobicContact CG2-CE1 3.87Å; T418-Y420 HydrophobicContact CG2-CE2 3.66Å; T418-Y420 VanDerWaalsContact CG2-CZ 3.48Å; T418-E438 PolarHBondContact N-O 3.41Å; T418-E438 PolarHBondContact O-N 3.05Å; T418-D440 PolarHBondContact N-OD1 3.27Å; T418-D440 PolarHBondContact OG1-OD1 2.96Å
419	H	77.4	Confident	82.3	Confident	104 Å²	104	63.5 Å²	63.5	48%	0.481	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116	179.9	168	-65.9	0	0	0	110	A435 F437	H419-A435 VanDerWaalsContact CD2-CB 3.44Å; H419-A435 WeakPolarHBondContact CD2-CB 3.46Å; H419-A435 VanDerWaalsContact CE1-CB 3.44Å; H419-A435 WeakPolarHBondContact CE1-CB 2.99Å; H419-A435 WeakPolarHBondContact NE2-CB 3.39Å; H419-F437 HydrophobicContact CB-CD1 4.22Å; H419-F437 HydrophobicContact CB-CE1 4.08Å; H419-F437 AromaticContact CD2-CE1 3.76Å; H419-F437 AromaticContact CD2-CZ 3.97Å
420	Y	82.8	Confident	81.7	Confident	68 Å²	68	65.8 Å²	65.8	27%	0.267	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.9	178.2	-68.7	-69.1	0	0	0	110.7	T418 A435 Y436 E438	T418-Y420 HydrophobicContact CG2-CD1 4.38Å; T418-Y420 HydrophobicContact CG2-CD2 4.18Å; T418-Y420 HydrophobicContact CG2-CE1 3.87Å; T418-Y420 HydrophobicContact CG2-CE2 3.66Å; T418-Y420 VanDerWaalsContact CG2-CZ 3.48Å; Y420-A435 CarbonylContact O-C 3.48Å; Y420-A435 VanDerWaalsContact O-CA 3.23Å; Y420-A435 WeakPolarHBondContact O-CA 3.3Å; Y420-Y436 HydrophobicContact CD2-CE1 4.27Å; Y420-Y436 AromaticContact CD2-CE2 3.98Å; Y420-Y436 HydrophobicContact CD2-CE2 3.98Å; Y420-Y436 AromaticContact CD2-CZ 3.83Å; Y420-Y436 HydrophobicContact CG-CE1 4.25Å; Y420-Y436 PolarHBondContact N-O 2.92Å; Y420-Y436 PolarHBondContact O-N 3Å; Y420-E438 HydrophobicContact CD2-CB 4.24Å; Y420-E438 HydrophobicContact CE2-CB 3.91Å
421	S	84.2	Confident	81.4	Confident	55 Å²	55	65.3 Å²	65.3	39%	0.385	33%	0.33	S	S	.	.			trans	-146.9	134	-170.4	56	0	0	0	0	113.5	V434	S421-V434 WeakPolarHBondContact CA-O 3.38Å; S421-V434 WeakPolarHBondContact CB-O 3.47Å
422	A	81.9	Confident	81.1	Confident	26 Å²	26	68.8 Å²	68.8	22%	0.215	34%	0.344	C	S	.	.			trans	-163.1	-159	176	0	0	0	0	0	112.7	P244 S245 Q433 F594	P244-A422 CarbonylContact O-C 3.45Å; P244-A422 VanDerWaalsContact O-O 3.09Å; S245-A422 WeakPolarHBondContact OG-CB 2.96Å; A422-Q433 WeakPolarHBondContact O-CB 3.29Å; A422-F594 HydrophobicContact CB-CE2 4.14Å
423	M	87.7	Confident	81.1	Confident	94 Å²	94	74.3 Å²	74.3	46%	0.463	37%	0.368	S	S	.	.			trans	-137.8	82.7	-169.8	-60.2	-85	-41.3	0	0	116.2	P244 S245 L431 E432 Q433	P244-M423 WeakPolarHBondContact O-CA 3.49Å; P244-M423 PolarHBondContact O-N 3.18Å; S245-M423 VanDerWaalsContact CB-N 3.31Å; M423-L431 HydrophobicContact CE-CB 4.07Å; M423-L431 VanDerWaalsContact CE-O 3.26Å; M423-L431 WeakPolarHBondContact CE-O 3.16Å; M423-E432 WeakPolarHBondContact CA-O 3.33Å; M423-Q433 HydrophobicContact CG-CB 4.39Å; M423-Q433 HydrophobicContact SD-CB 3.41Å; M423-Q433 WeakPolarHBondContact SD-CB 3.47Å
424	V	84.3	Confident	80.7	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.006	35%	0.348	C	S	.	.			trans	-94.4	170.1	171.8	108.1	0	0	0	0	116	P244 S245 A246 Q426 L431 E590	P244-V424 HydrophobicContact CB-CB 3.28Å; P244-V424 HydrophobicContact CB-CG1 3.12Å; P244-V424 WeakPolarHBondContact CB-O 3.44Å; P244-V424 HydrophobicContact CG-CB 4.43Å; P244-V424 HydrophobicContact CG-CG1 4.48Å; P244-V424 PolarHBondContact O-N 2.75Å; S245-V424 VanDerWaalsContact CA-CG2 3.42Å; A246-V424 HydrophobicContact CB-CG2 3.79Å; V424-Q426 PolarHBondContact O-N 3.43Å; V424-L431 WeakPolarHBondContact O-CA 3.21Å; V424-E590 HydrophobicContact CB-CB 4.37Å; V424-E590 HydrophobicContact CG1-CB 4.32Å; V424-E590 HydrophobicContact CG2-CB 3.13Å; V424-E590 HydrophobicContact CG2-CG 4.05Å; V424-E590 WeakPolarHBondContact CG2-OE2 3.19Å
425	L	83.9	Confident	80.6	Confident	63 Å²	63	70.7 Å²	70.7	33%	0.33	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-67.4	113.5	167.5	-163.8	69.2	0	0	0	113.3	L429 L431 T588	L425-L429 HydrophobicContact CD1-CB 4.09Å; L425-L429 HydrophobicContact CD1-CD2 4.01Å; L425-L429 WeakPolarHBondContact CD1-O 3.47Å; L425-L429 HydrophobicContact CD2-CD2 3.75Å; L425-L429 HydrophobicContact CG-CD2 3.84Å; L425-L431 HydrophobicContact CB-CD2 4.38Å; L425-T588 WeakPolarHBondContact O-CB 3.32Å; L425-T588 WeakPolarHBondContact O-CG2 3.31Å; L425-T588 PolarHBondContact O-OG1 3.1Å
426	Q	85.4	Confident	80.7	Confident	12 Å²	12	66.3 Å²	66.3	6%	0.056	33%	0.33	C	S	.	.			trans	-65.4	167.7	167.1	-72.3	-55.3	-15.3	0	0	113.1	P243 V424 S428 L429 V430 E432 T588	P243-Q426 VanDerWaalsContact CD-NE2 3.27Å; P243-Q426 VanDerWaalsContact CG-OE1 3.28Å; V424-Q426 PolarHBondContact O-N 3.43Å; Q426-S428 WeakPolarHBondContact CB-OG 3.5Å; Q426-S428 PolarHBondContact O-N 2.9Å; Q426-L429 VanDerWaalsContact O-CA 3.29Å; Q426-L429 WeakPolarHBondContact O-CA 3.44Å; Q426-L429 PolarHBondContact O-N 3.37Å; Q426-V430 WeakPolarHBondContact CB-O 3.33Å; Q426-V430 WeakPolarHBondContact CG-O 3.46Å; Q426-V430 PolarHBondContact N-O 3.3Å; Q426-E432 VanDerWaalsContact CD-OE2 3.28Å; Q426-E432 HydrophobicContact CG-CB 4.38Å; Q426-E432 HydrophobicContact CG-CG 3.86Å; Q426-E432 VanDerWaalsContact CG-OE2 3.3Å; Q426-E432 WeakPolarHBondContact CG-OE2 3.31Å; Q426-E432 PolarHBondContact NE2-OE2 3.05Å; Q426-T588 VanDerWaalsContact C-CG2 3.49Å
427	P	84	Confident	80.7	Confident	17 Å²	17	62 Å²	62	11%	0.11	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.6	163	-21.4	35.1	0	0	0	112.9	L429 F487 V494 T572 T588	P427-L429 PolarHBondContact O-N 3.16Å; P427-F487 WeakPolarHBondContact O-CE2 3.43Å; P427-V494 HydrophobicContact CB-CB 4.21Å; P427-V494 HydrophobicContact CB-CG1 4.48Å; P427-V494 HydrophobicContact CB-CG2 3.77Å; P427-T572 PolarHBondContact O-OG1 2.9Å; P427-T572 VanDerWaalsContact O-OG1 3.1Å; P427-T588 HydrophobicContact CG-CG2 4.18Å
428	S	78.6	Confident	80.8	Confident	50 Å²	50	56.9 Å²	56.9	35%	0.35	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-0.2	167.5	64.1	0	0	0	0	114.1	Q426 V430	Q426-S428 WeakPolarHBondContact CB-OG 3.5Å; Q426-S428 PolarHBondContact O-N 2.9Å; S428-V430 PolarHBondContact O-N 3.47Å; S428-V430 VanDerWaalsContact O-N 3.17Å
429	L	76.8	Confident	80.9	Confident	52 Å²	52	57.5 Å²	57.5	27%	0.272	30%	0.298	S	S	.	.	S	Bend	trans	60.5	15.6	-177.1	-55.6	173.9	0	0	0	115.2	L425 Q426 P427 F487 S491 T572	L425-L429 HydrophobicContact CD1-CB 4.09Å; L425-L429 HydrophobicContact CD1-CD2 4.01Å; L425-L429 WeakPolarHBondContact CD1-O 3.47Å; L425-L429 HydrophobicContact CD2-CD2 3.75Å; L425-L429 HydrophobicContact CG-CD2 3.84Å; Q426-L429 VanDerWaalsContact O-CA 3.29Å; Q426-L429 WeakPolarHBondContact O-CA 3.44Å; Q426-L429 PolarHBondContact O-N 3.37Å; P427-L429 PolarHBondContact O-N 3.16Å; L429-F487 HydrophobicContact CD1-CD2 4.41Å; L429-S491 WeakPolarHBondContact CD1-OG 3.35Å; L429-T572 HydrophobicContact CD1-CG2 4.25Å; L429-T572 HydrophobicContact CD2-CG2 3.9Å; L429-T572 HydrophobicContact CG-CG2 4.26Å
430	V	79.1	Confident	81.1	Confident	73 Å²	73	53.3 Å²	53.3	44%	0.442	28%	0.28	S	S	.	.			trans	-86	145.1	171	-176.2	0	0	0	0	110.3	Q426 S428 E432	Q426-V430 WeakPolarHBondContact CB-O 3.33Å; Q426-V430 WeakPolarHBondContact CG-O 3.46Å; Q426-V430 PolarHBondContact N-O 3.3Å; S428-V430 PolarHBondContact O-N 3.47Å; S428-V430 VanDerWaalsContact O-N 3.17Å; V430-E432 HydrophobicContact CB-CG 4.24Å; V430-E432 HydrophobicContact CG1-CG 3.79Å
431	L	84.7	Confident	81.2	Confident	108 Å²	108	50.9 Å²	50.9	57%	0.565	27%	0.271	S	S	*	.	B	Isolated β-bridge	trans	-90.9	109.8	168.8	-62.4	172	0	0	0	109.4	M423 V424 L425	M423-L431 HydrophobicContact CE-CB 4.07Å; M423-L431 VanDerWaalsContact CE-O 3.26Å; M423-L431 WeakPolarHBondContact CE-O 3.16Å; V424-L431 WeakPolarHBondContact O-CA 3.21Å; L425-L431 HydrophobicContact CB-CD2 4.38Å
432	E	79.6	Confident	81.4	Confident	79 Å²	79	50.7 Å²	50.7	37%	0.369	26%	0.263	S	S	.	.			trans	-113	173	-173.1	-65.9	-175.4	160.5	0	0	114.4	P244 M423 Q426 V430	P244-E432 HydrophobicContact CG-CB 4.2Å; P244-E432 WeakPolarHBondContact CG-O 3.45Å; M423-E432 WeakPolarHBondContact CA-O 3.33Å; Q426-E432 VanDerWaalsContact CD-OE2 3.28Å; Q426-E432 HydrophobicContact CG-CB 4.38Å; Q426-E432 HydrophobicContact CG-CG 3.86Å; Q426-E432 VanDerWaalsContact CG-OE2 3.3Å; Q426-E432 WeakPolarHBondContact CG-OE2 3.31Å; Q426-E432 PolarHBondContact NE2-OE2 3.05Å; V430-E432 HydrophobicContact CB-CG 4.24Å; V430-E432 HydrophobicContact CG1-CG 3.79Å
433	Q	83.9	Confident	81.8	Confident	135 Å²	135	51.8 Å²	51.8	63%	0.631	26%	0.262	S	S	*	.			trans	-77.3	136.4	167.6	165.1	-158.4	50.1	0	0	115.6	A422 M423	A422-Q433 WeakPolarHBondContact O-CB 3.29Å; M423-Q433 HydrophobicContact CG-CB 4.39Å; M423-Q433 HydrophobicContact SD-CB 3.41Å; M423-Q433 WeakPolarHBondContact SD-CB 3.47Å
434	V	80	Confident	82	Confident	16 Å²	16	49.9 Å²	49.9	10%	0.097	25%	0.253	C	S	.	.			trans	-138.2	161.2	153.9	146.5	0	0	0	0	116.3	L242 P243 S421 F594	L242-V434 WeakPolarHBondContact O-CG2 3.29Å; P243-V434 VanDerWaalsContact CA-CG2 3.49Å; P243-V434 WeakPolarHBondContact O-CB 3.35Å; P243-V434 WeakPolarHBondContact O-CG1 3.32Å; P243-V434 VanDerWaalsContact O-CG2 3.25Å; P243-V434 WeakPolarHBondContact O-CG2 3.29Å; S421-V434 WeakPolarHBondContact CA-O 3.38Å; S421-V434 WeakPolarHBondContact CB-O 3.47Å; V434-F594 HydrophobicContact CB-CE1 4.47Å; V434-F594 HydrophobicContact CG1-CE1 3.56Å; V434-F594 HydrophobicContact CG1-CZ 4.1Å
435	A	77.9	Confident	82.4	Confident	27 Å²	27	49.8 Å²	49.8	22%	0.223	25%	0.253	C	S	.	.			trans	-125.7	141.3	141.1	0	0	0	0	0	113.3	H419 Y420	H419-A435 VanDerWaalsContact CD2-CB 3.44Å; H419-A435 WeakPolarHBondContact CD2-CB 3.46Å; H419-A435 VanDerWaalsContact CE1-CB 3.44Å; H419-A435 WeakPolarHBondContact CE1-CB 2.99Å; H419-A435 WeakPolarHBondContact NE2-CB 3.39Å; Y420-A435 CarbonylContact O-C 3.48Å; Y420-A435 VanDerWaalsContact O-CA 3.23Å; Y420-A435 WeakPolarHBondContact O-CA 3.3Å
436	Y	80.4	Confident	82.8	Confident	38 Å²	38	46.8 Å²	46.8	15%	0.149	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	156.2	156.9	81	-86.5	0	0	0	110.8	Y420 E438 F594 V595	Y420-Y436 HydrophobicContact CD2-CE1 4.27Å; Y420-Y436 AromaticContact CD2-CE2 3.98Å; Y420-Y436 HydrophobicContact CD2-CE2 3.98Å; Y420-Y436 AromaticContact CD2-CZ 3.83Å; Y420-Y436 HydrophobicContact CG-CE1 4.25Å; Y420-Y436 PolarHBondContact N-O 2.92Å; Y420-Y436 PolarHBondContact O-N 3Å; Y436-E438 HydrophobicContact CE2-CB 4.35Å; Y436-F594 HydrophobicContact CD1-CD1 4.04Å; Y436-F594 AromaticContact CD1-CE1 3.43Å; Y436-F594 HydrophobicContact CD1-CE1 3.43Å; Y436-F594 VanDerWaalsContact CD1-CE1 3.43Å; Y436-F594 AromaticContact CD1-CZ 3.76Å; Y436-F594 HydrophobicContact CD1-CZ 3.76Å; Y436-F594 HydrophobicContact CE1-CD1 4.01Å; Y436-F594 HydrophobicContact CE1-CD2 4.45Å; Y436-F594 AromaticContact CE1-CE1 3.72Å; Y436-F594 HydrophobicContact CE1-CE1 3.72Å; Y436-F594 HydrophobicContact CE1-CE2 4.22Å; Y436-F594 HydrophobicContact CE1-CG 4.37Å; Y436-F594 AromaticContact CE1-CZ 3.85Å; Y436-F594 HydrophobicContact CE1-CZ 3.85Å; Y436-F594 WeakPolarHBondContact CE1-O 3.27Å; Y436-F594 VanDerWaalsContact CZ-O 3.3Å; Y436-F594 PolarHBondContact OH-O 3.16Å; Y436-V595 HydrophobicContact CD1-CG1 4.06Å; Y436-V595 HydrophobicContact CE1-CG1 4.34Å; Y436-V595 HydrophobicContact CG-CG1 4.29Å
437	F	75.5	Confident	82.9	Confident	114 Å²	114	48.2 Å²	48.2	50%	0.5	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.1	-176.6	-62.6	-83.4	0	0	0	110.5	R417 H419	R417-F437 HydrophobicContact CB-CB 4.26Å; R417-F437 HydrophobicContact CB-CD1 4.19Å; H419-F437 HydrophobicContact CB-CD1 4.22Å; H419-F437 HydrophobicContact CB-CE1 4.08Å; H419-F437 AromaticContact CD2-CE1 3.76Å; H419-F437 AromaticContact CD2-CZ 3.97Å
438	E	75.5	Confident	83	Confident	21 Å²	21	50.8 Å²	50.8	10%	0.098	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.2	169.1	-168.8	166.3	-122.7	0	0	109.9	P412 R417 T418 Y420 Y436 R447 R596	P412-E438 VanDerWaalsContact CD-OE2 3.23Å; P412-E438 WeakPolarHBondContact CD-OE2 3.37Å; P412-E438 HydrophobicContact CG-CB 4.46Å; P412-E438 HydrophobicContact CG-CG 4.19Å; R417-E438 CarbonylContact C-O 3.56Å; R417-E438 WeakPolarHBondContact CA-O 3.14Å; T418-E438 PolarHBondContact N-O 3.41Å; T418-E438 PolarHBondContact O-N 3.05Å; Y420-E438 HydrophobicContact CD2-CB 4.24Å; Y420-E438 HydrophobicContact CE2-CB 3.91Å; Y436-E438 HydrophobicContact CE2-CB 4.35Å; E438-R447 VanDerWaalsContact OE1-CD 3.27Å; E438-R447 WeakPolarHBondContact OE1-CD 3.45Å; E438-R447 IonicContact OE1-NH1 2.7Å; E438-R447 PolarHBondContact OE1-NH1 3.47Å; E438-R596 IonicContact OE1-NH1 3.16Å; E438-R596 PolarHBondContact OE1-NH1 3.13Å; E438-R596 IonicContact OE2-CZ 3.5Å; E438-R596 IonicContact OE2-NH1 3.54Å; E438-R596 PolarHBondContact OE2-NH1 2.88Å
439	Q	74.8	Confident	83.2	Confident	55 Å²	55	50 Å²	50	26%	0.257	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126.5	179.4	-176.6	61.9	50.3	0	0	110.7	W416 W743	W416-Q439 PolarHBondContact O-NE2 3.16Å; Q439-W743 HydrophobicContact CG-CH2 3.63Å; Q439-W743 HydrophobicContact CG-CZ2 4.35Å; Q439-W743 HydrophobicContact CG-CZ3 4.3Å
440	D	82.5	Confident	83.9	Confident	16 Å²	16	47.7 Å²	47.7	9%	0.086	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-66.4	140.3	-179.1	-63.1	-16.1	0	0	0	112.3	P412 G414 F415 W416 T418	P412-D440 WeakPolarHBondContact O-CA 3.41Å; G414-D440 VanDerWaalsContact CA-OD2 3.31Å; G414-D440 WeakPolarHBondContact CA-OD2 3.32Å; G414-D440 VanDerWaalsContact O-CB 3.31Å; G414-D440 WeakPolarHBondContact O-CB 3.29Å; F415-D440 PolarHBondContact N-OD2 3.39Å; W416-D440 WeakPolarHBondContact CA-OD2 3.37Å; W416-D440 PolarHBondContact N-OD2 3.21Å; W416-D440 VanDerWaalsContact O-CB 3.31Å; W416-D440 WeakPolarHBondContact O-CB 3.42Å; W416-D440 PolarHBondContact O-N 3.18Å; T418-D440 PolarHBondContact N-OD1 3.27Å; T418-D440 PolarHBondContact OG1-OD1 2.96Å
441	N	85.5	Confident	84.4	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.091	22%	0.216	C	C	.	.			trans	-99.1	90.9	175	-174.1	-11.7	0	0	0	111.7	P412 Y443 I444 G445 P446 A641	P412-N441 PolarHBondContact O-N 3.38Å; N441-Y443 PolarHBondContact O-N 3.01Å; N441-Y443 VanDerWaalsContact O-N 3.08Å; N441-Y443 WeakPolarHBondContact OD1-CB 3.32Å; N441-Y443 PolarHBondContact OD1-N 2.95Å; N441-I444 PolarHBondContact O-N 2.96Å; N441-I444 VanDerWaalsContact O-N 3.14Å; N441-G445 VanDerWaalsContact ND2-C 3.35Å; N441-G445 WeakPolarHBondContact ND2-CA 3.47Å; N441-P446 PolarHBondContact ND2-O 3.19Å; N441-A641 PolarHBondContact ND2-O 3.13Å
442	F	88.4	Confident	84.7	Confident	50 Å²	50	39.6 Å²	39.6	22%	0.219	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.3	179	79.6	-94.3	0	0	0	114.7	G414 F415 I444 W743	G414-F442 WeakPolarHBondContact O-CA 3.34Å; G414-F442 WeakPolarHBondContact O-CB 3.5Å; G414-F442 PolarHBondContact O-N 3.48Å; G414-F442 VanDerWaalsContact O-N 3.11Å; F415-F442 HydrophobicContact CD1-CB 3.58Å; F415-F442 HydrophobicContact CD1-CD1 4.05Å; F415-F442 HydrophobicContact CD1-CD2 4.33Å; F415-F442 AromaticContact CD1-CG 3.78Å; F415-F442 HydrophobicContact CD1-CG 3.78Å; F415-F442 HydrophobicContact CD2-CB 4.39Å; F415-F442 HydrophobicContact CE1-CB 3.43Å; F415-F442 VanDerWaalsContact CE1-CB 3.43Å; F415-F442 HydrophobicContact CE1-CD1 4.02Å; F415-F442 AromaticContact CE1-CD2 3.52Å; F415-F442 HydrophobicContact CE1-CD2 3.52Å; F415-F442 HydrophobicContact CE1-CE2 4.17Å; F415-F442 AromaticContact CE1-CG 3.41Å; F415-F442 HydrophobicContact CE1-CG 3.41Å; F415-F442 VanDerWaalsContact CE1-CG 3.41Å; F415-F442 HydrophobicContact CE2-CB 4.27Å; F415-F442 HydrophobicContact CG-CB 4.08Å; F415-F442 HydrophobicContact CZ-CB 3.8Å; F415-F442 AromaticContact CZ-CD2 4Å; F415-F442 HydrophobicContact CZ-CD2 4Å; F415-F442 HydrophobicContact CZ-CG 4.11Å; F442-I444 VanDerWaalsContact C-N 3.28Å; F442-I444 PolarHBondContact O-N 3.16Å; F442-W743 HydrophobicContact CE1-CB 4.37Å; F442-W743 AromaticContact CE1-CD1 3.88Å; F442-W743 HydrophobicContact CE1-CG 4.08Å
443	Y	90	Very high	85.3	Confident	50 Å²	50	37.3 Å²	37.3	20%	0.196	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.3	178.8	-68.2	-68.9	0	0	0	114.1	N441 A641 G642 I643 I644 H645	N441-Y443 PolarHBondContact O-N 3.01Å; N441-Y443 VanDerWaalsContact O-N 3.08Å; N441-Y443 WeakPolarHBondContact OD1-CB 3.32Å; N441-Y443 PolarHBondContact OD1-N 2.95Å; Y443-A641 HydrophobicContact CD2-CB 3.43Å; Y443-A641 VanDerWaalsContact CD2-CB 3.43Å; Y443-A641 HydrophobicContact CE2-CB 3.97Å; Y443-A641 HydrophobicContact CG-CB 4.07Å; Y443-G642 CarbonylContact O-C 2.88Å; Y443-G642 WeakPolarHBondContact O-CA 3.46Å; Y443-I643 PolarHBondContact O-N 3.29Å; Y443-I644 HydrophobicContact CD1-CB 4.21Å; Y443-I644 HydrophobicContact CD1-CG2 4.25Å; Y443-I644 PolarHBondContact O-N 2.91Å; Y443-H645 HydrophobicContact CD1-CB 3.63Å; Y443-H645 HydrophobicContact CE1-CB 3.92Å; Y443-H645 HydrophobicContact CG-CB 3.94Å
444	I	92	Very high	85.6	Confident	53 Å²	53	31.2 Å²	31.2	27%	0.272	15%	0.15	S	C	.	.	S	Bend	trans	62.1	80.4	-173.8	-48.8	176	0	0	0	110.1	F410 I413 N441 F442 G642 I643 I644	F410-I444 HydrophobicContact CD1-CG2 3.84Å; F410-I444 HydrophobicContact CE1-CG2 3.79Å; I413-I444 HydrophobicContact CD1-CG1 4.43Å; I413-I444 HydrophobicContact CD1-CG2 3.98Å; I413-I444 HydrophobicContact CG2-CG1 4Å; N441-I444 PolarHBondContact O-N 2.96Å; N441-I444 VanDerWaalsContact O-N 3.14Å; F442-I444 VanDerWaalsContact C-N 3.28Å; F442-I444 PolarHBondContact O-N 3.16Å; I444-G642 CarbonylContact O-C 3.4Å; I444-G642 VanDerWaalsContact O-CA 3.23Å; I444-G642 WeakPolarHBondContact O-CA 3.36Å; I444-I643 HydrophobicContact CG2-CD1 4.18Å; I444-I643 PolarHBondContact O-N 2.96Å; I444-I644 HydrophobicContact CD1-CD1 3.87Å; I444-I644 HydrophobicContact CD1-CG1 4.32Å; I444-I644 HydrophobicContact CG1-CD1 4.01Å; I444-I644 HydrophobicContact CG1-CG1 4.5Å
445	G	92.3	Very high	86.1	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.146	C	C	.	.			trans	-156.5	-171.2	-174.9	0	0	0	0	0	113.5	F410 G411 N441	F410-G445 WeakPolarHBondContact CA-O 3.41Å; G411-G445 PolarHBondContact N-O 2.93Å; N441-G445 VanDerWaalsContact ND2-C 3.35Å; N441-G445 WeakPolarHBondContact ND2-CA 3.47Å
446	P	91.7	Very high	86.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-60.7	172.6	173.9	-22.4	35.1	0	0	0	113.1	A404 L405 N441 D450 L451	A404-P446 HydrophobicContact CB-CG 4.21Å; L405-P446 HydrophobicContact CD2-CG 4.42Å; N441-P446 PolarHBondContact ND2-O 3.19Å; P446-D450 HydrophobicContact CB-CB 3.8Å; P446-L451 HydrophobicContact CB-CD2 4.5Å; P446-L451 HydrophobicContact CG-CD2 4.44Å
447	R	87.7	Confident	87.3	Confident	41 Å²	41	27.3 Å²	27.3	16%	0.155	13%	0.128	C	C	.	.			trans	-71.6	160.9	177.1	-46.7	167.8	-47.7	132.4	-9.2	109.9	E438 A449 D450 L451	E438-R447 VanDerWaalsContact OE1-CD 3.27Å; E438-R447 WeakPolarHBondContact OE1-CD 3.45Å; E438-R447 IonicContact OE1-NH1 2.7Å; E438-R447 PolarHBondContact OE1-NH1 3.47Å; R447-A449 VanDerWaalsContact C-N 3.31Å; R447-A449 PolarHBondContact O-N 2.97Å; R447-D450 WeakPolarHBondContact CA-OD2 3.46Å; R447-D450 WeakPolarHBondContact CB-OD2 3.4Å; R447-D450 WeakPolarHBondContact CG-OD2 3.29Å; R447-D450 IonicContact CZ-OD1 3.58Å; R447-D450 VanDerWaalsContact CZ-OD1 3.25Å; R447-D450 IonicContact CZ-OD2 2.7Å; R447-D450 PolarHBondContact N-OD2 3.06Å; R447-D450 VanDerWaalsContact NE-CG 3.34Å; R447-D450 IonicContact NE-OD1 3.87Å; R447-D450 PolarHBondContact NE-OD1 3.41Å; R447-D450 IonicContact NE-OD2 3.58Å; R447-D450 PolarHBondContact NE-OD2 3.19Å; R447-D450 IonicContact NH2-OD1 3.89Å; R447-D450 PolarHBondContact NH2-OD1 3.41Å; R447-D450 WeakPolarHBondContact O-CB 3.48Å; R447-D450 PolarHBondContact O-N 3.22Å; R447-D450 VanDerWaalsContact O-N 3.12Å; R447-L451 PolarHBondContact O-N 3.23Å; R447-L451 VanDerWaalsContact O-N 3.11Å
448	Y	85.2	Confident	88.1	Confident	71 Å²	71	22 Å²	22	28%	0.278	10%	0.104	S	C	.	.	H	α-helix	trans	-62.4	-38.1	-178	-165.9	-109.9	0	0	0	112.6	L451 V452 I580 A692	Y448-L451 PolarHBondContact O-N 2.93Å; Y448-V452 PolarHBondContact O-N 2.97Å; Y448-I580 HydrophobicContact CD1-CD1 4.32Å; Y448-I580 HydrophobicContact CD1-CG2 4.4Å; Y448-I580 HydrophobicContact CE1-CD1 3.96Å; Y448-A692 HydrophobicContact CE1-CB 3.92Å; Y448-A692 HydrophobicContact CE2-CB 4.1Å; Y448-A692 WeakPolarHBondContact OH-CB 3.44Å; Y448-A692 PolarHBondContact OH-N 3.22Å; Y448-A692 PolarHBondContact OH-O 2.89Å
449	A	84.7	Confident	88.8	Confident	33 Å²	33	21 Å²	21	27%	0.273	10%	0.1	S	C	.	.	H	α-helix	trans	-62.8	-42.3	172.6	0	0	0	0	0	112.4	R447 L451 V452 H453 I580	R447-A449 VanDerWaalsContact C-N 3.31Å; R447-A449 PolarHBondContact O-N 2.97Å; A449-L451 VanDerWaalsContact C-N 3.26Å; A449-L451 PolarHBondContact O-N 2.69Å; A449-V452 WeakPolarHBondContact O-CA 3.41Å; A449-V452 WeakPolarHBondContact O-CB 3.32Å; A449-V452 PolarHBondContact O-N 2.82Å; A449-H453 PolarHBondContact O-N 3.46Å; A449-I580 HydrophobicContact CB-CG2 4.15Å
450	D	90.4	Very high	89.4	Confident	5 Å²	5	18.5 Å²	18.5	3%	0.027	9%	0.088	C	C	.	.	H	α-helix	trans	-61.1	-36.5	177.2	-52.1	-32.5	0	0	0	111.5	Y408 P446 R447 H453 L454	Y408-D450 HydrophobicContact CD1-CB 3.67Å; Y408-D450 HydrophobicContact CE1-CB 4.39Å; Y408-D450 HydrophobicContact CG-CB 3.85Å; P446-D450 HydrophobicContact CB-CB 3.8Å; R447-D450 WeakPolarHBondContact CA-OD2 3.46Å; R447-D450 WeakPolarHBondContact CB-OD2 3.4Å; R447-D450 WeakPolarHBondContact CG-OD2 3.29Å; R447-D450 IonicContact CZ-OD1 3.58Å; R447-D450 VanDerWaalsContact CZ-OD1 3.25Å; R447-D450 IonicContact CZ-OD2 2.7Å; R447-D450 PolarHBondContact N-OD2 3.06Å; R447-D450 VanDerWaalsContact NE-CG 3.34Å; R447-D450 IonicContact NE-OD1 3.87Å; R447-D450 PolarHBondContact NE-OD1 3.41Å; R447-D450 IonicContact NE-OD2 3.58Å; R447-D450 PolarHBondContact NE-OD2 3.19Å; R447-D450 IonicContact NH2-OD1 3.89Å; R447-D450 PolarHBondContact NH2-OD1 3.41Å; R447-D450 WeakPolarHBondContact O-CB 3.48Å; R447-D450 PolarHBondContact O-N 3.22Å; R447-D450 VanDerWaalsContact O-N 3.12Å; D450-H453 PolarHBondContact O-N 3.31Å; D450-L454 VanDerWaalsContact O-CB 3.22Å; D450-L454 WeakPolarHBondContact O-CB 3.2Å; D450-L454 WeakPolarHBondContact O-CD1 3.27Å; D450-L454 VanDerWaalsContact O-CG 3.26Å; D450-L454 WeakPolarHBondContact O-CG 3.35Å; D450-L454 PolarHBondContact O-N 2.97Å
451	L	90.8	Very high	89.8	Confident	11 Å²	11	17.7 Å²	17.7	6%	0.058	8%	0.084	C	C	.	.	H	α-helix	trans	-66.4	-36.8	174.8	-66	173.1	0	0	0	112	P446 R447 Y448 A449 L454 G455 A456 A641 V694	P446-L451 HydrophobicContact CB-CD2 4.5Å; P446-L451 HydrophobicContact CG-CD2 4.44Å; R447-L451 PolarHBondContact O-N 3.23Å; R447-L451 VanDerWaalsContact O-N 3.11Å; Y448-L451 PolarHBondContact O-N 2.93Å; A449-L451 VanDerWaalsContact C-N 3.26Å; A449-L451 PolarHBondContact O-N 2.69Å; L451-L454 HydrophobicContact CD2-CD1 4.49Å; L451-G455 PolarHBondContact O-N 2.76Å; L451-A456 WeakPolarHBondContact O-CB 3.39Å; L451-A456 PolarHBondContact O-N 3Å; L451-A641 HydrophobicContact CD1-CB 4.43Å; L451-V694 HydrophobicContact CD1-CG2 4.41Å
452	V	90.4	Very high	90	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.7	-48.6	171.3	177.8	0	0	0	0	110.2	Y448 A449 L454 G455 Y458 I580 V615 R632 A692	Y448-V452 PolarHBondContact O-N 2.97Å; A449-V452 WeakPolarHBondContact O-CA 3.41Å; A449-V452 WeakPolarHBondContact O-CB 3.32Å; A449-V452 PolarHBondContact O-N 2.82Å; V452-L454 VanDerWaalsContact C-N 3.31Å; V452-L454 PolarHBondContact O-N 3.4Å; V452-G455 PolarHBondContact O-N 3.41Å; V452-G455 VanDerWaalsContact O-N 3.08Å; V452-Y458 HydrophobicContact CG1-CD1 3.78Å; V452-Y458 HydrophobicContact CG1-CE1 4.32Å; V452-Y458 HydrophobicContact CG1-CG 4.32Å; V452-I580 HydrophobicContact CG2-CG2 4.35Å; V452-V615 HydrophobicContact CG1-CG1 4.13Å; V452-R632 VanDerWaalsContact O-CZ 3.25Å; V452-R632 PolarHBondContact O-NH1 2.87Å; V452-R632 PolarHBondContact O-NH2 2.74Å; V452-A692 HydrophobicContact CG2-CB 3.58Å
453	H	90.9	Very high	90	Very high	30 Å²	30	15.5 Å²	15.5	14%	0.139	7%	0.073	C	C	.	.	H	α-helix	trans	-60.6	-39.5	178.2	-170.3	105.5	0	0	0	111.9	Y408 A449 D450 G455 Y598 E614 V615 M618	Y408-H453 PolarHBondContact OH-CD2 3.01Å; A449-H453 PolarHBondContact O-N 3.46Å; D450-H453 PolarHBondContact O-N 3.31Å; H453-G455 PolarHBondContact O-N 2.85Å; H453-Y598 PolarHBondContact ND1-OH 3.24Å; H453-Y598 VanDerWaalsContact ND1-OH 3.11Å; H453-E614 PolarHBondContact CE1-O 2.89Å; H453-E614 VanDerWaalsContact CE1-O 3.28Å; H453-E614 PolarHBondContact ND1-O 3.25Å; H453-V615 WeakPolarHBondContact CA-O 3.42Å; H453-V615 PolarHBondContact N-O 3.06Å; H453-M618 WeakPolarHBondContact O-CB 3.49Å; H453-M618 PolarHBondContact O-N 3.4Å
454	L	90.1	Very high	89.7	Confident	7 Å²	7	18.4 Å²	18.4	4%	0.037	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.6	175.2	-83.5	166.9	0	0	0	115.5	F166 A404 Y408 D450 L451 V452 L639	F166-L454 HydrophobicContact CZ-CD2 3.9Å; A404-L454 HydrophobicContact CB-CD1 3.7Å; Y408-L454 HydrophobicContact CD2-CD1 3.85Å; Y408-L454 HydrophobicContact CD2-CD2 4.14Å; Y408-L454 HydrophobicContact CD2-CG 4.01Å; Y408-L454 HydrophobicContact CE2-CD1 4.03Å; Y408-L454 HydrophobicContact CE2-CD2 3.56Å; Y408-L454 HydrophobicContact CE2-CG 3.64Å; D450-L454 VanDerWaalsContact O-CB 3.22Å; D450-L454 WeakPolarHBondContact O-CB 3.2Å; D450-L454 WeakPolarHBondContact O-CD1 3.27Å; D450-L454 VanDerWaalsContact O-CG 3.26Å; D450-L454 WeakPolarHBondContact O-CG 3.35Å; D450-L454 PolarHBondContact O-N 2.97Å; L451-L454 HydrophobicContact CD2-CD1 4.49Å; V452-L454 VanDerWaalsContact C-N 3.31Å; V452-L454 PolarHBondContact O-N 3.4Å; L454-L639 HydrophobicContact CB-CD1 4.32Å; L454-L639 HydrophobicContact CB-CD2 4.09Å
455	G	90.6	Very high	89.2	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.6	26	177.1	0	0	0	0	0	116.9	L451 V452 H453 M618 P636	L451-G455 PolarHBondContact O-N 2.76Å; V452-G455 PolarHBondContact O-N 3.41Å; V452-G455 VanDerWaalsContact O-N 3.08Å; H453-G455 PolarHBondContact O-N 2.85Å; G455-M618 VanDerWaalsContact CA-SD 3.53Å; G455-P636 WeakPolarHBondContact O-CD 3.41Å; G455-P636 WeakPolarHBondContact O-CG 3.07Å
456	A	92.4	Very high	88.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.104	C	C	.	.			trans	-54.6	157.9	170.2	0	0	0	0	0	113.5	L451 Y458 R632 A692 E693 V694	L451-A456 WeakPolarHBondContact O-CB 3.39Å; L451-A456 PolarHBondContact O-N 3Å; A456-Y458 PolarHBondContact O-N 3Å; A456-R632 WeakPolarHBondContact O-CD 3.25Å; A456-R632 PolarHBondContact O-NH1 3.29Å; A456-A692 HydrophobicContact CB-CB 4.24Å; A456-E693 WeakPolarHBondContact CA-O 3.49Å; A456-E693 WeakPolarHBondContact CB-O 3.32Å; A456-V694 HydrophobicContact CB-CG1 3.63Å
457	K	93	Very high	87.6	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-67	106.5	172.1	178.2	-81.5	-55.5	-176	0	107.6	P636 N681 S684 A685 V688 Q691 A692 E693	K457-P636 HydrophobicContact CB-CG 4Å; K457-N681 HydrophobicContact CG-CB 4.34Å; K457-S684 WeakPolarHBondContact CE-OG 3.23Å; K457-S684 PolarHBondContact NZ-OG 3.45Å; K457-A685 HydrophobicContact CD-CB 4.07Å; K457-A685 HydrophobicContact CG-CB 4.47Å; K457-V688 PolarHBondContact NZ-O 2.91Å; K457-Q691 WeakPolarHBondContact CE-O 3.29Å; K457-Q691 PolarHBondContact NZ-O 2.95Å; K457-A692 VanDerWaalsContact O-CA 3.28Å; K457-A692 WeakPolarHBondContact O-CA 3.18Å; K457-E693 HydrophobicContact CB-CB 4.24Å; K457-E693 WeakPolarHBondContact CE-OE1 3.27Å; K457-E693 WeakPolarHBondContact CE-OE2 3.44Å; K457-E693 PolarHBondContact N-O 3.16Å; K457-E693 VanDerWaalsContact NZ-CD 3.3Å; K457-E693 IonicContact NZ-OE1 2.69Å; K457-E693 PolarHBondContact NZ-OE1 3.13Å; K457-E693 IonicContact NZ-OE2 2.73Å; K457-E693 PolarHBondContact O-N 3.16Å; K457-E693 VanDerWaalsContact O-N 3.14Å
458	Y	91.1	Very high	87	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.008	12%	0.121	C	C	.	.			trans	-145.4	121	177.6	-175.2	-125.8	0	0	0	107.6	V452 A456 P460 C461 I580 Y690 A692	V452-Y458 HydrophobicContact CG1-CD1 3.78Å; V452-Y458 HydrophobicContact CG1-CE1 4.32Å; V452-Y458 HydrophobicContact CG1-CG 4.32Å; A456-Y458 PolarHBondContact O-N 3Å; Y458-P460 HydrophobicContact CD1-CB 4.37Å; Y458-P460 HydrophobicContact CD1-CG 4.36Å; Y458-P460 HydrophobicContact CE1-CB 3.97Å; Y458-P460 HydrophobicContact CE1-CG 3.9Å; Y458-P460 HydrophobicContact CE2-CG 4.19Å; Y458-C461 PolarHBondContact O-N 2.92Å; Y458-I580 WeakPolarHBondContact CE1-O 3.18Å; Y458-I580 HydrophobicContact CE2-CD1 4.49Å; Y458-I580 VanDerWaalsContact CZ-O 3.3Å; Y458-I580 PolarHBondContact OH-O 3.42Å; Y458-Y690 VanDerWaalsContact CE2-O 3.31Å; Y458-Y690 WeakPolarHBondContact CE2-O 3.22Å; Y458-A692 HydrophobicContact CD2-CB 4.48Å
459	A	90	Very high	86.8	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-69.6	-35.4	-167.6	0	0	0	0	0	114.9	C461 M462 R463 P689 F799	A459-C461 PolarHBondContact O-N 2.87Å; A459-M462 PolarHBondContact O-N 3.03Å; A459-R463 PolarHBondContact O-N 2.97Å; A459-P689 HydrophobicContact CB-CB 3.53Å; A459-P689 WeakPolarHBondContact CB-O 3.3Å; A459-P689 PolarHBondContact N-O 3.47Å; A459-F799 HydrophobicContact CB-CE2 4.15Å
460	P	88	Confident	86.5	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.013	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-58.3	-30	176.1	-29	37.9	0	0	0	114.4	Y458 M462 V468 L612 P627 Y690	Y458-P460 HydrophobicContact CD1-CB 4.37Å; Y458-P460 HydrophobicContact CD1-CG 4.36Å; Y458-P460 HydrophobicContact CE1-CB 3.97Å; Y458-P460 HydrophobicContact CE1-CG 3.9Å; Y458-P460 HydrophobicContact CE2-CG 4.19Å; P460-M462 PolarHBondContact O-N 3.39Å; P460-V468 HydrophobicContact CB-CG2 4.49Å; P460-V468 HydrophobicContact CG-CG2 4.4Å; P460-L612 HydrophobicContact CB-CD1 4.22Å; P460-P627 WeakPolarHBondContact O-CB 3.38Å; P460-P627 WeakPolarHBondContact O-CG 3.3Å; P460-Y690 HydrophobicContact CG-CD1 4.12Å; P460-Y690 HydrophobicContact CG-CE1 4.21Å
461	C	90.7	Very high	85.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-75	-6.1	173.4	-59.5	0	0	0	0	114.2	Y458 A459 C616 Q629 R632	Y458-C461 PolarHBondContact O-N 2.92Å; A459-C461 PolarHBondContact O-N 2.87Å; C461-C616 VanDerWaalsContact CA-SG 3.51Å; C461-C616 HydrophobicContact CB-CB 3.86Å; C461-C616 WeakPolarHBondContact CB-SG 3.3Å; C461-C616 WeakPolarHBondContact SG-CB 3.42Å; C461-C616 CovalentContact SG-SG 2.03Å; C461-C616 PolarHBondContact SG-SG 3.17Å; C461-Q629 WeakPolarHBondContact O-CB 3.49Å; C461-Q629 PolarHBondContact O-N 3.18Å; C461-Q629 VanDerWaalsContact O-N 3.07Å; C461-R632 VanDerWaalsContact CB-CD 3.49Å
462	M	90.1	Very high	85.3	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-16.6	-175.3	-66.9	-170.1	-68.6	0	0	114.2	A459 P460 P627 F630 R632 L633 A685 F799	A459-M462 PolarHBondContact O-N 3.03Å; P460-M462 PolarHBondContact O-N 3.39Å; M462-P627 CarbonylContact C-O 3.59Å; M462-F630 HydrophobicContact CB-CD1 4.41Å; M462-F630 HydrophobicContact CB-CE1 4.37Å; M462-F630 WeakPolarHBondContact O-CE1 3.45Å; M462-F630 VanDerWaalsContact O-CZ 3.23Å; M462-F630 WeakPolarHBondContact O-CZ 3.34Å; M462-R632 HydrophobicContact CG-CB 4Å; M462-R632 HydrophobicContact SD-CB 3.71Å; M462-L633 HydrophobicContact CE-CD2 4.04Å; M462-L633 HydrophobicContact SD-CD2 3.79Å; M462-L633 HydrophobicContact SD-CG 3.89Å; M462-A685 HydrophobicContact CE-CB 3.79Å; M462-F799 HydrophobicContact CB-CE1 4.21Å; M462-F799 HydrophobicContact CB-CZ 3.81Å; M462-F799 HydrophobicContact CE-CE2 4.4Å; M462-F799 HydrophobicContact CE-CZ 4.14Å
463	R	87.7	Confident	85	Confident	19 Å²	19	34.1 Å²	34.1	7%	0.072	17%	0.174	C	C	.	.	S	Bend	trans	-157.6	155.6	174.9	61.8	169.3	-175.8	65	11.5	110.1	A459 D465 P627 F799	A459-R463 PolarHBondContact O-N 2.97Å; R463-D465 IonicContact CZ-OD2 3.23Å; R463-D465 IonicContact NH1-OD2 3.68Å; R463-D465 PolarHBondContact NH1-OD2 3.33Å; R463-D465 IonicContact NH2-OD2 3.56Å; R463-D465 PolarHBondContact NH2-OD2 2.8Å; R463-D465 PolarHBondContact O-N 3.42Å; R463-P627 VanDerWaalsContact C-CG 3.49Å; R463-P627 WeakPolarHBondContact O-CG 3.48Å; R463-F799 HydrophobicContact CB-CE1 3.95Å; R463-F799 HydrophobicContact CB-CZ 4.18Å; R463-F799 WeakPolarHBondContact CD-O 3.32Å; R463-F799 HydrophobicContact CG-CE1 3.84Å; R463-F799 HydrophobicContact CG-CE2 4.31Å; R463-F799 HydrophobicContact CG-CZ 3.62Å; R463-F799 PolarHBondContact NE-O 3.03Å
464	R	84.2	Confident	84.6	Confident	111 Å²	111	36.4 Å²	36.4	42%	0.419	19%	0.185	S	C	.	.			trans	-56.7	141.1	167.3	-72.5	-162.6	166.9	-176	-4.6	109.7	Y469 E625 N626	R464-Y469 HydrophobicContact CB-CD2 4.36Å; R464-Y469 HydrophobicContact CB-CE2 4.04Å; R464-Y469 HydrophobicContact CG-CE1 4.08Å; R464-Y469 HydrophobicContact CG-CE2 3.95Å; R464-E625 VanDerWaalsContact CZ-O 3.31Å; R464-E625 IonicContact CZ-OE2 3.7Å; R464-E625 PolarHBondContact NE-O 2.95Å; R464-E625 PolarHBondContact NH2-O 2.73Å; R464-E625 IonicContact NH2-OE2 2.68Å; R464-E625 PolarHBondContact NH2-OE2 2.83Å; R464-N626 PolarHBondContact NE-OD1 3.31Å; R464-N626 PolarHBondContact NH2-ND2 2.91Å
465	D	81.1	Confident	84.4	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.197	C	C	.	.			trans	-131.4	108.4	-173.4	-163.3	-80.8	0	0	0	109.8	R463 N467 V468 Y469 Y690 W805	R463-D465 IonicContact CZ-OD2 3.23Å; R463-D465 IonicContact NH1-OD2 3.68Å; R463-D465 PolarHBondContact NH1-OD2 3.33Å; R463-D465 IonicContact NH2-OD2 3.56Å; R463-D465 PolarHBondContact NH2-OD2 2.8Å; R463-D465 PolarHBondContact O-N 3.42Å; D465-N467 PolarHBondContact O-N 2.78Å; D465-V468 HydrophobicContact CB-CB 4.48Å; D465-V468 HydrophobicContact CB-CG2 4.31Å; D465-V468 PolarHBondContact O-N 2.89Å; D465-V468 VanDerWaalsContact O-N 3.09Å; D465-Y469 VanDerWaalsContact O-CD2 3.29Å; D465-Y469 WeakPolarHBondContact O-CD2 3.33Å; D465-Y469 PolarHBondContact O-N 2.61Å; D465-Y690 PolarHBondContact OD1-OH 2.85Å; D465-W805 VanDerWaalsContact CG-CZ2 3.5Å; D465-W805 WeakPolarHBondContact OD1-CH2 3.28Å; D465-W805 WeakPolarHBondContact OD1-CZ2 3.43Å; D465-W805 WeakPolarHBondContact OD2-CZ2 3.31Å
466	L	76.6	Confident	84.3	Confident	133 Å²	133	41.6 Å²	41.6	70%	0.696	21%	0.208	S	C	*	.	H	α-helix	trans	-49.1	-33.2	-173.4	-56.2	171	0	0	0	114.8	S470 W805	L466-S470 VanDerWaalsContact O-CB 3.25Å; L466-S470 WeakPolarHBondContact O-CB 3.49Å; L466-S470 PolarHBondContact O-N 3.06Å; L466-S470 PolarHBondContact O-OG 3.41Å; L466-S470 VanDerWaalsContact O-OG 3.05Å; L466-W805 HydrophobicContact CB-CH2 3.56Å; L466-W805 HydrophobicContact CB-CZ3 3.75Å; L466-W805 HydrophobicContact CD1-CH2 4.5Å; L466-W805 HydrophobicContact CD1-CZ3 4.46Å; L466-W805 HydrophobicContact CG-CH2 4.15Å; L466-W805 HydrophobicContact CG-CZ3 4.48Å; L466-W805 VanDerWaalsContact N-CH2 3.27Å
467	N	74.2	Confident	84	Confident	84 Å²	84	47.5 Å²	47.5	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-71.2	-48.9	178.8	-74.2	-12.2	0	0	0	111.2	D465 Y469 S470 V471 Y690 W805	D465-N467 PolarHBondContact O-N 2.78Å; N467-Y469 VanDerWaalsContact C-N 3.3Å; N467-Y469 PolarHBondContact O-N 2.81Å; N467-S470 PolarHBondContact O-N 2.98Å; N467-S470 PolarHBondContact O-OG 3.02Å; N467-V471 PolarHBondContact O-N 3.33Å; N467-Y690 PolarHBondContact ND2-OH 2.93Å; N467-W805 HydrophobicContact CB-CH2 4.36Å; N467-W805 HydrophobicContact CB-CZ3 4.25Å; N467-W805 VanDerWaalsContact CG-CZ3 3.49Å; N467-W805 VanDerWaalsContact OD1-CZ3 3.31Å; N467-W805 WeakPolarHBondContact OD1-CZ3 3.32Å
468	V	75	Confident	83.7	Confident	12 Å²	12	52.2 Å²	52.2	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-42.8	175.9	-178.7	0	0	0	0	109.8	P460 D465 V471 V472	P460-V468 HydrophobicContact CB-CG2 4.49Å; P460-V468 HydrophobicContact CG-CG2 4.4Å; D465-V468 HydrophobicContact CB-CB 4.48Å; D465-V468 HydrophobicContact CB-CG2 4.31Å; D465-V468 PolarHBondContact O-N 2.89Å; D465-V468 VanDerWaalsContact O-N 3.09Å; V468-V471 PolarHBondContact O-N 2.89Å; V468-V472 WeakPolarHBondContact O-CG2 3.34Å; V468-V472 PolarHBondContact O-N 3.31Å
469	Y	81.1	Confident	83.6	Confident	53 Å²	53	52.8 Å²	52.8	21%	0.208	26%	0.255	C	S	.	.	H	α-helix	trans	-74.1	-24.8	-179.5	-79.8	-103.5	0	0	0	113.5	R464 D465 N467 E473 L612 E625 P627	R464-Y469 HydrophobicContact CB-CD2 4.36Å; R464-Y469 HydrophobicContact CB-CE2 4.04Å; R464-Y469 HydrophobicContact CG-CE1 4.08Å; R464-Y469 HydrophobicContact CG-CE2 3.95Å; D465-Y469 VanDerWaalsContact O-CD2 3.29Å; D465-Y469 WeakPolarHBondContact O-CD2 3.33Å; D465-Y469 PolarHBondContact O-N 2.61Å; N467-Y469 VanDerWaalsContact C-N 3.3Å; N467-Y469 PolarHBondContact O-N 2.81Å; Y469-E473 VanDerWaalsContact O-CB 3.26Å; Y469-E473 WeakPolarHBondContact O-CB 3.39Å; Y469-E473 PolarHBondContact O-N 3.46Å; Y469-L612 HydrophobicContact CE2-CD2 4.41Å; Y469-E625 PolarHBondContact OH-O 3Å; Y469-P627 WeakPolarHBondContact OH-CD 3.43Å
470	S	77.3	Confident	83.6	Confident	67 Å²	67	55.4 Å²	55.4	47%	0.469	27%	0.269	S	S	.	.	H	α-helix	trans	-72	-36.9	171.5	57.6	0	0	0	0	112	L466 N467 E473 E474	L466-S470 VanDerWaalsContact O-CB 3.25Å; L466-S470 WeakPolarHBondContact O-CB 3.49Å; L466-S470 PolarHBondContact O-N 3.06Å; L466-S470 PolarHBondContact O-OG 3.41Å; L466-S470 VanDerWaalsContact O-OG 3.05Å; N467-S470 PolarHBondContact O-N 2.98Å; N467-S470 PolarHBondContact O-OG 3.02Å; S470-E473 PolarHBondContact O-N 2.86Å; S470-E474 PolarHBondContact O-N 3.04Å
471	V	75.4	Confident	83.5	Confident	57 Å²	57	59.9 Å²	59.9	35%	0.345	29%	0.29	S	S	.	.	H	α-helix	trans	-67	-46.8	172.3	177	0	0	0	0	110.2	N467 V468 E473 E474 N475	N467-V471 PolarHBondContact O-N 3.33Å; V468-V471 PolarHBondContact O-N 2.89Å; V471-E473 VanDerWaalsContact C-N 3.27Å; V471-E473 PolarHBondContact O-N 2.99Å; V471-E474 PolarHBondContact O-N 2.73Å; V471-E474 VanDerWaalsContact O-N 3.11Å; V471-N475 PolarHBondContact O-N 2.92Å; V471-N475 PolarHBondContact O-OD1 3.23Å
472	V	81.7	Confident	83.5	Confident	53 Å²	53	60.2 Å²	60.2	32%	0.321	29%	0.292	S	S	.	.	H	α-helix	trans	-59	-37.4	175.8	170.4	0	0	0	0	112.4	V468 R476	V468-V472 WeakPolarHBondContact O-CG2 3.34Å; V468-V472 PolarHBondContact O-N 3.31Å; V472-R476 WeakPolarHBondContact O-CB 3.4Å; V472-R476 VanDerWaalsContact O-CG 3.26Å; V472-R476 WeakPolarHBondContact O-CG 3.21Å; V472-R476 PolarHBondContact O-N 3.32Å
473	E	83.8	Confident	83.6	Confident	85 Å²	85	60.1 Å²	60.1	40%	0.397	29%	0.292	S	S	.	.	H	α-helix	trans	-71.4	-33.7	176.2	-172.4	66.3	-172.8	0	0	112.7	Y469 S470 V471 R476 R477	Y469-E473 VanDerWaalsContact O-CB 3.26Å; Y469-E473 WeakPolarHBondContact O-CB 3.39Å; Y469-E473 PolarHBondContact O-N 3.46Å; S470-E473 PolarHBondContact O-N 2.86Å; V471-E473 VanDerWaalsContact C-N 3.27Å; V471-E473 PolarHBondContact O-N 2.99Å; E473-R476 WeakPolarHBondContact O-CB 3.35Å; E473-R476 PolarHBondContact O-N 2.82Å; E473-R477 WeakPolarHBondContact O-CG 3.25Å; E473-R477 PolarHBondContact O-N 3.26Å; E473-R477 VanDerWaalsContact O-N 3.1Å
474	E	83.4	Confident	83.9	Confident	77 Å²	77	59.2 Å²	59.2	36%	0.36	29%	0.288	S	S	.	.	H	α-helix	trans	-71.8	-44.3	174.3	-160.6	57.8	-130.9	0	0	111.6	S470 V471 R476 R477 Q478	S470-E474 PolarHBondContact O-N 3.04Å; V471-E474 PolarHBondContact O-N 2.73Å; V471-E474 VanDerWaalsContact O-N 3.11Å; E474-R476 PolarHBondContact O-N 3.07Å; E474-R477 WeakPolarHBondContact O-CA 3.36Å; E474-R477 WeakPolarHBondContact O-CB 3.46Å; E474-R477 PolarHBondContact O-N 2.91Å; E474-R477 WeakPolarHBondContact OE2-CD 3.27Å; E474-R477 IonicContact OE2-CZ 3.5Å; E474-R477 IonicContact OE2-NE 2.74Å; E474-R477 IonicContact OE2-NH1 3.53Å; E474-R477 PolarHBondContact OE2-NH1 2.9Å; E474-Q478 PolarHBondContact O-N 3.39Å
475	N	84.8	Confident	84.3	Confident	55 Å²	55	54 Å²	54	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-58.5	-35	172.4	-67.4	32.4	0	0	0	111.2	V471 Q478 E479	V471-N475 PolarHBondContact O-N 2.92Å; V471-N475 PolarHBondContact O-OD1 3.23Å; N475-Q478 PolarHBondContact O-N 2.98Å; N475-E479 VanDerWaalsContact O-CB 3.3Å; N475-E479 WeakPolarHBondContact O-CB 3.43Å; N475-E479 PolarHBondContact O-N 3.19Å
476	R	88.2	Confident	84.8	Confident	62 Å²	62	55.3 Å²	55.3	23%	0.234	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-37.7	171.4	-82.9	172	170.9	-174.3	-5.6	112.9	V472 E473 E474 E479 N480 T550 E625	V472-R476 WeakPolarHBondContact O-CB 3.4Å; V472-R476 VanDerWaalsContact O-CG 3.26Å; V472-R476 WeakPolarHBondContact O-CG 3.21Å; V472-R476 PolarHBondContact O-N 3.32Å; E473-R476 WeakPolarHBondContact O-CB 3.35Å; E473-R476 PolarHBondContact O-N 2.82Å; E474-R476 PolarHBondContact O-N 3.07Å; R476-E479 PolarHBondContact O-N 3.07Å; R476-N480 WeakPolarHBondContact O-CB 3.31Å; R476-N480 PolarHBondContact O-N 3.39Å; R476-T550 HydrophobicContact CB-CG2 3.89Å; R476-T550 HydrophobicContact CG-CG2 4.14Å; R476-T550 WeakPolarHBondContact O-CG2 3.43Å; R476-E625 IonicContact CZ-OE1 3.62Å; R476-E625 IonicContact NH1-OE1 2.75Å; R476-E625 PolarHBondContact NH1-OE1 2.97Å; R476-E625 IonicContact NH2-OE1 3.5Å; R476-E625 PolarHBondContact NH2-OE1 3.39Å
477	R	87.2	Confident	85.5	Confident	123 Å²	123	49.7 Å²	49.7	46%	0.464	25%	0.245	S	C	.	.	H	α-helix	trans	-66.6	-43.4	174.4	-68.5	164.2	-168.3	168.4	1.5	111.7	E473 E474 N480 Q481	E473-R477 WeakPolarHBondContact O-CG 3.25Å; E473-R477 PolarHBondContact O-N 3.26Å; E473-R477 VanDerWaalsContact O-N 3.1Å; E474-R477 WeakPolarHBondContact O-CA 3.36Å; E474-R477 WeakPolarHBondContact O-CB 3.46Å; E474-R477 PolarHBondContact O-N 2.91Å; E474-R477 WeakPolarHBondContact OE2-CD 3.27Å; E474-R477 IonicContact OE2-CZ 3.5Å; E474-R477 IonicContact OE2-NE 2.74Å; E474-R477 IonicContact OE2-NH1 3.53Å; E474-R477 PolarHBondContact OE2-NH1 2.9Å; R477-N480 PolarHBondContact O-N 3.24Å; R477-Q481 WeakPolarHBondContact O-CG 3.29Å; R477-Q481 PolarHBondContact O-N 3.38Å; R477-Q481 VanDerWaalsContact O-N 3.15Å
478	Q	86.4	Confident	86.2	Confident	99 Å²	99	51.5 Å²	51.5	46%	0.463	25%	0.251	S	S	.	.	H	α-helix	trans	-62.8	-42.7	174.5	-67.1	174.5	-6.9	0	0	111	E474 N475 Q481 S482	E474-Q478 PolarHBondContact O-N 3.39Å; N475-Q478 PolarHBondContact O-N 2.98Å; Q478-Q481 CarbonylContact O-C 3.51Å; Q478-Q481 WeakPolarHBondContact O-CA 3.49Å; Q478-Q481 WeakPolarHBondContact O-CB 3.29Å; Q478-Q481 PolarHBondContact O-N 2.83Å; Q478-S482 PolarHBondContact O-N 2.84Å
479	E	89.7	Confident	86.7	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.07	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-42.1	176.2	-176.6	169.9	87.4	0	0	112.6	N475 R476 Q481 S482 L605 C606 S607	N475-E479 VanDerWaalsContact O-CB 3.3Å; N475-E479 WeakPolarHBondContact O-CB 3.43Å; N475-E479 PolarHBondContact O-N 3.19Å; R476-E479 PolarHBondContact O-N 3.07Å; E479-Q481 PolarHBondContact O-N 3.49Å; E479-S482 VanDerWaalsContact O-CB 3.31Å; E479-S482 WeakPolarHBondContact O-CB 3.27Å; E479-S482 PolarHBondContact O-N 3.32Å; E479-S482 PolarHBondContact O-OG 3.03Å; E479-L605 HydrophobicContact CG-CD2 4.03Å; E479-C606 WeakPolarHBondContact OE2-CA 3.28Å; E479-C606 WeakPolarHBondContact OE2-CB 3.44Å; E479-C606 PolarHBondContact OE2-N 3.01Å; E479-S607 WeakPolarHBondContact OE1-CB 3.49Å; E479-S607 PolarHBondContact OE1-N 3.43Å; E479-S607 VanDerWaalsContact OE1-N 3.09Å; E479-S607 PolarHBondContact OE1-OG 3.46Å; E479-S607 PolarHBondContact OE2-N 3.07Å
480	N	88.8	Confident	86.8	Confident	54 Å²	54	63 Å²	63	29%	0.289	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-15.7	172.5	-165.2	27.5	0	0	0	112.9	R476 R477 S523 T550	R476-N480 WeakPolarHBondContact O-CB 3.31Å; R476-N480 PolarHBondContact O-N 3.39Å; R477-N480 PolarHBondContact O-N 3.24Å; N480-S523 PolarHBondContact OD1-OG 3.06Å; N480-S523 VanDerWaalsContact OD1-OG 3.07Å; N480-T550 HydrophobicContact CB-CG2 4.06Å
481	Q	86.7	Confident	87.1	Confident	96 Å²	96	62 Å²	62	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-96.2	-5.2	171.9	-69.3	-179.9	60.7	0	0	113.6	R477 Q478 E479 K510	R477-Q481 WeakPolarHBondContact O-CG 3.29Å; R477-Q481 PolarHBondContact O-N 3.38Å; R477-Q481 VanDerWaalsContact O-N 3.15Å; Q478-Q481 CarbonylContact O-C 3.51Å; Q478-Q481 WeakPolarHBondContact O-CA 3.49Å; Q478-Q481 WeakPolarHBondContact O-CB 3.29Å; Q478-Q481 PolarHBondContact O-N 2.83Å; E479-Q481 PolarHBondContact O-N 3.49Å; Q481-K510 VanDerWaalsContact O-CE 3.32Å; Q481-K510 WeakPolarHBondContact O-CE 3.04Å; Q481-K510 PolarHBondContact O-NZ 3.42Å
482	S	91	Very high	87.7	Confident	7 Å²	7	59.3 Å²	59.3	5%	0.049	28%	0.284	C	S	.	.			trans	-69.9	163.2	176.2	73	0	0	0	0	113	Q478 E479 Q495 T496 K510	Q478-S482 PolarHBondContact O-N 2.84Å; E479-S482 VanDerWaalsContact O-CB 3.31Å; E479-S482 WeakPolarHBondContact O-CB 3.27Å; E479-S482 PolarHBondContact O-N 3.32Å; E479-S482 PolarHBondContact O-OG 3.03Å; S482-Q495 PolarHBondContact OG-NE2 2.94Å; S482-T496 WeakPolarHBondContact CA-O 3.49Å; S482-K510 WeakPolarHBondContact O-CD 3.3Å; S482-K510 WeakPolarHBondContact O-CE 3.3Å
483	G	91.5	Very high	88.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	177.8	169.3	0	0	0	0	0	110.4	Q495 T496	G483-Q495 PolarHBondContact O-NE2 3.19Å; G483-Q495 PolarHBondContact O-OE1 2.83Å; G483-T496 PolarHBondContact N-O 3.28Å; G483-T496 PolarHBondContact O-N 3.38Å
484	C	93.7	Very high	88.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.3	178.1	-173.3	0	0	0	0	110.6	D509 A525 C527 H566	C484-D509 PolarHBondContact N-O 3.42Å; C484-D509 PolarHBondContact O-N 3.47Å; C484-A525 PolarHBondContact N-O 2.89Å; C484-C527 WeakPolarHBondContact CA-SG 3.21Å; C484-C527 HydrophobicContact CB-CB 4.14Å; C484-C527 WeakPolarHBondContact CB-SG 3.43Å; C484-C527 WeakPolarHBondContact SG-CA 3.5Å; C484-C527 WeakPolarHBondContact SG-CB 3.45Å; C484-C527 CovalentContact SG-SG 2.04Å; C484-C527 PolarHBondContact SG-SG 3.46Å; C484-H566 HydrophobicContact CB-CB 3.95Å
485	C	92.8	Very high	89.1	Confident	1 Å²	1	50 Å²	50	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.5	176.2	-172.3	0	0	0	0	109.5	C493 V494 T496 C501 A506	C485-C493 CarbonylContact O-C 3.44Å; C485-C493 WeakPolarHBondContact O-CA 3.31Å; C485-C493 VanDerWaalsContact O-CB 3.27Å; C485-C493 WeakPolarHBondContact O-CB 3.43Å; C485-V494 HydrophobicContact CB-CG1 4.07Å; C485-V494 WeakPolarHBondContact CB-O 3.46Å; C485-V494 PolarHBondContact N-O 3.19Å; C485-V494 PolarHBondContact O-N 3.32Å; C485-T496 HydrophobicContact CB-CG2 3.65Å; C485-C501 HydrophobicContact CB-CB 3.84Å; C485-C501 WeakPolarHBondContact CB-SG 3.32Å; C485-C501 WeakPolarHBondContact SG-CA 3.43Å; C485-C501 WeakPolarHBondContact SG-CB 3.47Å; C485-C501 CovalentContact SG-SG 2.04Å; C485-C501 PolarHBondContact SG-SG 2.97Å; C485-A506 WeakPolarHBondContact SG-CB 3.43Å
486	I	91.9	Very high	89.4	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.149	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.4	-168	-54.7	167.5	0	0	0	110.1	C493 A506 V507 D509 R565 C569	I486-C493 HydrophobicContact CB-CB 4.38Å; I486-C493 HydrophobicContact CG1-CB 4.01Å; I486-A506 CarbonylContact O-C 3.02Å; I486-A506 WeakPolarHBondContact O-CA 3.44Å; I486-A506 WeakPolarHBondContact O-CB 3.34Å; I486-V507 PolarHBondContact N-O 3.01Å; I486-V507 PolarHBondContact O-N 2.94Å; I486-D509 HydrophobicContact CD1-CB 4.12Å; I486-R565 HydrophobicContact CD1-CB 4.04Å; I486-C569 HydrophobicContact CG2-CB 4.38Å
487	F	90.2	Very high	89.4	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	137.3	-175.5	-64.2	-75.9	0	0	0	113.1	P427 L429 D489 K490 S491 G492 V494 P502 A506	P427-F487 WeakPolarHBondContact O-CE2 3.43Å; L429-F487 HydrophobicContact CD1-CD2 4.41Å; F487-D489 VanDerWaalsContact C-N 3.26Å; F487-D489 WeakPolarHBondContact CB-OD1 3.43Å; F487-D489 PolarHBondContact O-N 3.13Å; F487-K490 PolarHBondContact O-N 3.36Å; F487-K490 VanDerWaalsContact O-N 3.1Å; F487-S491 WeakPolarHBondContact CB-OG 3.3Å; F487-G492 WeakPolarHBondContact CD2-O 3.4Å; F487-G492 PolarHBondContact N-O 3.37Å; F487-G492 VanDerWaalsContact N-O 3.1Å; F487-V494 HydrophobicContact CE2-CG1 4.45Å; F487-P502 HydrophobicContact CE1-CG 3.9Å; F487-A506 HydrophobicContact CD1-CB 3.87Å; F487-A506 HydrophobicContact CE1-CB 4.11Å; F487-A506 HydrophobicContact CG-CB 4.47Å
488	H	89	Confident	89.5	Confident	122 Å²	122	46.7 Å²	46.7	57%	0.565	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-27.6	-174.8	-78.1	-48.9	0	0	0	114.5	K490 L505 V507	H488-K490 VanDerWaalsContact C-N 3.3Å; H488-L505 WeakPolarHBondContact CB-O 3.26Å; H488-L505 VanDerWaalsContact CD2-C 3.43Å; H488-L505 PolarHBondContact CD2-O 3.36Å; H488-L505 PolarHBondContact N-O 2.89Å; H488-V507 WeakPolarHBondContact CE1-CG2 3.35Å
489	D	86.6	Confident	89.5	Confident	119 Å²	119	46.2 Å²	46.2	64%	0.636	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-3	179.3	67.1	-13.9	0	0	0	113.6	F487 S491	F487-D489 VanDerWaalsContact C-N 3.26Å; F487-D489 WeakPolarHBondContact CB-OD1 3.43Å; F487-D489 PolarHBondContact O-N 3.13Å; D489-S491 VanDerWaalsContact C-N 3.29Å; D489-S491 VanDerWaalsContact CG-OG 3.32Å; D489-S491 WeakPolarHBondContact OD1-CB 3.28Å; D489-S491 PolarHBondContact OD1-N 3.42Å; D489-S491 PolarHBondContact OD1-OG 2.64Å; D489-S491 WeakPolarHBondContact OD2-CB 3.46Å; D489-S491 PolarHBondContact OD2-OG 2.69Å
490	K	83.5	Confident	89.3	Confident	189 Å²	189	50.8 Å²	50.8	82%	0.822	25%	0.249	S	C	*	.	S	Bend	trans	65.1	23.1	-171.9	-48.3	-174.9	176.4	-165.6	0	114.9	F487 H488 G492	F487-K490 PolarHBondContact O-N 3.36Å; F487-K490 VanDerWaalsContact O-N 3.1Å; H488-K490 VanDerWaalsContact C-N 3.3Å; K490-G492 PolarHBondContact O-N 3.16Å
491	S	83.7	Confident	89.3	Confident	44 Å²	44	48.6 Å²	48.6	31%	0.308	24%	0.238	S	C	.	.	S	Bend	trans	-65.7	-19.9	173.2	56.7	0	0	0	0	113.8	L429 F487 D489	L429-S491 WeakPolarHBondContact CD1-OG 3.35Å; F487-S491 WeakPolarHBondContact CB-OG 3.3Å; D489-S491 VanDerWaalsContact C-N 3.29Å; D489-S491 VanDerWaalsContact CG-OG 3.32Å; D489-S491 WeakPolarHBondContact OD1-CB 3.28Å; D489-S491 PolarHBondContact OD1-N 3.42Å; D489-S491 PolarHBondContact OD1-OG 2.64Å; D489-S491 WeakPolarHBondContact OD2-CB 3.46Å; D489-S491 PolarHBondContact OD2-OG 2.69Å
492	G	87.6	Confident	89.3	Confident	2 Å²	2	46.2 Å²	46.2	2%	0.021	23%	0.231	C	C	.	.			trans	155.9	-155.5	167.5	0	0	0	0	0	113.4	F487 K490 E570	F487-G492 WeakPolarHBondContact CD2-O 3.4Å; F487-G492 PolarHBondContact N-O 3.37Å; F487-G492 VanDerWaalsContact N-O 3.1Å; K490-G492 PolarHBondContact O-N 3.16Å; G492-E570 CarbonylContact C-O 3.5Å; G492-E570 WeakPolarHBondContact CA-O 3.49Å
493	C	91.8	Very high	89.1	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	157.9	172.9	59.8	0	0	0	0	112.8	C485 I486 C527 C569 E570 T572	C485-C493 CarbonylContact O-C 3.44Å; C485-C493 WeakPolarHBondContact O-CA 3.31Å; C485-C493 VanDerWaalsContact O-CB 3.27Å; C485-C493 WeakPolarHBondContact O-CB 3.43Å; I486-C493 HydrophobicContact CB-CB 4.38Å; I486-C493 HydrophobicContact CG1-CB 4.01Å; C493-C527 HydrophobicContact CB-CB 4.47Å; C493-C569 HydrophobicContact CB-CB 3.59Å; C493-C569 WeakPolarHBondContact CB-SG 3.45Å; C493-C569 WeakPolarHBondContact SG-CB 3.16Å; C493-C569 CovalentContact SG-SG 2.03Å; C493-C569 PolarHBondContact SG-SG 3.08Å; C493-E570 PolarHBondContact N-O 2.96Å; C493-T572 PolarHBondContact O-N 3.33Å; C493-T572 PolarHBondContact O-OG1 3.48Å
494	V	92.2	Very high	88.8	Confident	11 Å²	11	61.8 Å²	61.8	7%	0.067	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.5	178.4	59.9	0	0	0	0	111.1	P427 C485 F487 T496 C527 I586	P427-V494 HydrophobicContact CB-CB 4.21Å; P427-V494 HydrophobicContact CB-CG1 4.48Å; P427-V494 HydrophobicContact CB-CG2 3.77Å; C485-V494 HydrophobicContact CB-CG1 4.07Å; C485-V494 WeakPolarHBondContact CB-O 3.46Å; C485-V494 PolarHBondContact N-O 3.19Å; C485-V494 PolarHBondContact O-N 3.32Å; F487-V494 HydrophobicContact CE2-CG1 4.45Å; V494-T496 HydrophobicContact CG1-CG2 4.17Å; V494-T496 PolarHBondContact O-N 3Å; V494-C527 PolarHBondContact O-SG 3.09Å; V494-C527 VanDerWaalsContact O-SG 3.38Å; V494-I586 HydrophobicContact CG2-CG2 4.15Å
495	Q	93	Very high	88.4	Confident	9 Å²	9	67.2 Å²	67.2	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.3	171.5	-166.9	70.4	14.5	0	0	109.4	S482 G483 A525 V526 I586 L605	S482-Q495 PolarHBondContact OG-NE2 2.94Å; G483-Q495 PolarHBondContact O-NE2 3.19Å; G483-Q495 PolarHBondContact O-OE1 2.83Å; Q495-A525 PolarHBondContact NE2-O 3.02Å; Q495-A525 VanDerWaalsContact NE2-O 3.16Å; Q495-A525 PolarHBondContact OE1-O 3.4Å; Q495-V526 VanDerWaalsContact OE1-CA 3.31Å; Q495-I586 HydrophobicContact CB-CD1 3.91Å; Q495-I586 HydrophobicContact CG-CD1 4.24Å; Q495-L605 HydrophobicContact CG-CD2 4.02Å
496	T	91.4	Very high	88.3	Confident	26 Å²	26	67.5 Å²	67.5	16%	0.16	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	171.3	-174.9	-165.9	0	0	0	0	112.2	S482 G483 C485 V494 R500 C501	S482-T496 WeakPolarHBondContact CA-O 3.49Å; G483-T496 PolarHBondContact N-O 3.28Å; G483-T496 PolarHBondContact O-N 3.38Å; C485-T496 HydrophobicContact CB-CG2 3.65Å; V494-T496 HydrophobicContact CG1-CG2 4.17Å; V494-T496 PolarHBondContact O-N 3Å; T496-R500 HydrophobicContact CG2-CB 4.43Å; T496-R500 VanDerWaalsContact OG1-CB 3.24Å; T496-R500 WeakPolarHBondContact OG1-CB 3.5Å; T496-C501 HydrophobicContact CG2-CB 4.33Å
497	T	89.6	Confident	88.2	Confident	30 Å²	30	68.9 Å²	68.9	18%	0.184	35%	0.347	C	S	.	.			trans	-78.2	170.2	176.1	53.4	0	0	0	0	111.6	D499 R500	T497-D499 WeakPolarHBondContact CB-OD1 3.48Å; T497-D499 VanDerWaalsContact OG1-CG 3.23Å; T497-D499 PolarHBondContact OG1-OD1 3.11Å; T497-D499 PolarHBondContact OG1-OD2 2.95Å; T497-R500 PolarHBondContact O-N 2.67Å
498	E	88.6	Confident	88.3	Confident	114 Å²	114	71.5 Å²	71.5	53%	0.533	36%	0.357	S	S	.	.	S	Bend	trans	-70.2	-40.4	-171.4	-162.5	171.3	171.6	0	0	112.1	R500 C501 W508	E498-R500 VanDerWaalsContact C-N 3.32Å; E498-R500 PolarHBondContact O-N 3.4Å; E498-C501 PolarHBondContact O-N 2.94Å; E498-W508 HydrophobicContact CB-CD2 4.28Å; E498-W508 HydrophobicContact CB-CH2 3.98Å; E498-W508 HydrophobicContact CB-CZ2 3.59Å; E498-W508 HydrophobicContact CG-CD2 3.89Å; E498-W508 HydrophobicContact CG-CE3 3.99Å; E498-W508 HydrophobicContact CG-CG 4.42Å; E498-W508 HydrophobicContact CG-CH2 3.96Å; E498-W508 HydrophobicContact CG-CZ2 3.94Å; E498-W508 HydrophobicContact CG-CZ3 4.02Å; E498-W508 WeakPolarHBondContact OE2-CH2 3.45Å; E498-W508 WeakPolarHBondContact OE2-CZ3 3.4Å
499	D	87	Confident	88.3	Confident	89 Å²	89	67.4 Å²	67.4	48%	0.476	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-41.1	172.2	52.4	-69	0	0	0	113.5	T497 C501	T497-D499 WeakPolarHBondContact CB-OD1 3.48Å; T497-D499 VanDerWaalsContact OG1-CG 3.23Å; T497-D499 PolarHBondContact OG1-OD1 3.11Å; T497-D499 PolarHBondContact OG1-OD2 2.95Å; D499-C501 VanDerWaalsContact C-N 3.34Å
500	R	85.3	Confident	88.4	Confident	111 Å²	111	64.4 Å²	64.4	42%	0.419	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-0.6	-178.9	-78.3	156.9	-159.5	-120.1	-5.3	113.7	E236 D240 T496 T497 E498	E236-R500 IonicContact OE1-NH2 2.72Å; E236-R500 PolarHBondContact OE1-NH2 2.87Å; E236-R500 IonicContact OE2-NH2 3.35Å; D240-R500 IonicContact OD2-CZ 3.99Å; D240-R500 IonicContact OD2-NH1 2.8Å; D240-R500 PolarHBondContact OD2-NH1 3.47Å; D240-R500 IonicContact OD2-NH2 2.84Å; D240-R500 PolarHBondContact OD2-NH2 3.13Å; T496-R500 HydrophobicContact CG2-CB 4.43Å; T496-R500 VanDerWaalsContact OG1-CB 3.24Å; T496-R500 WeakPolarHBondContact OG1-CB 3.5Å; T497-R500 PolarHBondContact O-N 2.67Å; E498-R500 VanDerWaalsContact C-N 3.32Å; E498-R500 PolarHBondContact O-N 3.4Å
501	C	88.7	Confident	88.6	Confident	7 Å²	7	56.6 Å²	56.6	5%	0.047	29%	0.286	C	S	.	.	S	Bend	trans	-98.4	117.2	178.6	-170.1	0	0	0	0	111.9	C485 T496 E498 D499 Q503 W508	C485-C501 HydrophobicContact CB-CB 3.84Å; C485-C501 WeakPolarHBondContact CB-SG 3.32Å; C485-C501 WeakPolarHBondContact SG-CA 3.43Å; C485-C501 WeakPolarHBondContact SG-CB 3.47Å; C485-C501 CovalentContact SG-SG 2.04Å; C485-C501 PolarHBondContact SG-SG 2.97Å; T496-C501 HydrophobicContact CG2-CB 4.33Å; E498-C501 PolarHBondContact O-N 2.94Å; D499-C501 VanDerWaalsContact C-N 3.34Å; C501-Q503 PolarHBondContact O-N 3.41Å; C501-W508 HydrophobicContact CB-CB 4.33Å; C501-W508 HydrophobicContact CB-CG 4.41Å
502	P	86.9	Confident	88.6	Confident	47 Å²	47	56.3 Å²	56.3	31%	0.305	28%	0.284	S	S	.	.			trans	-73.1	100.7	-172.7	27.9	-34.8	0	0	0	112.6	F487 L504 L505 A506	F487-P502 HydrophobicContact CE1-CG 3.9Å; P502-L504 PolarHBondContact O-N 2.67Å; P502-L505 HydrophobicContact CB-CB 4.42Å; P502-L505 HydrophobicContact CG-CB 4.34Å; P502-L505 PolarHBondContact O-N 3.34Å; P502-A506 HydrophobicContact CG-CB 4.22Å; P502-A506 PolarHBondContact O-N 2.95Å
503	Q	85.5	Confident	88.5	Confident	172 Å²	172	62.5 Å²	62.5	80%	0.804	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-19.8	-175.3	-60.4	-179.4	-1.3	0	0	116.5	C501	C501-Q503 PolarHBondContact O-N 3.41Å
504	L	85.9	Confident	88.1	Confident	161 Å²	161	67.2 Å²	67.2	84%	0.843	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-15.5	178.8	-73.3	167.8	0	0	0	114	P502	P502-L504 PolarHBondContact O-N 2.67Å
505	L	86.1	Confident	87.7	Confident	115 Å²	115	72.4 Å²	72.4	60%	0.602	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	-17.4	-170.3	-62.7	177.3	0	0	0	113.4	H488 P502	H488-L505 WeakPolarHBondContact CB-O 3.26Å; H488-L505 VanDerWaalsContact CD2-C 3.43Å; H488-L505 PolarHBondContact CD2-O 3.36Å; H488-L505 PolarHBondContact N-O 2.89Å; P502-L505 HydrophobicContact CB-CB 4.42Å; P502-L505 HydrophobicContact CG-CB 4.34Å; P502-L505 PolarHBondContact O-N 3.34Å
506	A	89.3	Confident	87.1	Confident	6 Å²	6	75.7 Å²	75.7	5%	0.05	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.7	-178.9	0	0	0	0	0	112.7	C485 I486 F487 P502	C485-A506 WeakPolarHBondContact SG-CB 3.43Å; I486-A506 CarbonylContact O-C 3.02Å; I486-A506 WeakPolarHBondContact O-CA 3.44Å; I486-A506 WeakPolarHBondContact O-CB 3.34Å; F487-A506 HydrophobicContact CD1-CB 3.87Å; F487-A506 HydrophobicContact CE1-CB 4.11Å; F487-A506 HydrophobicContact CG-CB 4.47Å; P502-A506 HydrophobicContact CG-CB 4.22Å; P502-A506 PolarHBondContact O-N 2.95Å
507	V	90.5	Very high	86.6	Confident	58 Å²	58	75.1 Å²	75.1	35%	0.352	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127	165.5	-176.5	0	0	0	0	108.2	I486 H488	I486-V507 PolarHBondContact N-O 3.01Å; I486-V507 PolarHBondContact O-N 2.94Å; H488-V507 WeakPolarHBondContact CE1-CG2 3.35Å
508	W	91.1	Very high	85.9	Confident	70 Å²	70	75.4 Å²	75.4	27%	0.265	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	120.9	167.5	-172.1	78.1	0	0	0	109.6	E498 C501 K510	E498-W508 HydrophobicContact CB-CD2 4.28Å; E498-W508 HydrophobicContact CB-CH2 3.98Å; E498-W508 HydrophobicContact CB-CZ2 3.59Å; E498-W508 HydrophobicContact CG-CD2 3.89Å; E498-W508 HydrophobicContact CG-CE3 3.99Å; E498-W508 HydrophobicContact CG-CG 4.42Å; E498-W508 HydrophobicContact CG-CH2 3.96Å; E498-W508 HydrophobicContact CG-CZ2 3.94Å; E498-W508 HydrophobicContact CG-CZ3 4.02Å; E498-W508 WeakPolarHBondContact OE2-CH2 3.45Å; E498-W508 WeakPolarHBondContact OE2-CZ3 3.4Å; C501-W508 HydrophobicContact CB-CB 4.33Å; C501-W508 HydrophobicContact CB-CG 4.41Å; W508-K510 HydrophobicContact CD2-CB 4.19Å; W508-K510 HydrophobicContact CE3-CB 4.03Å; W508-K510 HydrophobicContact CH2-CB 3.78Å; W508-K510 HydrophobicContact CH2-CD 3.37Å; W508-K510 HydrophobicContact CH2-CG 4.21Å; W508-K510 HydrophobicContact CZ2-CB 3.86Å; W508-K510 HydrophobicContact CZ2-CD 3.31Å; W508-K510 HydrophobicContact CZ2-CG 4.18Å; W508-K510 HydrophobicContact CZ3-CB 3.83Å; W508-K510 HydrophobicContact CZ3-CD 4.25Å
509	D	89.2	Confident	85.3	Confident	36 Å²	36	77.2 Å²	77.2	19%	0.193	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	111.7	179.5	-160.5	-15.7	0	0	0	109.1	C484 I486 A525	C484-D509 PolarHBondContact N-O 3.42Å; C484-D509 PolarHBondContact O-N 3.47Å; I486-D509 HydrophobicContact CD1-CB 4.12Å; D509-A525 WeakPolarHBondContact O-CB 3.47Å
510	K	89	Confident	85	Confident	56 Å²	56	75.5 Å²	75.5	24%	0.243	42%	0.422	C	S	.	.			trans	-146.2	139.2	179.1	-162.9	-171.5	166.9	-172.6	0	111.2	Q481 S482 W508	Q481-K510 VanDerWaalsContact O-CE 3.32Å; Q481-K510 WeakPolarHBondContact O-CE 3.04Å; Q481-K510 PolarHBondContact O-NZ 3.42Å; S482-K510 WeakPolarHBondContact O-CD 3.3Å; S482-K510 WeakPolarHBondContact O-CE 3.3Å; W508-K510 HydrophobicContact CD2-CB 4.19Å; W508-K510 HydrophobicContact CE3-CB 4.03Å; W508-K510 HydrophobicContact CH2-CB 3.78Å; W508-K510 HydrophobicContact CH2-CD 3.37Å; W508-K510 HydrophobicContact CH2-CG 4.21Å; W508-K510 HydrophobicContact CZ2-CB 3.86Å; W508-K510 HydrophobicContact CZ2-CD 3.31Å; W508-K510 HydrophobicContact CZ2-CG 4.18Å; W508-K510 HydrophobicContact CZ3-CB 3.83Å; W508-K510 HydrophobicContact CZ3-CD 4.25Å
511	W	87.9	Confident	85	Confident	25 Å²	25	71.6 Å²	71.6	10%	0.095	41%	0.407	C	S	.	.			trans	-79.8	157.5	173.1	-54.5	-16.6	0	0	0	110.5	N515 P518 R521 V522 G524 H566	W511-N515 WeakPolarHBondContact CA-O 3.24Å; W511-P518 HydrophobicContact CH2-CG 4.11Å; W511-P518 HydrophobicContact CZ2-CG 4.29Å; W511-R521 HydrophobicContact CE3-CB 3.75Å; W511-R521 HydrophobicContact CZ3-CB 3.96Å; W511-V522 CarbonylContact C-O 3.5Å; W511-G524 VanDerWaalsContact CE3-CA 3.5Å; W511-G524 WeakPolarHBondContact CH2-O 3.39Å; W511-G524 VanDerWaalsContact CZ3-CA 3.46Å; W511-H566 AromaticContact CZ2-CE1 3.87Å; W511-H566 AromaticContact CZ2-NE2 3.95Å
512	S	84.9	Confident	84.6	Confident	37 Å²	37	73.9 Å²	73.9	26%	0.259	42%	0.421	S	S	.	.			trans	-164.3	169.5	-172.6	53.7	0	0	0	0	111.1	S514 N515 P516	S512-S514 PolarHBondContact O-N 3.45Å; S512-S514 PolarHBondContact OG-OG 3.17Å; S512-N515 PolarHBondContact N-O 3.04Å; S512-N515 CarbonylContact O-C 3.56Å; S512-N515 PolarHBondContact O-N 2.95Å; S512-N515 PolarHBondContact OG-N 3.49Å; S512-P516 WeakPolarHBondContact O-CA 3.36Å
513	T	84.8	Confident	84.1	Confident	132 Å²	132	72.4 Å²	72.4	81%	0.81	41%	0.412	S	S	*	.	S	Bend	trans	-62.8	-24.2	175.4	-38.3	0	0	0	0	113
514	S	84.1	Confident	83.6	Confident	99 Å²	99	64.3 Å²	64.3	69%	0.692	37%	0.374	S	S	*	.	S	Bend	trans	-86	-40.4	175.7	44.6	0	0	0	0	112.8	S512 P516	S512-S514 PolarHBondContact O-N 3.45Å; S512-S514 PolarHBondContact OG-OG 3.17Å; S514-P516 VanDerWaalsContact C-CD 3.49Å; S514-P516 WeakPolarHBondContact O-CD 3.16Å
515	N	82.3	Confident	83.5	Confident	121 Å²	121	56.8 Å²	56.8	65%	0.647	34%	0.335	S	S	*	.	S	Bend	trans	-118.7	77.2	172.8	-67.3	-39.2	0	0	0	109.6	W511 S512	W511-N515 WeakPolarHBondContact CA-O 3.24Å; S512-N515 PolarHBondContact N-O 3.04Å; S512-N515 CarbonylContact O-C 3.56Å; S512-N515 PolarHBondContact O-N 2.95Å; S512-N515 PolarHBondContact OG-N 3.49Å
516	P	82.2	Confident	83.7	Confident	77 Å²	77	51.3 Å²	51.3	50%	0.5	31%	0.307	S	S	.	.			trans	-69	145.5	-179.2	27.7	-34.8	0	0	0	110.9	S512 S514	S512-P516 WeakPolarHBondContact O-CA 3.36Å; S514-P516 VanDerWaalsContact C-CD 3.49Å; S514-P516 WeakPolarHBondContact O-CD 3.16Å
517	G	79.7	Confident	83.8	Confident	15 Å²	15	51 Å²	51	16%	0.155	31%	0.305	C	S	.	.			trans	-72.1	-172.9	173.5	0	0	0	0	0	113.2	G520 R521	G517-G520 PolarHBondContact O-N 3.22Å; G517-R521 PolarHBondContact N-O 3.22Å
518	P	75.5	Confident	83.5	Confident	36 Å²	36	49.6 Å²	49.6	23%	0.234	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-52.2	145	169.3	-13	23.8	0	0	0	110.8	W511 G520 R521 R532	W511-P518 HydrophobicContact CH2-CG 4.11Å; W511-P518 HydrophobicContact CZ2-CG 4.29Å; P518-G520 PolarHBondContact O-N 3.33Å; P518-R521 WeakPolarHBondContact O-CB 3.47Å; P518-R521 WeakPolarHBondContact O-CG 3.45Å; P518-R521 PolarHBondContact O-N 2.79Å; P518-R532 VanDerWaalsContact CG-NH1 3.34Å
519	D	75.5	Confident	83.3	Confident	152 Å²	152	46.6 Å²	46.6	81%	0.813	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	57.5	16.6	177.1	-47.9	-50.8	0	0	0	114.8
520	G	80.9	Confident	83.2	Confident	52 Å²	52	45 Å²	45	54%	0.536	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	85.8	8	177.7	0	0	0	0	0	115.1	G517 P518	G517-G520 PolarHBondContact O-N 3.22Å; P518-G520 PolarHBondContact O-N 3.33Å
521	R	84.2	Confident	83.1	Confident	30 Å²	30	42.5 Å²	42.5	11%	0.113	27%	0.272	C	S	.	.			trans	-57	134.4	178.8	-72.6	-178.5	170.7	-87.3	-3.6	112.7	W511 G517 P518 W545 P546 D547	W511-R521 HydrophobicContact CE3-CB 3.75Å; W511-R521 HydrophobicContact CZ3-CB 3.96Å; G517-R521 PolarHBondContact N-O 3.22Å; P518-R521 WeakPolarHBondContact O-CB 3.47Å; P518-R521 WeakPolarHBondContact O-CG 3.45Å; P518-R521 PolarHBondContact O-N 2.79Å; R521-W545 PolarHBondContact NH2-O 2.94Å; R521-P546 PolarHBondContact NH1-O 3.42Å; R521-D547 VanDerWaalsContact CA-OD1 3.28Å; R521-D547 WeakPolarHBondContact CA-OD1 3.42Å; R521-D547 WeakPolarHBondContact CB-OD1 3.45Å; R521-D547 VanDerWaalsContact CG-OD1 3.27Å; R521-D547 WeakPolarHBondContact CG-OD1 3.48Å; R521-D547 IonicContact NH1-OD1 3.59Å
522	V	82.3	Confident	82.9	Confident	55 Å²	55	46 Å²	46	33%	0.333	29%	0.285	S	S	.	.	S	Bend	trans	-97.8	-14.5	169	-61.9	0	0	0	0	113	W511 D547	W511-V522 CarbonylContact C-O 3.5Å; V522-D547 WeakPolarHBondContact CG2-OD2 3.17Å; V522-D547 PolarHBondContact N-OD1 2.82Å; V522-D547 PolarHBondContact N-OD2 2.96Å
523	S	75.2	Confident	82.9	Confident	15 Å²	15	44.6 Å²	44.6	11%	0.105	28%	0.275	C	S	.	.	S	Bend	trans	-131.7	110.9	-175.7	-87.6	0	0	0	0	110.3	N480 D547	N480-S523 PolarHBondContact OD1-OG 3.06Å; N480-S523 VanDerWaalsContact OD1-OG 3.07Å; S523-D547 WeakPolarHBondContact CB-O 3.35Å; S523-D547 PolarHBondContact N-OD1 3.17Å; S523-D547 VanDerWaalsContact O-OD1 3.1Å
524	G	75.1	Confident	83	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.021	24%	0.238	C	C	.	.			trans	169.1	8.3	-179.5	0	0	0	0	0	120.2	W511 V526 W552	W511-G524 VanDerWaalsContact CE3-CA 3.5Å; W511-G524 WeakPolarHBondContact CH2-O 3.39Å; W511-G524 VanDerWaalsContact CZ3-CA 3.46Å; G524-V526 VanDerWaalsContact C-N 3.33Å; G524-V526 PolarHBondContact O-N 3.33Å; G524-V526 VanDerWaalsContact O-N 3.08Å; G524-W552 VanDerWaalsContact CA-CZ2 3.46Å; G524-W552 WeakPolarHBondContact O-CH2 3.46Å
525	A	84.9	Confident	83.1	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.025	22%	0.216	C	C	.	.			trans	-79.8	85.1	166	0	0	0	0	0	109.5	C484 Q495 D509	C484-A525 PolarHBondContact N-O 2.89Å; Q495-A525 PolarHBondContact NE2-O 3.02Å; Q495-A525 VanDerWaalsContact NE2-O 3.16Å; Q495-A525 PolarHBondContact OE1-O 3.4Å; D509-A525 WeakPolarHBondContact O-CB 3.47Å
526	V	89.9	Confident	83.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-104.5	124.9	177.6	-177	0	0	0	0	109.6	Q495 G524 G528 Q529 L549 W552 H566 L605	Q495-V526 VanDerWaalsContact OE1-CA 3.31Å; G524-V526 VanDerWaalsContact C-N 3.33Å; G524-V526 PolarHBondContact O-N 3.33Å; G524-V526 VanDerWaalsContact O-N 3.08Å; V526-G528 PolarHBondContact O-N 3.41Å; V526-Q529 HydrophobicContact CB-CB 4.23Å; V526-Q529 HydrophobicContact CG1-CB 4.01Å; V526-Q529 PolarHBondContact O-N 3.25Å; V526-Q529 VanDerWaalsContact O-N 3.1Å; V526-L549 HydrophobicContact CG2-CD2 3.18Å; V526-W552 HydrophobicContact CB-CZ3 4.09Å; V526-W552 HydrophobicContact CG2-CE3 3.91Å; V526-W552 HydrophobicContact CG2-CH2 4.13Å; V526-W552 HydrophobicContact CG2-CZ3 3.56Å; V526-H566 PolarHBondContact O-CD2 3.25Å; V526-L605 HydrophobicContact CG1-CD1 4.38Å; V526-L605 HydrophobicContact CG1-CD2 3.93Å; V526-L605 HydrophobicContact CG1-CG 4.05Å; V526-L605 HydrophobicContact CG2-CD1 4.28Å; V526-L605 HydrophobicContact CG2-CD2 4.45Å
527	C	90.9	Very high	83.7	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.007	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	130.4	175.1	-62.6	0	0	0	0	110.9	C484 C493 V494 Q529 H566 L571	C484-C527 WeakPolarHBondContact CA-SG 3.21Å; C484-C527 HydrophobicContact CB-CB 4.14Å; C484-C527 WeakPolarHBondContact CB-SG 3.43Å; C484-C527 WeakPolarHBondContact SG-CA 3.5Å; C484-C527 WeakPolarHBondContact SG-CB 3.45Å; C484-C527 CovalentContact SG-SG 2.04Å; C484-C527 PolarHBondContact SG-SG 3.46Å; C493-C527 HydrophobicContact CB-CB 4.47Å; V494-C527 PolarHBondContact O-SG 3.09Å; V494-C527 VanDerWaalsContact O-SG 3.38Å; C527-Q529 PolarHBondContact O-N 2.85Å; C527-H566 CarbonylContact C-O 3.52Å; C527-H566 WeakPolarHBondContact CA-O 3.23Å; C527-L571 HydrophobicContact CB-CD2 3.4Å; C527-L571 VanDerWaalsContact CB-CD2 3.4Å
528	G	85.1	Confident	83.9	Confident	28 Å²	28	33 Å²	33	29%	0.289	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	0.4	-179	0	0	0	0	0	116.2	V526 H566	V526-G528 PolarHBondContact O-N 3.41Å; G528-H566 PolarHBondContact N-O 2.97Å
529	Q	86.9	Confident	84.5	Confident	7 Å²	7	32.5 Å²	32.5	3%	0.033	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-141.9	128.5	-175.2	-173.2	173.3	5.5	0	0	113.5	V526 C527 W545 W552 P553 C555 T604	V526-Q529 HydrophobicContact CB-CB 4.23Å; V526-Q529 HydrophobicContact CG1-CB 4.01Å; V526-Q529 PolarHBondContact O-N 3.25Å; V526-Q529 VanDerWaalsContact O-N 3.1Å; C527-Q529 PolarHBondContact O-N 2.85Å; Q529-W545 HydrophobicContact CG-CH2 4.24Å; Q529-W545 HydrophobicContact CG-CZ3 4.07Å; Q529-W545 VanDerWaalsContact NE2-CH2 3.28Å; Q529-W552 HydrophobicContact CG-CE3 4.33Å; Q529-W552 HydrophobicContact CG-CZ3 4.38Å; Q529-P553 PolarHBondContact NE2-O 3.43Å; Q529-C555 HydrophobicContact CG-CB 4.27Å; Q529-T604 HydrophobicContact CB-CG2 4.39Å; Q529-T604 PolarHBondContact OE1-OG1 3.47Å
530	D	87	Confident	84.9	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.011	19%	0.192	C	C	.	.			trans	-137.7	137.9	169.9	-172.5	-74.1	0	0	0	110.1	R532 A533 C534 L564 H566 T567	D530-R532 PolarHBondContact O-N 3.11Å; D530-R532 VanDerWaalsContact O-N 3.11Å; D530-R532 VanDerWaalsContact OD1-CB 3.24Å; D530-R532 WeakPolarHBondContact OD1-CB 3.41Å; D530-R532 WeakPolarHBondContact OD1-CG 3.14Å; D530-R532 IonicContact OD1-CZ 3.55Å; D530-R532 PolarHBondContact OD1-N 3.5Å; D530-R532 IonicContact OD1-NE 2.81Å; D530-R532 PolarHBondContact OD1-NE 2.9Å; D530-R532 IonicContact OD1-NH2 3.5Å; D530-R532 PolarHBondContact OD1-NH2 2.93Å; D530-R532 IonicContact OD2-CZ 3.53Å; D530-R532 IonicContact OD2-NE 3.5Å; D530-R532 IonicContact OD2-NH2 2.72Å; D530-R532 PolarHBondContact OD2-NH2 3.35Å; D530-A533 HydrophobicContact CB-CB 4.04Å; D530-A533 PolarHBondContact O-N 3.06Å; D530-C534 PolarHBondContact O-N 3.39Å; D530-C534 VanDerWaalsContact O-N 3.1Å; D530-L564 HydrophobicContact CB-CD1 3.74Å; D530-L564 VanDerWaalsContact OD2-CD1 3.32Å; D530-L564 WeakPolarHBondContact OD2-CD1 3.39Å; D530-H566 IonicContact OD2-CE1 3.8Å; D530-H566 IonicContact OD2-NE2 2.71Å; D530-H566 PolarHBondContact OD2-NE2 3.5Å; D530-T567 HydrophobicContact CB-CG2 3.72Å
531	P	86.1	Confident	85	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.026	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.9	-178.1	-22.2	32.5	0	0	0	113.9	S539 W545 W552	P531-S539 WeakPolarHBondContact O-CB 3.33Å; P531-W545 HydrophobicContact CB-CD2 3.94Å; P531-W545 HydrophobicContact CB-CE3 3.74Å; P531-W545 HydrophobicContact CB-CG 4.32Å; P531-W545 HydrophobicContact CB-CZ3 4.15Å; P531-W545 HydrophobicContact CG-CD2 4.3Å; P531-W545 HydrophobicContact CG-CE3 3.65Å; P531-W545 HydrophobicContact CG-CZ3 4.05Å; P531-W552 VanDerWaalsContact CD-CH2 3.45Å; P531-W552 HydrophobicContact CG-CH2 3.51Å; P531-W552 HydrophobicContact CG-CZ2 3.72Å; P531-W552 HydrophobicContact CG-CZ3 3.97Å
532	R	83.8	Confident	84.8	Confident	99 Å²	99	37.1 Å²	37.1	37%	0.374	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-26.6	178.6	-53.4	164.4	-66.3	159.8	-5.3	112.5	P518 D530	P518-R532 VanDerWaalsContact CG-NH1 3.34Å; D530-R532 PolarHBondContact O-N 3.11Å; D530-R532 VanDerWaalsContact O-N 3.11Å; D530-R532 VanDerWaalsContact OD1-CB 3.24Å; D530-R532 WeakPolarHBondContact OD1-CB 3.41Å; D530-R532 WeakPolarHBondContact OD1-CG 3.14Å; D530-R532 IonicContact OD1-CZ 3.55Å; D530-R532 PolarHBondContact OD1-N 3.5Å; D530-R532 IonicContact OD1-NE 2.81Å; D530-R532 PolarHBondContact OD1-NE 2.9Å; D530-R532 IonicContact OD1-NH2 3.5Å; D530-R532 PolarHBondContact OD1-NH2 2.93Å; D530-R532 IonicContact OD2-CZ 3.53Å; D530-R532 IonicContact OD2-NE 3.5Å; D530-R532 IonicContact OD2-NH2 2.72Å; D530-R532 PolarHBondContact OD2-NH2 3.35Å
533	A	84.1	Confident	84.7	Confident	7 Å²	7	39.4 Å²	39.4	6%	0.058	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-32.7	174.8	0	0	0	0	0	111.3	D530 A535 N559 V562	D530-A533 HydrophobicContact CB-CB 4.04Å; D530-A533 PolarHBondContact O-N 3.06Å; A533-A535 PolarHBondContact O-N 3.36Å; A533-N559 PolarHBondContact O-N 3.34Å; A533-N559 PolarHBondContact O-ND2 3.08Å; A533-N559 VanDerWaalsContact O-ND2 3.1Å; A533-V562 HydrophobicContact CB-CB 4.04Å; A533-V562 HydrophobicContact CB-CG1 4.23Å
534	C	87.8	Confident	85.1	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.02	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	129.9	-175.7	-158.4	0	0	0	0	113.7	D530 I536 A538 W545 C555	D530-C534 PolarHBondContact O-N 3.39Å; D530-C534 VanDerWaalsContact O-N 3.1Å; C534-I536 VanDerWaalsContact SG-C 3.55Å; C534-I536 PolarHBondContact SG-O 3.31Å; C534-I536 VanDerWaalsContact SG-O 3.34Å; C534-A538 WeakPolarHBondContact O-CA 3.46Å; C534-W545 HydrophobicContact CB-CH2 3.68Å; C534-W545 HydrophobicContact CB-CZ2 3.65Å; C534-C555 WeakPolarHBondContact CA-SG 3.39Å; C534-C555 HydrophobicContact CB-CB 4.09Å; C534-C555 WeakPolarHBondContact CB-SG 3.18Å; C534-C555 WeakPolarHBondContact SG-CA 3.23Å; C534-C555 WeakPolarHBondContact SG-CB 3.46Å; C534-C555 CovalentContact SG-SG 2.04Å; C534-C555 PolarHBondContact SG-SG 3.32Å
535	A	86.5	Confident	85.8	Confident	30 Å²	30	45 Å²	45	25%	0.248	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-39.6	172	0	0	0	0	0	112	A533 A538 E557	A533-A535 PolarHBondContact O-N 3.36Å; A535-A538 WeakPolarHBondContact O-CB 3.26Å; A535-A538 PolarHBondContact O-N 2.92Å; A535-E557 HydrophobicContact CB-CB 4.02Å; A535-E557 PolarHBondContact N-O 3.5Å
536	I	85.9	Confident	85.9	Confident	73 Å²	73	47.3 Å²	47.3	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	108.8	-179.9	-57.8	-172.5	0	0	0	110.1	C534 R556 E557	C534-I536 VanDerWaalsContact SG-C 3.55Å; C534-I536 PolarHBondContact SG-O 3.31Å; C534-I536 VanDerWaalsContact SG-O 3.34Å; I536-R556 HydrophobicContact CB-CB 4.38Å; I536-R556 HydrophobicContact CG2-CB 4.36Å; I536-R556 PolarHBondContact O-N 3.5Å; I536-E557 HydrophobicContact CB-CB 4.3Å; I536-E557 VanDerWaalsContact CD1-CD 3.46Å; I536-E557 HydrophobicContact CD1-CG 4.2Å; I536-E557 VanDerWaalsContact CD1-OE2 3.26Å; I536-E557 WeakPolarHBondContact CD1-OE2 3.28Å; I536-E557 HydrophobicContact CG1-CB 4.27Å; I536-E557 HydrophobicContact CG1-CG 4.38Å
537	P	89.9	Confident	85.7	Confident	56 Å²	56	50 Å²	50	36%	0.364	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.4	115.3	-6	33.5	-30.8	0	0	0	112.4	S539 W545 P553 L554	P537-S539 PolarHBondContact O-N 3.06Å; P537-W545 HydrophobicContact CG-CZ2 4.36Å; P537-W545 VanDerWaalsContact O-CZ2 3.27Å; P537-W545 WeakPolarHBondContact O-CZ2 3.3Å; P537-W545 PolarHBondContact O-NE1 3.21Å; P537-P553 HydrophobicContact CG-CB 3.79Å; P537-P553 HydrophobicContact CG-CG 3.55Å; P537-L554 WeakPolarHBondContact CD-O 3.26Å
538	A	85.7	Confident	85.5	Confident	37 Å²	37	51.7 Å²	51.7	31%	0.306	30%	0.301	S	S	.	.			trans	-54.4	133	176.3	0	0	0	0	0	113.2	C534 A535 I540	C534-A538 WeakPolarHBondContact O-CA 3.46Å; A535-A538 WeakPolarHBondContact O-CB 3.26Å; A535-A538 PolarHBondContact O-N 2.92Å; A538-I540 HydrophobicContact CB-CG2 4.3Å; A538-I540 PolarHBondContact O-N 3.48Å
539	S	86.2	Confident	85.6	Confident	27 Å²	27	50.5 Å²	50.5	19%	0.189	29%	0.288	C	S	.	.			trans	-78	82.7	175.5	178.1	0	0	0	0	110.7	P531 P537 E544 W545	P531-S539 WeakPolarHBondContact O-CB 3.33Å; P537-S539 PolarHBondContact O-N 3.06Å; S539-E544 WeakPolarHBondContact OG-CA 3.36Å; S539-W545 PolarHBondContact OG-N 3.02Å
540	I	85.8	Confident	85.7	Confident	118 Å²	118	51.2 Å²	51.2	61%	0.605	29%	0.292	S	S	*	.	B	Isolated β-bridge	trans	-127.8	139.2	-178.5	57.4	171.1	0	0	0	111.7	A538 L543	A538-I540 HydrophobicContact CB-CG2 4.3Å; A538-I540 PolarHBondContact O-N 3.48Å; I540-L543 PolarHBondContact N-O 3.33Å; I540-L543 CarbonylContact O-C 3.13Å; I540-L543 WeakPolarHBondContact O-CA 3.47Å; I540-L543 PolarHBondContact O-N 3.3Å
541	S	82.4	Confident	85.7	Confident	91 Å²	91	59.5 Å²	59.5	64%	0.636	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	130.9	179.4	-138.4	0	0	0	0	111.8	E544	S541-E544 VanDerWaalsContact CA-OE1 3.26Å; S541-E544 WeakPolarHBondContact CA-OE1 3.48Å; S541-E544 WeakPolarHBondContact CB-OE1 3.44Å; S541-E544 PolarHBondContact OG-OE1 3Å
542	P	79	Confident	85.9	Confident	122 Å²	122	59.7 Å²	59.7	79%	0.792	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.8	13.1	8.3	38	-35.7	0	0	0	115.2
543	L	80	Confident	86.1	Confident	102 Å²	102	57 Å²	57	53%	0.534	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-106.9	56.2	172.5	-84.5	82.4	0	0	0	110.8	R182 I540	R182-L543 VanDerWaalsContact NH2-CD2 3.27Å; I540-L543 PolarHBondContact N-O 3.33Å; I540-L543 CarbonylContact O-C 3.13Å; I540-L543 WeakPolarHBondContact O-CA 3.47Å; I540-L543 PolarHBondContact O-N 3.3Å
544	E	84.9	Confident	86.3	Confident	118 Å²	118	59.7 Å²	59.7	55%	0.551	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-68.3	140.5	164.3	-73.4	154.4	-130	0	0	109.7	S539 S541	S539-E544 WeakPolarHBondContact OG-CA 3.36Å; S541-E544 VanDerWaalsContact CA-OE1 3.26Å; S541-E544 WeakPolarHBondContact CA-OE1 3.48Å; S541-E544 WeakPolarHBondContact CB-OE1 3.44Å; S541-E544 PolarHBondContact OG-OE1 3Å
545	W	88.6	Confident	86.4	Confident	16 Å²	16	61 Å²	61	6%	0.061	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-68.3	145.7	175.2	-62.6	10.5	0	0	0	109.5	R521 Q529 P531 C534 P537 S539 W552 P553 C555	R521-W545 PolarHBondContact NH2-O 2.94Å; Q529-W545 HydrophobicContact CG-CH2 4.24Å; Q529-W545 HydrophobicContact CG-CZ3 4.07Å; Q529-W545 VanDerWaalsContact NE2-CH2 3.28Å; P531-W545 HydrophobicContact CB-CD2 3.94Å; P531-W545 HydrophobicContact CB-CE3 3.74Å; P531-W545 HydrophobicContact CB-CG 4.32Å; P531-W545 HydrophobicContact CB-CZ3 4.15Å; P531-W545 HydrophobicContact CG-CD2 4.3Å; P531-W545 HydrophobicContact CG-CE3 3.65Å; P531-W545 HydrophobicContact CG-CZ3 4.05Å; C534-W545 HydrophobicContact CB-CH2 3.68Å; C534-W545 HydrophobicContact CB-CZ2 3.65Å; P537-W545 HydrophobicContact CG-CZ2 4.36Å; P537-W545 VanDerWaalsContact O-CZ2 3.27Å; P537-W545 WeakPolarHBondContact O-CZ2 3.3Å; P537-W545 PolarHBondContact O-NE1 3.21Å; S539-W545 PolarHBondContact OG-N 3.02Å; W545-W552 HydrophobicContact CE3-CB 4.26Å; W545-W552 AromaticContact CE3-CD2 3.75Å; W545-W552 HydrophobicContact CE3-CD2 3.75Å; W545-W552 AromaticContact CE3-CE3 3.83Å; W545-W552 HydrophobicContact CE3-CE3 3.83Å; W545-W552 AromaticContact CE3-CG 3.97Å; W545-W552 HydrophobicContact CE3-CG 3.97Å; W545-W552 HydrophobicContact CE3-CZ3 4.41Å; W545-W552 HydrophobicContact CZ3-CD2 4.11Å; W545-W552 AromaticContact CZ3-CE3 3.7Å; W545-W552 HydrophobicContact CZ3-CE3 3.7Å; W545-W552 HydrophobicContact CZ3-CZ3 4.2Å; W545-P553 HydrophobicContact CD2-CG 3.88Å; W545-P553 HydrophobicContact CE3-CG 4.43Å; W545-P553 HydrophobicContact CG-CG 4.29Å; W545-P553 HydrophobicContact CH2-CG 4.46Å; W545-P553 HydrophobicContact CZ2-CG 3.85Å; W545-C555 HydrophobicContact CH2-CB 4.3Å
546	P	87.9	Confident	86.3	Confident	53 Å²	53	68.5 Å²	68.5	34%	0.344	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-63.2	163.4	175.8	27.4	-34	0	0	0	112	R521 D548 R551 W552	R521-P546 PolarHBondContact NH1-O 3.42Å; P546-D548 VanDerWaalsContact C-N 3.33Å; P546-D548 HydrophobicContact CB-CB 4.46Å; P546-R551 HydrophobicContact CG-CB 3.58Å; P546-W552 PolarHBondContact O-NE1 3.42Å
547	D	85.4	Confident	86.1	Confident	55 Å²	55	69.9 Å²	69.9	29%	0.294	37%	0.368	S	S	.	.	S	Bend	trans	-74.4	-27.9	169.2	-152.9	26.9	0	0	0	111.3	R521 V522 S523 L549	R521-D547 VanDerWaalsContact CA-OD1 3.28Å; R521-D547 WeakPolarHBondContact CA-OD1 3.42Å; R521-D547 WeakPolarHBondContact CB-OD1 3.45Å; R521-D547 VanDerWaalsContact CG-OD1 3.27Å; R521-D547 WeakPolarHBondContact CG-OD1 3.48Å; R521-D547 IonicContact NH1-OD1 3.59Å; V522-D547 WeakPolarHBondContact CG2-OD2 3.17Å; V522-D547 PolarHBondContact N-OD1 2.82Å; V522-D547 PolarHBondContact N-OD2 2.96Å; S523-D547 WeakPolarHBondContact CB-O 3.35Å; S523-D547 PolarHBondContact N-OD1 3.17Å; S523-D547 VanDerWaalsContact O-OD1 3.1Å; D547-L549 PolarHBondContact O-N 2.89Å
548	D	87	Confident	85.6	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.203	38%	0.378	C	S	.	.			trans	-62.1	105	171.1	-175.6	-11.4	0	0	0	111.3	P546 T550 R551 W552	P546-D548 VanDerWaalsContact C-N 3.33Å; P546-D548 HydrophobicContact CB-CB 4.46Å; D548-T550 PolarHBondContact O-N 2.85Å; D548-T550 WeakPolarHBondContact OD1-CB 3.39Å; D548-T550 PolarHBondContact OD1-N 3.23Å; D548-T550 PolarHBondContact OD1-OG1 3.13Å; D548-T550 PolarHBondContact OD2-OG1 3.08Å; D548-R551 HydrophobicContact CB-CG 4.41Å; D548-R551 PolarHBondContact O-N 3.48Å; D548-R551 VanDerWaalsContact O-N 3.14Å; D548-R551 IonicContact OD2-CZ 2.6Å; D548-R551 IonicContact OD2-NE 3.67Å; D548-R551 PolarHBondContact OD2-NE 2.97Å; D548-R551 IonicContact OD2-NH2 3.8Å; D548-R551 PolarHBondContact OD2-NH2 3.03Å; D548-W552 VanDerWaalsContact O-CD1 3.28Å
549	L	87.9	Confident	85.2	Confident	3 Å²	3	74 Å²	74	2%	0.016	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-49.7	-37.7	177.9	-81.3	156.7	0	0	0	112.8	V526 D547 R551 W552	V526-L549 HydrophobicContact CG2-CD2 3.18Å; D547-L549 PolarHBondContact O-N 2.89Å; L549-R551 PolarHBondContact O-N 3.32Å; L549-W552 HydrophobicContact CD2-CD2 4.3Å; L549-W552 HydrophobicContact CD2-CE3 4.47Å; L549-W552 HydrophobicContact CD2-CH2 4.38Å; L549-W552 HydrophobicContact CD2-CZ2 4.18Å; L549-W552 WeakPolarHBondContact O-CB 3.28Å; L549-W552 PolarHBondContact O-N 2.59Å; L549-W552 VanDerWaalsContact O-N 3.1Å
550	T	87.5	Confident	84.2	Confident	22 Å²	22	82.8 Å²	82.8	14%	0.135	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-71.3	-1.9	-174.1	72.2	0	0	0	0	113.8	R476 N480 D548 S607	R476-T550 HydrophobicContact CB-CG2 3.89Å; R476-T550 HydrophobicContact CG-CG2 4.14Å; R476-T550 WeakPolarHBondContact O-CG2 3.43Å; N480-T550 HydrophobicContact CB-CG2 4.06Å; D548-T550 PolarHBondContact O-N 2.85Å; D548-T550 WeakPolarHBondContact OD1-CB 3.39Å; D548-T550 PolarHBondContact OD1-N 3.23Å; D548-T550 PolarHBondContact OD1-OG1 3.13Å; D548-T550 PolarHBondContact OD2-OG1 3.08Å; T550-S607 WeakPolarHBondContact O-CB 3.19Å
551	R	87.9	Confident	83	Confident	175 Å²	175	80.5 Å²	80.5	66%	0.66	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-118.7	10.5	178.7	-56.2	-176	-151.9	-158.6	4.7	112.6	P546 D548 L549	P546-R551 HydrophobicContact CG-CB 3.58Å; D548-R551 HydrophobicContact CB-CG 4.41Å; D548-R551 PolarHBondContact O-N 3.48Å; D548-R551 VanDerWaalsContact O-N 3.14Å; D548-R551 IonicContact OD2-CZ 2.6Å; D548-R551 IonicContact OD2-NE 3.67Å; D548-R551 PolarHBondContact OD2-NE 2.97Å; D548-R551 IonicContact OD2-NH2 3.8Å; D548-R551 PolarHBondContact OD2-NH2 3.03Å; L549-R551 PolarHBondContact O-N 3.32Å
552	W	89.8	Confident	82.2	Confident	8 Å²	8	78.3 Å²	78.3	3%	0.03	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-72.3	130.4	178.1	-77.1	27.3	0	0	0	110.8	G524 V526 Q529 P531 W545 P546 D548 L549 L605	G524-W552 VanDerWaalsContact CA-CZ2 3.46Å; G524-W552 WeakPolarHBondContact O-CH2 3.46Å; V526-W552 HydrophobicContact CB-CZ3 4.09Å; V526-W552 HydrophobicContact CG2-CE3 3.91Å; V526-W552 HydrophobicContact CG2-CH2 4.13Å; V526-W552 HydrophobicContact CG2-CZ3 3.56Å; Q529-W552 HydrophobicContact CG-CE3 4.33Å; Q529-W552 HydrophobicContact CG-CZ3 4.38Å; P531-W552 VanDerWaalsContact CD-CH2 3.45Å; P531-W552 HydrophobicContact CG-CH2 3.51Å; P531-W552 HydrophobicContact CG-CZ2 3.72Å; P531-W552 HydrophobicContact CG-CZ3 3.97Å; W545-W552 HydrophobicContact CE3-CB 4.26Å; W545-W552 AromaticContact CE3-CD2 3.75Å; W545-W552 HydrophobicContact CE3-CD2 3.75Å; W545-W552 AromaticContact CE3-CE3 3.83Å; W545-W552 HydrophobicContact CE3-CE3 3.83Å; W545-W552 AromaticContact CE3-CG 3.97Å; W545-W552 HydrophobicContact CE3-CG 3.97Å; W545-W552 HydrophobicContact CE3-CZ3 4.41Å; W545-W552 HydrophobicContact CZ3-CD2 4.11Å; W545-W552 AromaticContact CZ3-CE3 3.7Å; W545-W552 HydrophobicContact CZ3-CE3 3.7Å; W545-W552 HydrophobicContact CZ3-CZ3 4.2Å; P546-W552 PolarHBondContact O-NE1 3.42Å; D548-W552 VanDerWaalsContact O-CD1 3.28Å; L549-W552 HydrophobicContact CD2-CD2 4.3Å; L549-W552 HydrophobicContact CD2-CE3 4.47Å; L549-W552 HydrophobicContact CD2-CH2 4.38Å; L549-W552 HydrophobicContact CD2-CZ2 4.18Å; L549-W552 WeakPolarHBondContact O-CB 3.28Å; L549-W552 PolarHBondContact O-N 2.59Å; L549-W552 VanDerWaalsContact O-N 3.1Å; W552-L605 HydrophobicContact CB-CD1 4.46Å
553	P	88.6	Confident	81.7	Confident	44 Å²	44	76.6 Å²	76.6	29%	0.286	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-70.3	157.5	175.3	31.2	-35.2	0	0	0	111.4	Q529 P537 W545 C555	Q529-P553 PolarHBondContact NE2-O 3.43Å; P537-P553 HydrophobicContact CG-CB 3.79Å; P537-P553 HydrophobicContact CG-CG 3.55Å; W545-P553 HydrophobicContact CD2-CG 3.88Å; W545-P553 HydrophobicContact CE3-CG 4.43Å; W545-P553 HydrophobicContact CG-CG 4.29Å; W545-P553 HydrophobicContact CH2-CG 4.46Å; W545-P553 HydrophobicContact CZ2-CG 3.85Å; P553-C555 PolarHBondContact O-N 2.88Å
554	L	88.4	Confident	81.6	Confident	62 Å²	62	73.5 Å²	73.5	33%	0.325	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-58.5	126.2	166.1	-74.5	162.6	0	0	0	110.1	P537 E602 A603 Q608	P537-L554 WeakPolarHBondContact CD-O 3.26Å; L554-E602 HydrophobicContact CD2-CG 4.5Å; L554-E602 WeakPolarHBondContact CD2-O 3.31Å; L554-A603 HydrophobicContact CD2-CB 3.82Å; L554-Q608 HydrophobicContact CD2-CB 3.74Å; L554-Q608 HydrophobicContact CD2-CG 4.17Å; L554-Q608 HydrophobicContact CG-CB 3.96Å; L554-Q608 HydrophobicContact CG-CG 4.32Å
555	C	88.2	Confident	81.3	Confident	30 Å²	30	76.6 Å²	76.6	20%	0.203	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-86	121.1	171	-170.7	0	0	0	0	110.2	Q529 C534 W545 P553 E557	Q529-C555 HydrophobicContact CG-CB 4.27Å; C534-C555 WeakPolarHBondContact CA-SG 3.39Å; C534-C555 HydrophobicContact CB-CB 4.09Å; C534-C555 WeakPolarHBondContact CB-SG 3.18Å; C534-C555 WeakPolarHBondContact SG-CA 3.23Å; C534-C555 WeakPolarHBondContact SG-CB 3.46Å; C534-C555 CovalentContact SG-SG 2.04Å; C534-C555 PolarHBondContact SG-SG 3.32Å; W545-C555 HydrophobicContact CH2-CB 4.3Å; P553-C555 PolarHBondContact O-N 2.88Å; C555-E557 PolarHBondContact SG-O 3.06Å
556	R	85.4	Confident	81.2	Confident	189 Å²	189	76 Å²	76	71%	0.713	39%	0.391	S	S	*	.			trans	-93.6	-32.7	-178.8	-61.9	-175.5	179.8	-167	-2.3	113.7	I536	I536-R556 HydrophobicContact CB-CB 4.38Å; I536-R556 HydrophobicContact CG2-CB 4.36Å; I536-R556 PolarHBondContact O-N 3.5Å
557	E	82.6	Confident	80.9	Confident	102 Å²	102	75.1 Å²	75.1	48%	0.477	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.2	-176.5	-69.4	-176.4	-179.6	0	0	109.6	A535 I536 C555	A535-E557 HydrophobicContact CB-CB 4.02Å; A535-E557 PolarHBondContact N-O 3.5Å; I536-E557 HydrophobicContact CB-CB 4.3Å; I536-E557 VanDerWaalsContact CD1-CD 3.46Å; I536-E557 HydrophobicContact CD1-CG 4.2Å; I536-E557 VanDerWaalsContact CD1-OE2 3.26Å; I536-E557 WeakPolarHBondContact CD1-OE2 3.28Å; I536-E557 HydrophobicContact CG1-CB 4.27Å; I536-E557 HydrophobicContact CG1-CG 4.38Å; C555-E557 PolarHBondContact SG-O 3.06Å
558	T	79.3	Confident	80.7	Confident	93 Å²	93	79 Å²	79	57%	0.571	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.7	179.4	50.9	0	0	0	0	111.1
559	N	75.9	Confident	80.5	Confident	86 Å²	86	78.3 Å²	78.3	46%	0.46	40%	0.398	S	S	.	.			trans	-74	126.2	174.6	-62.8	-72.8	0	0	0	110.7	A533 G561	A533-N559 PolarHBondContact O-N 3.34Å; A533-N559 PolarHBondContact O-ND2 3.08Å; A533-N559 VanDerWaalsContact O-ND2 3.1Å; N559-G561 PolarHBondContact O-N 3.12Å
560	E	65.6	Low	80.4	Confident	211 Å²	211	85.5 Å²	85.5	99%	0.986	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	19	-178.4	-56.5	-174.7	134.2	0	0	115.3
561	G	61.6	Low	80.5	Confident	70 Å²	70	86.3 Å²	86.3	72%	0.722	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-1.2	-172.3	0	0	0	0	0	116.3	N559	N559-G561 PolarHBondContact O-N 3.12Å
562	V	65.5	Low	80.5	Confident	46 Å²	46	79.1 Å²	79.1	28%	0.279	41%	0.411	S	S	.	.			trans	-116.7	83.9	-170.7	-172.5	0	0	0	0	111.3	A533 L564 T567	A533-V562 HydrophobicContact CB-CB 4.04Å; A533-V562 HydrophobicContact CB-CG1 4.23Å; V562-L564 HydrophobicContact CG1-CD1 3.64Å; V562-L564 HydrophobicContact CG1-CG 3.97Å; V562-L564 PolarHBondContact O-N 3.33Å; V562-T567 PolarHBondContact O-OG1 3.38Å
563	S	67.2	Low	80.5	Confident	86 Å²	86	78.9 Å²	78.9	60%	0.601	41%	0.41	S	S	*	.			trans	-71.5	114.2	173.6	174.6	0	0	0	0	111	E568	S563-E568 WeakPolarHBondContact CB-OE1 3.5Å; S563-E568 VanDerWaalsContact OG-CD 3.31Å; S563-E568 PolarHBondContact OG-OE1 2.95Å
564	L	77.3	Confident	80.8	Confident	36 Å²	36	79.7 Å²	79.7	19%	0.188	41%	0.408	C	S	.	.			trans	-142.7	149.9	175.3	-57.2	158.8	0	0	0	109.3	D530 V562 H566 T567 E568	D530-L564 HydrophobicContact CB-CD1 3.74Å; D530-L564 VanDerWaalsContact OD2-CD1 3.32Å; D530-L564 WeakPolarHBondContact OD2-CD1 3.39Å; V562-L564 HydrophobicContact CG1-CD1 3.64Å; V562-L564 HydrophobicContact CG1-CG 3.97Å; V562-L564 PolarHBondContact O-N 3.33Å; L564-H566 VanDerWaalsContact C-N 3.31Å; L564-H566 PolarHBondContact O-N 3.45Å; L564-T567 HydrophobicContact CB-CG2 4.21Å; L564-T567 WeakPolarHBondContact CB-OG1 3.41Å; L564-T567 HydrophobicContact CD1-CG2 4.01Å; L564-T567 PolarHBondContact N-OG1 3.46Å; L564-T567 PolarHBondContact O-N 3.3Å; L564-T567 PolarHBondContact O-OG1 3.46Å; L564-E568 WeakPolarHBondContact O-CG 3.31Å; L564-E568 PolarHBondContact O-N 3.28Å
565	R	80.6	Confident	81	Confident	183 Å²	183	76.8 Å²	76.8	69%	0.691	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-41.3	-176.1	-69.8	-177.2	173.6	-170.8	-2.4	112.9	I486	I486-R565 HydrophobicContact CD1-CB 4.04Å
566	H	84.4	Confident	81.3	Confident	5 Å²	5	75.3 Å²	75.3	2%	0.023	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.1	177.4	58.9	-69.3	0	0	0	114.1	C484 W511 V526 C527 G528 D530 L564 C569	C484-H566 HydrophobicContact CB-CB 3.95Å; W511-H566 AromaticContact CZ2-CE1 3.87Å; W511-H566 AromaticContact CZ2-NE2 3.95Å; V526-H566 PolarHBondContact O-CD2 3.25Å; C527-H566 CarbonylContact C-O 3.52Å; C527-H566 WeakPolarHBondContact CA-O 3.23Å; G528-H566 PolarHBondContact N-O 2.97Å; D530-H566 IonicContact OD2-CE1 3.8Å; D530-H566 IonicContact OD2-NE2 2.71Å; D530-H566 PolarHBondContact OD2-NE2 3.5Å; L564-H566 VanDerWaalsContact C-N 3.31Å; L564-H566 PolarHBondContact O-N 3.45Å; H566-C569 PolarHBondContact O-SG 2.91Å
567	T	82.4	Confident	81.7	Confident	34 Å²	34	66.4 Å²	66.4	21%	0.209	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-21.4	179.1	63.2	0	0	0	0	114.5	D530 V562 L564	D530-T567 HydrophobicContact CB-CG2 3.72Å; V562-T567 PolarHBondContact O-OG1 3.38Å; L564-T567 HydrophobicContact CB-CG2 4.21Å; L564-T567 WeakPolarHBondContact CB-OG1 3.41Å; L564-T567 HydrophobicContact CD1-CG2 4.01Å; L564-T567 PolarHBondContact N-OG1 3.46Å; L564-T567 PolarHBondContact O-N 3.3Å; L564-T567 PolarHBondContact O-OG1 3.46Å
568	E	81.8	Confident	81.9	Confident	136 Å²	136	62.5 Å²	62.5	64%	0.636	33%	0.332	S	S	*	.	S	Bend	trans	-85.6	-4.8	179.3	-70	-173.1	162.2	0	0	114.5	S563 L564	S563-E568 WeakPolarHBondContact CB-OE1 3.5Å; S563-E568 VanDerWaalsContact OG-CD 3.31Å; S563-E568 PolarHBondContact OG-OE1 2.95Å; L564-E568 WeakPolarHBondContact O-CG 3.31Å; L564-E568 PolarHBondContact O-N 3.28Å
569	C	82.8	Confident	81.7	Confident	23 Å²	23	60.3 Å²	60.3	16%	0.155	33%	0.328	C	S	.	.	S	Bend	trans	-91.8	142.9	-174.9	62.9	0	0	0	0	112.8	I486 C493 H566	I486-C569 HydrophobicContact CG2-CB 4.38Å; C493-C569 HydrophobicContact CB-CB 3.59Å; C493-C569 WeakPolarHBondContact CB-SG 3.45Å; C493-C569 WeakPolarHBondContact SG-CB 3.16Å; C493-C569 CovalentContact SG-SG 2.03Å; C493-C569 PolarHBondContact SG-SG 3.08Å; H566-C569 PolarHBondContact O-SG 2.91Å
570	E	86.5	Confident	81.9	Confident	154 Å²	154	58.5 Å²	58.5	72%	0.72	32%	0.317	S	S	*	.			trans	-75	126.1	177.6	-172.6	166.6	-179.8	0	0	110.6	G492 C493 T572	G492-E570 CarbonylContact C-O 3.5Å; G492-E570 WeakPolarHBondContact CA-O 3.49Å; C493-E570 PolarHBondContact N-O 2.96Å; E570-T572 PolarHBondContact O-N 3.35Å
571	L	88.8	Confident	82.5	Confident	40 Å²	40	53.3 Å²	53.3	21%	0.209	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-73.3	109.7	-176.1	-74	173.3	0	0	0	111.7	C527 T604	C527-L571 HydrophobicContact CB-CD2 3.4Å; C527-L571 VanDerWaalsContact CB-CD2 3.4Å; L571-T604 HydrophobicContact CD1-CG2 4.03Å
572	T	87.7	Confident	83.3	Confident	24 Å²	24	50.5 Å²	50.5	15%	0.147	26%	0.264	C	S	.	.	S	Bend	trans	-78.8	-37.2	174.5	68	0	0	0	0	111.4	P427 L429 C493 E570	P427-T572 PolarHBondContact O-OG1 2.9Å; P427-T572 VanDerWaalsContact O-OG1 3.1Å; L429-T572 HydrophobicContact CD1-CG2 4.25Å; L429-T572 HydrophobicContact CD2-CG2 3.9Å; L429-T572 HydrophobicContact CG-CG2 4.26Å; C493-T572 PolarHBondContact O-N 3.33Å; C493-T572 PolarHBondContact O-OG1 3.48Å; E570-T572 PolarHBondContact O-N 3.35Å
573	G	90.2	Very high	84.2	Confident	2 Å²	2	50.9 Å²	50.9	2%	0.021	26%	0.262	C	S	.	.			trans	-112.1	141.5	179.6	0	0	0	0	0	113.5	T587	G573-T587 CarbonylContact C-O 3.51Å; G573-T587 VanDerWaalsContact CA-O 3.31Å; G573-T587 WeakPolarHBondContact CA-O 3.48Å
574	R	93.6	Very high	85.3	Confident	62 Å²	62	47.6 Å²	47.6	23%	0.234	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	163.5	172.2	-67.6	-173.5	175.3	-91.4	12	111.5	C576 I586 T587 F599 H600 E601 A603	R574-C576 PolarHBondContact O-N 2.98Å; R574-I586 WeakPolarHBondContact O-CA 3.32Å; R574-T587 PolarHBondContact N-O 3.1Å; R574-T587 PolarHBondContact O-N 3.18Å; R574-F599 HydrophobicContact CB-CE1 4.45Å; R574-F599 HydrophobicContact CB-CE2 3.88Å; R574-F599 HydrophobicContact CB-CZ 3.68Å; R574-F599 HydrophobicContact CG-CZ 4.18Å; R574-H600 WeakPolarHBondContact CD-O 3.43Å; R574-E601 PolarHBondContact NH1-O 3.26Å; R574-E601 PolarHBondContact NH2-O 3.23Å; R574-A603 PolarHBondContact NH1-O 3.27Å
575	P	94.6	Very high	86	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	122.3	178.1	-27.8	38	0	0	0	113.6	H600 A603 L605 V609	P575-H600 PolarHBondContact O-N 3.28Å; P575-A603 HydrophobicContact CB-CB 4.42Å; P575-A603 WeakPolarHBondContact CD-O 3.43Å; P575-A603 HydrophobicContact CG-CB 3.85Å; P575-L605 VanDerWaalsContact CG-C 3.46Å; P575-L605 WeakPolarHBondContact CG-O 3.18Å; P575-V609 HydrophobicContact CB-CG1 4.24Å; P575-V609 HydrophobicContact CB-CG2 3.96Å
576	C	93.8	Very high	86.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.1	169.4	176.2	0	0	0	0	109.9	R574 I578 C584 R585 T587 C592 Y598 F599	R574-C576 PolarHBondContact O-N 2.98Å; C576-I578 HydrophobicContact CB-CG1 4.45Å; C576-I578 WeakPolarHBondContact SG-CG1 3.39Å; C576-C584 WeakPolarHBondContact O-CA 3.39Å; C576-R585 PolarHBondContact N-O 3.14Å; C576-R585 PolarHBondContact O-N 3.43Å; C576-T587 HydrophobicContact CB-CG2 3.4Å; C576-C592 HydrophobicContact CB-CB 3.75Å; C576-C592 WeakPolarHBondContact CB-SG 3.45Å; C576-C592 WeakPolarHBondContact SG-CA 3.33Å; C576-C592 WeakPolarHBondContact SG-CB 3.5Å; C576-C592 CovalentContact SG-SG 2.03Å; C576-C592 PolarHBondContact SG-SG 3.44Å; C576-Y598 CarbonylContact C-O 3.53Å; C576-Y598 WeakPolarHBondContact CA-O 3.22Å; C576-F599 HydrophobicContact CB-CD2 4.46Å
577	C	92.5	Very high	86.9	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.2	177.5	-65.5	0	0	0	0	111.4	E583 G597 Y598 C611	C577-E583 CarbonylContact C-O 3.47Å; C577-E583 WeakPolarHBondContact CA-O 3.29Å; C577-G597 CarbonylContact O-C 3.44Å; C577-G597 WeakPolarHBondContact O-CA 3.26Å; C577-Y598 HydrophobicContact CB-CD2 4.48Å; C577-Y598 PolarHBondContact N-O 3.27Å; C577-Y598 PolarHBondContact O-N 3.08Å; C577-C611 WeakPolarHBondContact CA-SG 3.43Å; C577-C611 HydrophobicContact CB-CB 3.42Å; C577-C611 VanDerWaalsContact CB-CB 3.42Å; C577-C611 WeakPolarHBondContact CB-SG 3.29Å; C577-C611 WeakPolarHBondContact SG-CA 3.23Å; C577-C611 WeakPolarHBondContact SG-CB 3.35Å; C577-C611 CovalentContact SG-SG 2.03Å; C577-C611 PolarHBondContact SG-SG 3.37Å
578	I	87.2	Confident	87.3	Confident	21 Å²	21	39.4 Å²	39.4	11%	0.108	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.8	-167.2	-52.6	171.5	0	0	0	111.1	C576 E583 Y591 V595	C576-I578 HydrophobicContact CB-CG1 4.45Å; C576-I578 WeakPolarHBondContact SG-CG1 3.39Å; I578-E583 PolarHBondContact N-O 2.86Å; I578-E583 WeakPolarHBondContact O-CB 3.37Å; I578-E583 PolarHBondContact O-N 3.46Å; I578-Y591 HydrophobicContact CD1-CE1 3.66Å; I578-V595 HydrophobicContact CD1-CG2 4.11Å; I578-V595 HydrophobicContact CG1-CG2 4.1Å; I578-V595 HydrophobicContact CG2-CG2 4.09Å
579	G	76.7	Confident	87.8	Confident	47 Å²	47	37.7 Å²	37.7	49%	0.485	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	174.8	169.6	0	0	0	0	0	115.5	Q581 V615	G579-Q581 VanDerWaalsContact C-N 3.26Å; G579-Q581 PolarHBondContact O-N 3.13Å; G579-V615 WeakPolarHBondContact O-CG2 3.46Å
580	I	79.2	Confident	88.2	Confident	47 Å²	47	38.7 Å²	38.7	24%	0.241	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-6.7	-179.2	63.8	171.8	0	0	0	114	Y448 A449 V452 Y458	Y448-I580 HydrophobicContact CD1-CD1 4.32Å; Y448-I580 HydrophobicContact CD1-CG2 4.4Å; Y448-I580 HydrophobicContact CE1-CD1 3.96Å; A449-I580 HydrophobicContact CB-CG2 4.15Å; V452-I580 HydrophobicContact CG2-CG2 4.35Å; Y458-I580 WeakPolarHBondContact CE1-O 3.18Å; Y458-I580 HydrophobicContact CE2-CD1 4.49Å; Y458-I580 VanDerWaalsContact CZ-O 3.3Å; Y458-I580 PolarHBondContact OH-O 3.42Å
581	Q	77.4	Confident	88.5	Confident	103 Å²	103	31.9 Å²	31.9	48%	0.481	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-15.5	178.4	-59.4	-171.1	19.9	0	0	112.5	G579	G579-Q581 VanDerWaalsContact C-N 3.26Å; G579-Q581 PolarHBondContact O-N 3.13Å
582	G	79.4	Confident	88.6	Confident	10 Å²	10	30 Å²	30	10%	0.103	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	46	-171.3	0	0	0	0	0	111.6	C611	G582-C611 VanDerWaalsContact O-CB 3.28Å; G582-C611 WeakPolarHBondContact O-CB 3.2Å
583	E	84.6	Confident	88.9	Confident	54 Å²	54	33.2 Å²	33.2	25%	0.252	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	147.7	173.6	-163.8	-171.9	149.8	0	0	109.7	C577 I578 R585	C577-E583 CarbonylContact C-O 3.47Å; C577-E583 WeakPolarHBondContact CA-O 3.29Å; I578-E583 PolarHBondContact N-O 2.86Å; I578-E583 WeakPolarHBondContact O-CB 3.37Å; I578-E583 PolarHBondContact O-N 3.46Å; E583-R585 IonicContact OE1-CZ 2.71Å; E583-R585 IonicContact OE1-NE 3.85Å; E583-R585 PolarHBondContact OE1-NE 3.06Å; E583-R585 IonicContact OE1-NH2 3.72Å; E583-R585 PolarHBondContact OE1-NH2 3.17Å; E583-R585 IonicContact OE2-NH2 3.37Å
584	C	90.9	Very high	88.9	Confident	18 Å²	18	34.3 Å²	34.3	12%	0.122	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	132.1	175.9	-171.9	0	0	0	0	110.8	C576 C606 C611	C576-C584 WeakPolarHBondContact O-CA 3.39Å; C584-C606 VanDerWaalsContact C-SG 3.54Å; C584-C606 HydrophobicContact CB-CB 3.68Å; C584-C606 WeakPolarHBondContact CB-SG 3.41Å; C584-C606 WeakPolarHBondContact SG-CA 3.25Å; C584-C606 WeakPolarHBondContact SG-CB 3.41Å; C584-C606 CovalentContact SG-SG 2.04Å; C584-C606 PolarHBondContact SG-SG 3.32Å; C584-C611 VanDerWaalsContact CB-SG 3.57Å
585	R	90.3	Very high	88.5	Confident	34 Å²	34	32.3 Å²	32.3	13%	0.128	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.9	169.6	-61.3	-167.7	-167.5	173.3	11.9	110.9	F239 D240 F241 C576 E583 T587	F239-R585 PolarHBondContact O-NH2 3.3Å; D240-R585 IonicContact OD1-CZ 3.87Å; D240-R585 VanDerWaalsContact OD1-CZ 3.23Å; D240-R585 IonicContact OD1-NE 3.48Å; D240-R585 IonicContact OD1-NH1 3.58Å; D240-R585 PolarHBondContact OD1-NH1 2.95Å; D240-R585 IonicContact OD1-NH2 2.78Å; F241-R585 PolarHBondContact O-NH1 3.33Å; C576-R585 PolarHBondContact N-O 3.14Å; C576-R585 PolarHBondContact O-N 3.43Å; E583-R585 IonicContact OE1-CZ 2.71Å; E583-R585 IonicContact OE1-NE 3.85Å; E583-R585 PolarHBondContact OE1-NE 3.06Å; E583-R585 IonicContact OE1-NH2 3.72Å; E583-R585 PolarHBondContact OE1-NH2 3.17Å; E583-R585 IonicContact OE2-NH2 3.37Å; R585-T587 PolarHBondContact O-N 2.62Å
586	I	91.9	Very high	88.1	Confident	38 Å²	38	37 Å²	37	20%	0.195	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	113.5	171.9	-60.1	-178.9	0	0	0	107.6	V494 Q495 R574	V494-I586 HydrophobicContact CG2-CG2 4.15Å; Q495-I586 HydrophobicContact CB-CD1 3.91Å; Q495-I586 HydrophobicContact CG-CD1 4.24Å; R574-I586 WeakPolarHBondContact O-CA 3.32Å
587	T	91.9	Very high	87.8	Confident	4 Å²	4	37.9 Å²	37.9	3%	0.025	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	174.7	-165.8	-163.9	0	0	0	0	113	G573 R574 C576 R585 Y591 F599	G573-T587 CarbonylContact C-O 3.51Å; G573-T587 VanDerWaalsContact CA-O 3.31Å; G573-T587 WeakPolarHBondContact CA-O 3.48Å; R574-T587 PolarHBondContact N-O 3.1Å; R574-T587 PolarHBondContact O-N 3.18Å; C576-T587 HydrophobicContact CB-CG2 3.4Å; R585-T587 PolarHBondContact O-N 2.62Å; T587-Y591 HydrophobicContact CG2-CD1 3.6Å; T587-Y591 HydrophobicContact CG2-CE1 4.28Å; T587-Y591 WeakPolarHBondContact OG1-CD1 3.42Å; T587-F599 WeakPolarHBondContact O-CE2 3.28Å
588	T	92.5	Very high	87.8	Confident	9 Å²	9	41.6 Å²	41.6	6%	0.055	21%	0.21	C	C	.	.			trans	-76.6	149.6	178.5	63.1	0	0	0	0	111.6	L425 Q426 P427 E590 Y591 C592	L425-T588 WeakPolarHBondContact O-CB 3.32Å; L425-T588 WeakPolarHBondContact O-CG2 3.31Å; L425-T588 PolarHBondContact O-OG1 3.1Å; Q426-T588 VanDerWaalsContact C-CG2 3.49Å; P427-T588 HydrophobicContact CG-CG2 4.18Å; T588-E590 PolarHBondContact O-N 3.2Å; T588-Y591 PolarHBondContact O-N 3.34Å; T588-Y591 PolarHBondContact OG1-N 3.26Å; T588-C592 PolarHBondContact O-N 3.31Å
589	R	92.4	Very high	88.1	Confident	100 Å²	100	42.5 Å²	42.5	38%	0.377	21%	0.214	S	C	.	.	H	α-helix	trans	-51.2	-45.5	173.4	164.6	167.2	-93.6	150.9	-5.1	111.1	Y591 C592 D593 F599 E601	R589-Y591 VanDerWaalsContact C-N 3.29Å; R589-Y591 PolarHBondContact O-N 3.44Å; R589-C592 WeakPolarHBondContact O-CA 3.46Å; R589-C592 WeakPolarHBondContact O-CB 3.35Å; R589-C592 PolarHBondContact O-N 3.49Å; R589-D593 WeakPolarHBondContact CG-OD2 3.45Å; R589-D593 PolarHBondContact O-N 3.03Å; R589-F599 VanDerWaalsContact CA-CE2 3.48Å; R589-F599 HydrophobicContact CB-CD1 4Å; R589-F599 HydrophobicContact CB-CD2 4.2Å; R589-F599 HydrophobicContact CB-CE1 3.76Å; R589-F599 HydrophobicContact CB-CE2 3.98Å; R589-F599 HydrophobicContact CB-CG 4.2Å; R589-F599 HydrophobicContact CB-CZ 3.73Å; R589-F599 HydrophobicContact CG-CD1 4.38Å; R589-F599 VanDerWaalsContact N-CE2 3.33Å; R589-E601 VanDerWaalsContact CZ-CD 3.49Å; R589-E601 IonicContact CZ-OE1 3.67Å; R589-E601 IonicContact CZ-OE2 3.41Å; R589-E601 IonicContact NH1-OE1 2.72Å; R589-E601 PolarHBondContact NH1-OE1 2.95Å; R589-E601 IonicContact NH1-OE2 3.62Å; R589-E601 PolarHBondContact NH1-OE2 3.15Å; R589-E601 IonicContact NH2-OE1 3.98Å; R589-E601 IonicContact NH2-OE2 2.75Å; R589-E601 PolarHBondContact NH2-OE2 2.94Å
590	E	90.4	Very high	88.9	Confident	45 Å²	45	41.1 Å²	41.1	21%	0.21	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-27	-174	-52.2	-168.5	146.2	0	0	113.2	T247 V424 T588 F594	T247-E590 WeakPolarHBondContact CA-OE1 3.31Å; T247-E590 WeakPolarHBondContact CG2-OE1 3.15Å; V424-E590 HydrophobicContact CB-CB 4.37Å; V424-E590 HydrophobicContact CG1-CB 4.32Å; V424-E590 HydrophobicContact CG2-CB 3.13Å; V424-E590 HydrophobicContact CG2-CG 4.05Å; V424-E590 WeakPolarHBondContact CG2-OE2 3.19Å; T588-E590 PolarHBondContact O-N 3.2Å; E590-F594 WeakPolarHBondContact O-CB 3.38Å; E590-F594 PolarHBondContact O-N 2.87Å
591	Y	91.9	Very high	89.5	Confident	11 Å²	11	44 Å²	44	4%	0.043	21%	0.207	C	C	.	.	H	α-helix	trans	-72.7	-45.1	166.4	169	-124	0	0	0	111.8	P243 I578 T587 T588 R589 D593 F594 V595	P243-Y591 HydrophobicContact CB-CD1 4.32Å; P243-Y591 HydrophobicContact CB-CD2 3.43Å; P243-Y591 VanDerWaalsContact CB-CD2 3.43Å; P243-Y591 HydrophobicContact CB-CE2 3.91Å; P243-Y591 HydrophobicContact CB-CG 3.61Å; P243-Y591 HydrophobicContact CG-CD1 3.6Å; P243-Y591 HydrophobicContact CG-CD2 3.49Å; P243-Y591 VanDerWaalsContact CG-CD2 3.49Å; P243-Y591 HydrophobicContact CG-CE1 3.79Å; P243-Y591 HydrophobicContact CG-CE2 3.68Å; P243-Y591 HydrophobicContact CG-CG 3.4Å; P243-Y591 WeakPolarHBondContact O-CD2 3.4Å; P243-Y591 WeakPolarHBondContact O-CE2 3.27Å; I578-Y591 HydrophobicContact CD1-CE1 3.66Å; T587-Y591 HydrophobicContact CG2-CD1 3.6Å; T587-Y591 HydrophobicContact CG2-CE1 4.28Å; T587-Y591 WeakPolarHBondContact OG1-CD1 3.42Å; T588-Y591 PolarHBondContact O-N 3.34Å; T588-Y591 PolarHBondContact OG1-N 3.26Å; R589-Y591 VanDerWaalsContact C-N 3.29Å; R589-Y591 PolarHBondContact O-N 3.44Å; Y591-D593 VanDerWaalsContact C-N 3.28Å; Y591-D593 PolarHBondContact O-N 3.34Å; Y591-F594 HydrophobicContact CD2-CD1 4.29Å; Y591-F594 WeakPolarHBondContact O-CB 3.42Å; Y591-F594 PolarHBondContact O-N 3.07Å; Y591-V595 HydrophobicContact CD2-CG1 3.88Å; Y591-V595 HydrophobicContact CE2-CB 4.38Å; Y591-V595 HydrophobicContact CE2-CG1 3.26Å; Y591-V595 HydrophobicContact CE2-CG2 4.24Å; Y591-V595 PolarHBondContact O-N 2.84Å
592	C	92.7	Very high	90	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.6	-43.6	-179.3	-158.5	0	0	0	0	111.6	C576 T588 R589 R596 G597 Y598 F599	C576-C592 HydrophobicContact CB-CB 3.75Å; C576-C592 WeakPolarHBondContact CB-SG 3.45Å; C576-C592 WeakPolarHBondContact SG-CA 3.33Å; C576-C592 WeakPolarHBondContact SG-CB 3.5Å; C576-C592 CovalentContact SG-SG 2.03Å; C576-C592 PolarHBondContact SG-SG 3.44Å; T588-C592 PolarHBondContact O-N 3.31Å; R589-C592 WeakPolarHBondContact O-CA 3.46Å; R589-C592 WeakPolarHBondContact O-CB 3.35Å; R589-C592 PolarHBondContact O-N 3.49Å; C592-R596 WeakPolarHBondContact O-CA 3.23Å; C592-R596 PolarHBondContact O-N 3.37Å; C592-G597 PolarHBondContact O-N 2.85Å; C592-Y598 VanDerWaalsContact SG-C 3.51Å; C592-F599 HydrophobicContact CB-CB 4.02Å; C592-F599 HydrophobicContact CB-CD2 3.81Å; C592-F599 HydrophobicContact CB-CG 4.33Å
593	D	92.3	Very high	90.6	Very high	92 Å²	92	43.9 Å²	43.9	49%	0.492	20%	0.204	S	C	.	.	H	α-helix	trans	-62.8	-40.4	174.4	-65.5	-26.1	0	0	0	111.8	R589 Y591 R596	R589-D593 WeakPolarHBondContact CG-OD2 3.45Å; R589-D593 PolarHBondContact O-N 3.03Å; Y591-D593 VanDerWaalsContact C-N 3.28Å; Y591-D593 PolarHBondContact O-N 3.34Å; D593-R596 PolarHBondContact O-N 3.47Å; D593-R596 VanDerWaalsContact O-N 3.14Å
594	F	89.9	Confident	90.9	Very high	25 Å²	25	42 Å²	42	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-47.9	179.3	174.2	-107.3	0	0	0	113.1	S245 A422 V434 Y436 E590 Y591 R596	S245-F594 WeakPolarHBondContact O-CB 3.25Å; S245-F594 WeakPolarHBondContact O-CD2 3.47Å; S245-F594 WeakPolarHBondContact O-CG 3.29Å; A422-F594 HydrophobicContact CB-CE2 4.14Å; V434-F594 HydrophobicContact CB-CE1 4.47Å; V434-F594 HydrophobicContact CG1-CE1 3.56Å; V434-F594 HydrophobicContact CG1-CZ 4.1Å; Y436-F594 HydrophobicContact CD1-CD1 4.04Å; Y436-F594 AromaticContact CD1-CE1 3.43Å; Y436-F594 HydrophobicContact CD1-CE1 3.43Å; Y436-F594 VanDerWaalsContact CD1-CE1 3.43Å; Y436-F594 AromaticContact CD1-CZ 3.76Å; Y436-F594 HydrophobicContact CD1-CZ 3.76Å; Y436-F594 HydrophobicContact CE1-CD1 4.01Å; Y436-F594 HydrophobicContact CE1-CD2 4.45Å; Y436-F594 AromaticContact CE1-CE1 3.72Å; Y436-F594 HydrophobicContact CE1-CE1 3.72Å; Y436-F594 HydrophobicContact CE1-CE2 4.22Å; Y436-F594 HydrophobicContact CE1-CG 4.37Å; Y436-F594 AromaticContact CE1-CZ 3.85Å; Y436-F594 HydrophobicContact CE1-CZ 3.85Å; Y436-F594 WeakPolarHBondContact CE1-O 3.27Å; Y436-F594 VanDerWaalsContact CZ-O 3.3Å; Y436-F594 PolarHBondContact OH-O 3.16Å; E590-F594 WeakPolarHBondContact O-CB 3.38Å; E590-F594 PolarHBondContact O-N 2.87Å; Y591-F594 HydrophobicContact CD2-CD1 4.29Å; Y591-F594 WeakPolarHBondContact O-CB 3.42Å; Y591-F594 PolarHBondContact O-N 3.07Å; F594-R596 PolarHBondContact O-N 3.31Å
595	V	85.4	Confident	90.9	Very high	19 Å²	19	41.1 Å²	41.1	12%	0.115	19%	0.19	C	C	.	.	H	α-helix	trans	-79	-2.6	173.5	-61.2	0	0	0	0	113.4	Y436 I578 Y591 G597	Y436-V595 HydrophobicContact CD1-CG1 4.06Å; Y436-V595 HydrophobicContact CE1-CG1 4.34Å; Y436-V595 HydrophobicContact CG-CG1 4.29Å; I578-V595 HydrophobicContact CD1-CG2 4.11Å; I578-V595 HydrophobicContact CG1-CG2 4.1Å; I578-V595 HydrophobicContact CG2-CG2 4.09Å; Y591-V595 HydrophobicContact CD2-CG1 3.88Å; Y591-V595 HydrophobicContact CE2-CB 4.38Å; Y591-V595 HydrophobicContact CE2-CG1 3.26Å; Y591-V595 HydrophobicContact CE2-CG2 4.24Å; Y591-V595 PolarHBondContact O-N 2.84Å; V595-G597 VanDerWaalsContact C-N 3.33Å; V595-G597 PolarHBondContact O-N 2.84Å
596	R	87.4	Confident	91	Very high	98 Å²	98	40.8 Å²	40.8	37%	0.37	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	43.8	-178.1	-50	173.9	-172.7	145.4	0.5	112.7	E438 C592 D593 F594	E438-R596 IonicContact OE1-NH1 3.16Å; E438-R596 PolarHBondContact OE1-NH1 3.13Å; E438-R596 IonicContact OE2-CZ 3.5Å; E438-R596 IonicContact OE2-NH1 3.54Å; E438-R596 PolarHBondContact OE2-NH1 2.88Å; C592-R596 WeakPolarHBondContact O-CA 3.23Å; C592-R596 PolarHBondContact O-N 3.37Å; D593-R596 PolarHBondContact O-N 3.47Å; D593-R596 VanDerWaalsContact O-N 3.14Å; F594-R596 PolarHBondContact O-N 3.31Å
597	G	88.1	Confident	90.9	Very high	19 Å²	19	40 Å²	40	20%	0.196	19%	0.191	C	C	.	.			trans	-82.7	-171.7	169	0	0	0	0	0	112.6	C577 C592 V595	C577-G597 CarbonylContact O-C 3.44Å; C577-G597 WeakPolarHBondContact O-CA 3.26Å; C592-G597 PolarHBondContact O-N 2.85Å; V595-G597 VanDerWaalsContact C-N 3.33Å; V595-G597 PolarHBondContact O-N 2.84Å
598	Y	91	Very high	90.8	Very high	79 Å²	79	41.2 Å²	41.2	31%	0.31	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.4	175.4	-55.6	-94.3	0	0	0	109.7	H453 C576 C577 C592 E614	H453-Y598 PolarHBondContact ND1-OH 3.24Å; H453-Y598 VanDerWaalsContact ND1-OH 3.11Å; C576-Y598 CarbonylContact C-O 3.53Å; C576-Y598 WeakPolarHBondContact CA-O 3.22Å; C577-Y598 HydrophobicContact CB-CD2 4.48Å; C577-Y598 PolarHBondContact N-O 3.27Å; C577-Y598 PolarHBondContact O-N 3.08Å; C592-Y598 VanDerWaalsContact SG-C 3.51Å; Y598-E614 HydrophobicContact CD2-CB 4.01Å; Y598-E614 HydrophobicContact CE2-CB 4.31Å; Y598-E614 HydrophobicContact CG-CB 4.14Å
599	F	93.8	Very high	90.7	Very high	40 Å²	40	41.9 Å²	41.9	18%	0.175	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.3	-175.6	-172.6	-101.9	0	0	0	111.6	R574 C576 T587 R589 C592 E601	R574-F599 HydrophobicContact CB-CE1 4.45Å; R574-F599 HydrophobicContact CB-CE2 3.88Å; R574-F599 HydrophobicContact CB-CZ 3.68Å; R574-F599 HydrophobicContact CG-CZ 4.18Å; C576-F599 HydrophobicContact CB-CD2 4.46Å; T587-F599 WeakPolarHBondContact O-CE2 3.28Å; R589-F599 VanDerWaalsContact CA-CE2 3.48Å; R589-F599 HydrophobicContact CB-CD1 4Å; R589-F599 HydrophobicContact CB-CD2 4.2Å; R589-F599 HydrophobicContact CB-CE1 3.76Å; R589-F599 HydrophobicContact CB-CE2 3.98Å; R589-F599 HydrophobicContact CB-CG 4.2Å; R589-F599 HydrophobicContact CB-CZ 3.73Å; R589-F599 HydrophobicContact CG-CD1 4.38Å; R589-F599 VanDerWaalsContact N-CE2 3.33Å; C592-F599 HydrophobicContact CB-CB 4.02Å; C592-F599 HydrophobicContact CB-CD2 3.81Å; C592-F599 HydrophobicContact CB-CG 4.33Å; F599-E601 HydrophobicContact CD1-CG 3.93Å; F599-E601 HydrophobicContact CE1-CG 3.79Å
600	H	93.7	Very high	90.5	Very high	18 Å²	18	38.4 Å²	38.4	8%	0.083	19%	0.191	C	C	.	.			trans	-100.2	110.2	-178	-67.5	-86.9	0	0	0	111.3	R574 P575 E602 A603 V609	R574-H600 WeakPolarHBondContact CD-O 3.43Å; P575-H600 PolarHBondContact O-N 3.28Å; H600-E602 IonicContact CE1-OE1 2.91Å; H600-E602 IonicContact CG-OE1 2.69Å; H600-E602 IonicContact ND1-OE1 3.22Å; H600-E602 PolarHBondContact ND1-OE1 3.48Å; H600-A603 HydrophobicContact CB-CB 3.87Å; H600-V609 HydrophobicContact CB-CG1 3.96Å
601	E	90.9	Very high	90.4	Very high	107 Å²	107	36.6 Å²	36.6	50%	0.5	18%	0.183	S	C	.	.	S	Bend	trans	-80	-21	177.5	-76.8	-175.6	114.5	0	0	112.9	R574 R589 F599	R574-E601 PolarHBondContact NH1-O 3.26Å; R574-E601 PolarHBondContact NH2-O 3.23Å; R589-E601 VanDerWaalsContact CZ-CD 3.49Å; R589-E601 IonicContact CZ-OE1 3.67Å; R589-E601 IonicContact CZ-OE2 3.41Å; R589-E601 IonicContact NH1-OE1 2.72Å; R589-E601 PolarHBondContact NH1-OE1 2.95Å; R589-E601 IonicContact NH1-OE2 3.62Å; R589-E601 PolarHBondContact NH1-OE2 3.15Å; R589-E601 IonicContact NH2-OE1 3.98Å; R589-E601 IonicContact NH2-OE2 2.75Å; R589-E601 PolarHBondContact NH2-OE2 2.94Å; F599-E601 HydrophobicContact CD1-CG 3.93Å; F599-E601 HydrophobicContact CE1-CG 3.79Å
602	E	88.5	Confident	90.2	Very high	112 Å²	112	36.9 Å²	36.9	52%	0.523	19%	0.185	S	C	.	.	S	Bend	trans	-84.4	-16.2	179.9	70.6	-75.8	-178.5	0	0	113.6	L554 H600	L554-E602 HydrophobicContact CD2-CG 4.5Å; L554-E602 WeakPolarHBondContact CD2-O 3.31Å; H600-E602 IonicContact CE1-OE1 2.91Å; H600-E602 IonicContact CG-OE1 2.69Å; H600-E602 IonicContact ND1-OE1 3.22Å; H600-E602 PolarHBondContact ND1-OE1 3.48Å
603	A	91.4	Very high	89.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.			trans	-107.3	153.8	-172.6	0	0	0	0	0	113.3	L554 R574 P575 H600 Q608 V609	L554-A603 HydrophobicContact CD2-CB 3.82Å; R574-A603 PolarHBondContact NH1-O 3.27Å; P575-A603 HydrophobicContact CB-CB 4.42Å; P575-A603 WeakPolarHBondContact CD-O 3.43Å; P575-A603 HydrophobicContact CG-CB 3.85Å; H600-A603 HydrophobicContact CB-CB 3.87Å; A603-Q608 HydrophobicContact CB-CB 4.46Å; A603-V609 HydrophobicContact CB-CG1 3.64Å
604	T	90.8	Very high	89.7	Confident	14 Å²	14	36.7 Å²	36.7	9%	0.086	19%	0.185	C	C	.	.	S	Bend	trans	-118.5	-31.3	174.9	53.5	0	0	0	0	112	Q529 L571 Q608	Q529-T604 HydrophobicContact CB-CG2 4.39Å; Q529-T604 PolarHBondContact OE1-OG1 3.47Å; L571-T604 HydrophobicContact CD1-CG2 4.03Å; T604-Q608 PolarHBondContact OG1-NE2 2.87Å; T604-Q608 PolarHBondContact OG1-OE1 2.65Å
605	L	92.5	Very high	89.5	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	-117.3	145.3	-177.4	-62.7	175.9	0	0	0	111.6	E479 Q495 V526 W552 P575 S607 Q608	E479-L605 HydrophobicContact CG-CD2 4.03Å; Q495-L605 HydrophobicContact CG-CD2 4.02Å; V526-L605 HydrophobicContact CG1-CD1 4.38Å; V526-L605 HydrophobicContact CG1-CD2 3.93Å; V526-L605 HydrophobicContact CG1-CG 4.05Å; V526-L605 HydrophobicContact CG2-CD1 4.28Å; V526-L605 HydrophobicContact CG2-CD2 4.45Å; W552-L605 HydrophobicContact CB-CD1 4.46Å; P575-L605 VanDerWaalsContact CG-C 3.46Å; P575-L605 WeakPolarHBondContact CG-O 3.18Å; L605-S607 VanDerWaalsContact C-N 3.28Å; L605-S607 PolarHBondContact O-N 3Å; L605-Q608 HydrophobicContact CB-CG 4.04Å; L605-Q608 VanDerWaalsContact N-OE1 3.14Å; L605-Q608 WeakPolarHBondContact O-CB 3.3Å; L605-Q608 PolarHBondContact O-N 3.3Å; L605-Q608 VanDerWaalsContact O-N 3.15Å
606	C	92	Very high	89.6	Confident	26 Å²	26	35 Å²	35	18%	0.176	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-65.9	-27.3	174.3	-84.5	0	0	0	0	112.9	E479 C584 Q608 V609	E479-C606 WeakPolarHBondContact OE2-CA 3.28Å; E479-C606 WeakPolarHBondContact OE2-CB 3.44Å; E479-C606 PolarHBondContact OE2-N 3.01Å; C584-C606 VanDerWaalsContact C-SG 3.54Å; C584-C606 HydrophobicContact CB-CB 3.68Å; C584-C606 WeakPolarHBondContact CB-SG 3.41Å; C584-C606 WeakPolarHBondContact SG-CA 3.25Å; C584-C606 WeakPolarHBondContact SG-CB 3.41Å; C584-C606 CovalentContact SG-SG 2.04Å; C584-C606 PolarHBondContact SG-SG 3.32Å; C606-Q608 PolarHBondContact O-N 3.5Å; C606-V609 WeakPolarHBondContact O-CG2 3.46Å; C606-V609 PolarHBondContact O-N 2.96Å
607	S	90.3	Very high	89	Confident	23 Å²	23	31.6 Å²	31.6	16%	0.161	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-65	-19.3	170.9	51.5	0	0	0	0	114.9	E479 T550 L605	E479-S607 WeakPolarHBondContact OE1-CB 3.49Å; E479-S607 PolarHBondContact OE1-N 3.43Å; E479-S607 VanDerWaalsContact OE1-N 3.09Å; E479-S607 PolarHBondContact OE1-OG 3.46Å; E479-S607 PolarHBondContact OE2-N 3.07Å; T550-S607 WeakPolarHBondContact O-CB 3.19Å; L605-S607 VanDerWaalsContact C-N 3.28Å; L605-S607 PolarHBondContact O-N 3Å
608	Q	89.5	Confident	88.4	Confident	28 Å²	28	32.1 Å²	32.1	13%	0.131	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-80.6	-19.1	-179.9	-67.2	166.6	-9.7	0	0	113.2	L554 A603 T604 L605 C606	L554-Q608 HydrophobicContact CD2-CB 3.74Å; L554-Q608 HydrophobicContact CD2-CG 4.17Å; L554-Q608 HydrophobicContact CG-CB 3.96Å; L554-Q608 HydrophobicContact CG-CG 4.32Å; A603-Q608 HydrophobicContact CB-CB 4.46Å; T604-Q608 PolarHBondContact OG1-NE2 2.87Å; T604-Q608 PolarHBondContact OG1-OE1 2.65Å; L605-Q608 HydrophobicContact CB-CG 4.04Å; L605-Q608 VanDerWaalsContact N-OE1 3.14Å; L605-Q608 WeakPolarHBondContact O-CB 3.3Å; L605-Q608 PolarHBondContact O-N 3.3Å; L605-Q608 VanDerWaalsContact O-N 3.15Å; C606-Q608 PolarHBondContact O-N 3.5Å
609	V	89.7	Confident	87.9	Confident	24 Å²	24	31.3 Å²	31.3	15%	0.145	17%	0.173	C	C	.	.			trans	-109.3	158.9	-176.2	-61.9	0	0	0	0	111.4	P575 H600 A603 C606	P575-V609 HydrophobicContact CB-CG1 4.24Å; P575-V609 HydrophobicContact CB-CG2 3.96Å; H600-V609 HydrophobicContact CB-CG1 3.96Å; A603-V609 HydrophobicContact CB-CG1 3.64Å; C606-V609 WeakPolarHBondContact O-CG2 3.46Å; C606-V609 PolarHBondContact O-N 2.96Å
610	S	87.8	Confident	87.3	Confident	27 Å²	27	33.8 Å²	33.8	19%	0.189	19%	0.193	C	C	.	.			trans	-122	81.4	175	-172.7	0	0	0	0	110	L612 G613 E614 S624	S610-L612 PolarHBondContact O-N 2.84Å; S610-G613 VanDerWaalsContact O-CA 3.28Å; S610-G613 WeakPolarHBondContact O-CA 3.09Å; S610-G613 PolarHBondContact O-N 3.11Å; S610-E614 PolarHBondContact O-N 3.06Å; S610-S624 WeakPolarHBondContact CB-OG 3.17Å; S610-S624 PolarHBondContact OG-O 2.96Å
611	C	88.8	Confident	87	Confident	7 Å²	7	33.9 Å²	33.9	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-59	-31.6	-178.4	-62.7	0	0	0	0	113.3	C577 G582 C584 G613 E614 V615	C577-C611 WeakPolarHBondContact CA-SG 3.43Å; C577-C611 HydrophobicContact CB-CB 3.42Å; C577-C611 VanDerWaalsContact CB-CB 3.42Å; C577-C611 WeakPolarHBondContact CB-SG 3.29Å; C577-C611 WeakPolarHBondContact SG-CA 3.23Å; C577-C611 WeakPolarHBondContact SG-CB 3.35Å; C577-C611 CovalentContact SG-SG 2.03Å; C577-C611 PolarHBondContact SG-SG 3.37Å; G582-C611 VanDerWaalsContact O-CB 3.28Å; G582-C611 WeakPolarHBondContact O-CB 3.2Å; C584-C611 VanDerWaalsContact CB-SG 3.57Å; C611-G613 VanDerWaalsContact C-N 3.3Å; C611-G613 PolarHBondContact O-N 3.21Å; C611-E614 PolarHBondContact O-N 2.98Å; C611-V615 WeakPolarHBondContact O-CB 3.36Å; C611-V615 WeakPolarHBondContact O-CG2 3.43Å; C611-V615 PolarHBondContact O-N 2.81Å
612	L	87.6	Confident	86.6	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.084	21%	0.21	C	C	.	.	H	α-helix	trans	-65.8	-33	170.9	-174.8	63.3	0	0	0	111.8	P460 Y469 S610 C616 F621 P627	P460-L612 HydrophobicContact CB-CD1 4.22Å; Y469-L612 HydrophobicContact CE2-CD2 4.41Å; S610-L612 PolarHBondContact O-N 2.84Å; L612-C616 WeakPolarHBondContact O-CB 3.49Å; L612-C616 PolarHBondContact O-N 3.39Å; L612-C616 PolarHBondContact O-SG 2.87Å; L612-F621 HydrophobicContact CG-CE2 4.3Å; L612-F621 HydrophobicContact CG-CZ 4.25Å; L612-P627 HydrophobicContact CD2-CG 4.3Å
613	G	87	Confident	86.2	Confident	13 Å²	13	38.3 Å²	38.3	13%	0.134	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-51.8	172.7	0	0	0	0	0	112.3	S610 C611 C616 G617	S610-G613 VanDerWaalsContact O-CA 3.28Å; S610-G613 WeakPolarHBondContact O-CA 3.09Å; S610-G613 PolarHBondContact O-N 3.11Å; C611-G613 VanDerWaalsContact C-N 3.3Å; C611-G613 PolarHBondContact O-N 3.21Å; G613-C616 CarbonylContact O-C 3.55Å; G613-C616 PolarHBondContact O-N 3.49Å; G613-G617 WeakPolarHBondContact O-CA 3.18Å; G613-G617 PolarHBondContact O-N 3.25Å; G613-G617 VanDerWaalsContact O-N 3.08Å
614	E	86.9	Confident	85.5	Confident	76 Å²	76	42 Å²	42	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-46.2	179.5	-59.8	-51.8	144.1	0	0	112.3	H453 Y598 S610 C611 C616 G617	H453-E614 PolarHBondContact CE1-O 2.89Å; H453-E614 VanDerWaalsContact CE1-O 3.28Å; H453-E614 PolarHBondContact ND1-O 3.25Å; Y598-E614 HydrophobicContact CD2-CB 4.01Å; Y598-E614 HydrophobicContact CE2-CB 4.31Å; Y598-E614 HydrophobicContact CG-CB 4.14Å; S610-E614 PolarHBondContact O-N 3.06Å; C611-E614 PolarHBondContact O-N 2.98Å; E614-C616 PolarHBondContact O-N 2.94Å; E614-G617 PolarHBondContact O-N 3.3Å
615	V	85.5	Confident	84.7	Confident	9 Å²	9	45.5 Å²	45.5	6%	0.055	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-33.7	175.6	170.1	0	0	0	0	111.8	V452 H453 G579 C611	V452-V615 HydrophobicContact CG1-CG1 4.13Å; H453-V615 WeakPolarHBondContact CA-O 3.42Å; H453-V615 PolarHBondContact N-O 3.06Å; G579-V615 WeakPolarHBondContact O-CG2 3.46Å; C611-V615 WeakPolarHBondContact O-CB 3.36Å; C611-V615 WeakPolarHBondContact O-CG2 3.43Å; C611-V615 PolarHBondContact O-N 2.81Å
616	C	88	Confident	84.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.9	176.6	-62.9	0	0	0	0	114	C461 L612 G613 E614 M618 F621 Q629 R632	C461-C616 VanDerWaalsContact CA-SG 3.51Å; C461-C616 HydrophobicContact CB-CB 3.86Å; C461-C616 WeakPolarHBondContact CB-SG 3.3Å; C461-C616 WeakPolarHBondContact SG-CB 3.42Å; C461-C616 CovalentContact SG-SG 2.03Å; C461-C616 PolarHBondContact SG-SG 3.17Å; L612-C616 WeakPolarHBondContact O-CB 3.49Å; L612-C616 PolarHBondContact O-N 3.39Å; L612-C616 PolarHBondContact O-SG 2.87Å; G613-C616 CarbonylContact O-C 3.55Å; G613-C616 PolarHBondContact O-N 3.49Å; E614-C616 PolarHBondContact O-N 2.94Å; C616-M618 PolarHBondContact O-N 3.37Å; C616-F621 HydrophobicContact CB-CE1 3.92Å; C616-F621 HydrophobicContact CB-CZ 3.74Å; C616-Q629 PolarHBondContact O-NE2 3.31Å; C616-Q629 PolarHBondContact O-OE1 3.38Å; C616-Q629 VanDerWaalsContact O-OE1 3.06Å; C616-R632 PolarHBondContact O-NH2 3.09Å
617	G	75.8	Confident	84	Confident	25 Å²	25	47.8 Å²	47.8	26%	0.258	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	4.2	-152.8	0	0	0	0	0	121.9	G613 E614 V619	G613-G617 WeakPolarHBondContact O-CA 3.18Å; G613-G617 PolarHBondContact O-N 3.25Å; G613-G617 VanDerWaalsContact O-N 3.08Å; E614-G617 PolarHBondContact O-N 3.3Å; G617-V619 PolarHBondContact O-N 2.81Å; G617-V619 VanDerWaalsContact O-N 3.14Å
618	M	75.9	Confident	83.9	Confident	30 Å²	30	48.5 Å²	48.5	15%	0.148	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-37.7	172.3	-176.3	-174.8	54.9	0	0	114.6	H453 G455 C616 S631 R632 I635	H453-M618 WeakPolarHBondContact O-CB 3.49Å; H453-M618 PolarHBondContact O-N 3.4Å; G455-M618 VanDerWaalsContact CA-SD 3.53Å; C616-M618 PolarHBondContact O-N 3.37Å; M618-S631 WeakPolarHBondContact CE-OG 3.48Å; M618-R632 HydrophobicContact CE-CG 4.01Å; M618-I635 HydrophobicContact CE-CD1 3.9Å; M618-I635 HydrophobicContact SD-CD1 3.35Å; M618-I635 WeakPolarHBondContact SD-CD1 3.01Å; M618-I635 HydrophobicContact SD-CG1 4.49Å; M618-I635 HydrophobicContact SD-CG2 4.05Å
619	V	80.5	Confident	83.9	Confident	62 Å²	62	47.4 Å²	47.4	38%	0.376	27%	0.265	S	S	.	.	S	Bend	trans	-150.6	125	175.7	-177.8	0	0	0	0	107.8	G617 Q629	G617-V619 PolarHBondContact O-N 2.81Å; G617-V619 VanDerWaalsContact O-N 3.14Å; V619-Q629 PolarHBondContact O-NE2 3.22Å
620	P	81.3	Confident	83.9	Confident	92 Å²	92	50 Å²	50	60%	0.597	28%	0.275	S	S	*	.			trans	-61.9	140.3	177.1	26	-34.5	0	0	0	111.3
621	F	85.7	Confident	83.9	Confident	21 Å²	21	51 Å²	51	9%	0.092	28%	0.281	C	S	.	.			trans	-63.3	144.8	179.6	-53.4	-40.9	0	0	0	111.5	L612 C616 K623 P627 D628 Q629	L612-F621 HydrophobicContact CG-CE2 4.3Å; L612-F621 HydrophobicContact CG-CZ 4.25Å; C616-F621 HydrophobicContact CB-CE1 3.92Å; C616-F621 HydrophobicContact CB-CZ 3.74Å; F621-K623 WeakPolarHBondContact CB-O 3.29Å; F621-K623 PolarHBondContact O-N 2.86Å; F621-K623 VanDerWaalsContact O-N 3.11Å; F621-P627 HydrophobicContact CD1-CB 4.32Å; F621-P627 HydrophobicContact CE1-CB 3.8Å; F621-P627 HydrophobicContact CE2-CB 4.18Å; F621-P627 HydrophobicContact CZ-CB 3.74Å; F621-D628 WeakPolarHBondContact CA-OD1 3.41Å; F621-D628 WeakPolarHBondContact CD1-OD1 3.32Å; F621-Q629 HydrophobicContact CD1-CG 3.92Å; F621-Q629 HydrophobicContact CE1-CG 3.82Å
622	L	82.5	Confident	84.1	Confident	162 Å²	162	50.6 Å²	50.6	85%	0.848	28%	0.279	S	S	*	.	S	Bend	trans	-61	-21.5	176.3	-72.7	168.4	0	0	0	113.5	D628	L622-D628 WeakPolarHBondContact CB-OD2 3.37Å; L622-D628 WeakPolarHBondContact CD1-OD2 3.08Å; L622-D628 VanDerWaalsContact CG-OD2 3.23Å; L622-D628 WeakPolarHBondContact CG-OD2 3.09Å; L622-D628 PolarHBondContact N-OD2 3.2Å
623	K	80.9	Confident	84.3	Confident	149 Å²	149	50.4 Å²	50.4	65%	0.648	28%	0.278	S	S	*	.	B	Isolated β-bridge	trans	-139.7	131.9	163.9	-62	-177.2	179.1	-175	0	108	F621 E625 N626	F621-K623 WeakPolarHBondContact CB-O 3.29Å; F621-K623 PolarHBondContact O-N 2.86Å; F621-K623 VanDerWaalsContact O-N 3.11Å; K623-E625 PolarHBondContact O-N 2.72Å; K623-N626 HydrophobicContact CB-CB 4.23Å; K623-N626 PolarHBondContact O-N 2.9Å
624	S	77.7	Confident	84.6	Confident	79 Å²	79	51.8 Å²	51.8	55%	0.552	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-34.2	-173.2	-163	0	0	0	0	114.8	S610	S610-S624 WeakPolarHBondContact CB-OG 3.17Å; S610-S624 PolarHBondContact OG-O 2.96Å
625	E	73	Confident	84.9	Confident	86 Å²	86	49.3 Å²	49.3	40%	0.402	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	4	176.6	-52.6	-165	133.7	0	0	115.8	R464 Y469 R476 K623	R464-E625 VanDerWaalsContact CZ-O 3.31Å; R464-E625 IonicContact CZ-OE2 3.7Å; R464-E625 PolarHBondContact NE-O 2.95Å; R464-E625 PolarHBondContact NH2-O 2.73Å; R464-E625 IonicContact NH2-OE2 2.68Å; R464-E625 PolarHBondContact NH2-OE2 2.83Å; Y469-E625 PolarHBondContact OH-O 3Å; R476-E625 IonicContact CZ-OE1 3.62Å; R476-E625 IonicContact NH1-OE1 2.75Å; R476-E625 PolarHBondContact NH1-OE1 2.97Å; R476-E625 IonicContact NH2-OE1 3.5Å; R476-E625 PolarHBondContact NH2-OE1 3.39Å; K623-E625 PolarHBondContact O-N 2.72Å
626	N	82.9	Confident	85.3	Confident	64 Å²	64	48.9 Å²	48.9	34%	0.342	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-129.8	92.8	-172.9	-69.8	-90.1	0	0	0	111.4	R464 K623 D628	R464-N626 PolarHBondContact NE-OD1 3.31Å; R464-N626 PolarHBondContact NH2-ND2 2.91Å; K623-N626 HydrophobicContact CB-CB 4.23Å; K623-N626 PolarHBondContact O-N 2.9Å; N626-D628 PolarHBondContact O-N 2.86Å
627	P	87	Confident	85.6	Confident	10 Å²	10	48.9 Å²	48.9	7%	0.065	27%	0.268	C	S	.	.			trans	-62.3	131.6	177.1	23.7	-34.9	0	0	0	112.7	P460 M462 R463 Y469 L612 F621	P460-P627 WeakPolarHBondContact O-CB 3.38Å; P460-P627 WeakPolarHBondContact O-CG 3.3Å; M462-P627 CarbonylContact C-O 3.59Å; R463-P627 VanDerWaalsContact C-CG 3.49Å; R463-P627 WeakPolarHBondContact O-CG 3.48Å; Y469-P627 WeakPolarHBondContact OH-CD 3.43Å; L612-P627 HydrophobicContact CD2-CG 4.3Å; F621-P627 HydrophobicContact CD1-CB 4.32Å; F621-P627 HydrophobicContact CE1-CB 3.8Å; F621-P627 HydrophobicContact CE2-CB 4.18Å; F621-P627 HydrophobicContact CZ-CB 3.74Å
628	D	89.1	Confident	86.5	Confident	39 Å²	39	49.5 Å²	49.5	21%	0.209	26%	0.264	C	S	.	.			trans	-141.9	12.4	-166.5	62.8	-2.6	0	0	0	113.9	F621 L622 N626 F630	F621-D628 WeakPolarHBondContact CA-OD1 3.41Å; F621-D628 WeakPolarHBondContact CD1-OD1 3.32Å; L622-D628 WeakPolarHBondContact CB-OD2 3.37Å; L622-D628 WeakPolarHBondContact CD1-OD2 3.08Å; L622-D628 VanDerWaalsContact CG-OD2 3.23Å; L622-D628 WeakPolarHBondContact CG-OD2 3.09Å; L622-D628 PolarHBondContact N-OD2 3.2Å; N626-D628 PolarHBondContact O-N 2.86Å; D628-F630 HydrophobicContact CB-CE2 4.28Å; D628-F630 WeakPolarHBondContact O-CD2 3.39Å; D628-F630 VanDerWaalsContact O-CE2 3.32Å; D628-F630 WeakPolarHBondContact O-CE2 3.32Å; D628-F630 PolarHBondContact O-N 3.48Å
629	Q	88.3	Confident	87.4	Confident	5 Å²	5	48.2 Å²	48.2	2%	0.023	26%	0.258	C	S	.	.			trans	-79.8	57.3	-169.4	-59.7	179	2.7	0	0	113.8	C461 C616 V619 F621 S631 R632	C461-Q629 WeakPolarHBondContact O-CB 3.49Å; C461-Q629 PolarHBondContact O-N 3.18Å; C461-Q629 VanDerWaalsContact O-N 3.07Å; C616-Q629 PolarHBondContact O-NE2 3.31Å; C616-Q629 PolarHBondContact O-OE1 3.38Å; C616-Q629 VanDerWaalsContact O-OE1 3.06Å; V619-Q629 PolarHBondContact O-NE2 3.22Å; F621-Q629 HydrophobicContact CD1-CG 3.92Å; F621-Q629 HydrophobicContact CE1-CG 3.82Å; Q629-S631 PolarHBondContact O-N 2.96Å; Q629-R632 HydrophobicContact CB-CG 4.29Å; Q629-R632 WeakPolarHBondContact O-CB 3.4Å; Q629-R632 WeakPolarHBondContact O-CG 3.28Å; Q629-R632 PolarHBondContact O-N 2.96Å; Q629-R632 VanDerWaalsContact OE1-CZ 3.27Å
630	F	89.1	Confident	88	Confident	79 Å²	79	45.5 Å²	45.5	35%	0.346	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-58.4	-13.7	178.4	-55.7	-65.7	0	0	0	114.5	M462 D628 R632 L633 F799 Y800	M462-F630 HydrophobicContact CB-CD1 4.41Å; M462-F630 HydrophobicContact CB-CE1 4.37Å; M462-F630 WeakPolarHBondContact O-CE1 3.45Å; M462-F630 VanDerWaalsContact O-CZ 3.23Å; M462-F630 WeakPolarHBondContact O-CZ 3.34Å; D628-F630 HydrophobicContact CB-CE2 4.28Å; D628-F630 WeakPolarHBondContact O-CD2 3.39Å; D628-F630 VanDerWaalsContact O-CE2 3.32Å; D628-F630 WeakPolarHBondContact O-CE2 3.32Å; D628-F630 PolarHBondContact O-N 3.48Å; F630-R632 PolarHBondContact O-N 3.48Å; F630-L633 PolarHBondContact O-N 3.02Å; F630-L633 VanDerWaalsContact O-N 3.08Å; F630-F799 HydrophobicContact CE1-CE1 4.37Å; F630-Y800 AromaticContact CE1-CE1 3.84Å; F630-Y800 HydrophobicContact CE1-CE1 3.84Å; F630-Y800 AromaticContact CE1-CZ 3.73Å; F630-Y800 WeakPolarHBondContact CE1-OH 3.34Å; F630-Y800 AromaticContact CZ-CE1 3.9Å; F630-Y800 HydrophobicContact CZ-CE1 3.9Å; F630-Y800 AromaticContact CZ-CZ 3.94Å; F630-Y800 WeakPolarHBondContact CZ-OH 3.4Å
631	S	89.2	Confident	88.6	Confident	46 Å²	46	41.7 Å²	41.7	32%	0.322	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-55.3	-26	166.6	54.1	0	0	0	0	113.1	M618 Q629 L633 L634 I635	M618-S631 WeakPolarHBondContact CE-OG 3.48Å; Q629-S631 PolarHBondContact O-N 2.96Å; S631-L633 PolarHBondContact O-N 3.09Å; S631-L633 VanDerWaalsContact O-N 3.17Å; S631-L634 PolarHBondContact O-N 3.04Å; S631-I635 PolarHBondContact O-N 3.26Å
632	R	92.4	Very high	88.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-63.9	-9.3	172.1	-69.6	178.5	178.5	-90.8	-5.3	115	V452 A456 C461 M462 C616 M618 Q629 F630 P636	V452-R632 VanDerWaalsContact O-CZ 3.25Å; V452-R632 PolarHBondContact O-NH1 2.87Å; V452-R632 PolarHBondContact O-NH2 2.74Å; A456-R632 WeakPolarHBondContact O-CD 3.25Å; A456-R632 PolarHBondContact O-NH1 3.29Å; C461-R632 VanDerWaalsContact CB-CD 3.49Å; M462-R632 HydrophobicContact CG-CB 4Å; M462-R632 HydrophobicContact SD-CB 3.71Å; C616-R632 PolarHBondContact O-NH2 3.09Å; M618-R632 HydrophobicContact CE-CG 4.01Å; Q629-R632 HydrophobicContact CB-CG 4.29Å; Q629-R632 WeakPolarHBondContact O-CB 3.4Å; Q629-R632 WeakPolarHBondContact O-CG 3.28Å; Q629-R632 PolarHBondContact O-N 2.96Å; Q629-R632 VanDerWaalsContact OE1-CZ 3.27Å; F630-R632 PolarHBondContact O-N 3.48Å; R632-P636 WeakPolarHBondContact O-CD 3.43Å; R632-P636 WeakPolarHBondContact O-CG 3.45Å
633	L	92.3	Very high	89.5	Confident	11 Å²	11	36 Å²	36	6%	0.058	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-79.3	-20.5	167.1	-60.9	178.2	0	0	0	112.7	M462 F630 S631 I678 N681 L682 F796	M462-L633 HydrophobicContact CE-CD2 4.04Å; M462-L633 HydrophobicContact SD-CD2 3.79Å; M462-L633 HydrophobicContact SD-CG 3.89Å; F630-L633 PolarHBondContact O-N 3.02Å; F630-L633 VanDerWaalsContact O-N 3.08Å; S631-L633 PolarHBondContact O-N 3.09Å; S631-L633 VanDerWaalsContact O-N 3.17Å; L633-I678 HydrophobicContact CB-CG2 4.26Å; L633-N681 HydrophobicContact CD2-CB 4.35Å; L633-N681 PolarHBondContact O-ND2 2.86Å; L633-L682 HydrophobicContact CD1-CB 4.44Å; L633-L682 HydrophobicContact CD1-CD1 4.07Å; L633-L682 HydrophobicContact CD2-CB 4.09Å; L633-L682 HydrophobicContact CD2-CD1 4.26Å; L633-F796 HydrophobicContact CD1-CE1 4.11Å; L633-F796 HydrophobicContact CD1-CZ 4.25Å
634	L	92.9	Very high	90.2	Very high	43 Å²	43	32.4 Å²	32.4	23%	0.225	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-42.6	-174.9	172.1	60.5	0	0	0	112.9	F158 S631 L637 F638 L674 I678	F158-L634 HydrophobicContact CE1-CD2 4.24Å; S631-L634 PolarHBondContact O-N 3.04Å; L634-L637 HydrophobicContact CD1-CD1 4.31Å; L634-L637 WeakPolarHBondContact O-CB 3.38Å; L634-L637 WeakPolarHBondContact O-CG 3.29Å; L634-L637 PolarHBondContact O-N 3.3Å; L634-F638 HydrophobicContact CD1-CE2 3.97Å; L634-F638 HydrophobicContact CG-CE2 4.27Å; L634-L674 HydrophobicContact CD1-CD2 4.04Å; L634-I678 HydrophobicContact CB-CG1 4.47Å; L634-I678 HydrophobicContact CD1-CD1 4.3Å; L634-I678 HydrophobicContact CD1-CG1 4.49Å
635	I	92.7	Very high	90.9	Very high	23 Å²	23	30 Å²	30	12%	0.118	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-63	-37.3	-173.1	-73.3	174	0	0	0	114.1	F162 M618 S631 L637 F638 L639	F162-I635 HydrophobicContact CE2-CD1 3.88Å; F162-I635 HydrophobicContact CE2-CG1 4.18Å; F162-I635 HydrophobicContact CE2-CG2 4.29Å; F162-I635 HydrophobicContact CZ-CD1 4.24Å; F162-I635 HydrophobicContact CZ-CG1 4.48Å; F162-I635 HydrophobicContact CZ-CG2 3.76Å; M618-I635 HydrophobicContact CE-CD1 3.9Å; M618-I635 HydrophobicContact SD-CD1 3.35Å; M618-I635 WeakPolarHBondContact SD-CD1 3.01Å; M618-I635 HydrophobicContact SD-CG1 4.49Å; M618-I635 HydrophobicContact SD-CG2 4.05Å; S631-I635 PolarHBondContact O-N 3.26Å; I635-L637 PolarHBondContact O-N 3.01Å; I635-F638 PolarHBondContact O-N 2.85Å; I635-L639 HydrophobicContact CG2-CD1 3.9Å; I635-L639 HydrophobicContact CG2-CG 4.22Å; I635-L639 PolarHBondContact O-N 3.36Å
636	P	94.1	Very high	92	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-55.9	-23.3	173.9	-32	39.9	0	0	0	115.1	G455 K457 R632 F638 G695	G455-P636 WeakPolarHBondContact O-CD 3.41Å; G455-P636 WeakPolarHBondContact O-CG 3.07Å; K457-P636 HydrophobicContact CB-CG 4Å; R632-P636 WeakPolarHBondContact O-CD 3.43Å; R632-P636 WeakPolarHBondContact O-CG 3.45Å; P636-F638 PolarHBondContact O-N 2.9Å; P636-G695 CarbonylContact O-C 3.52Å; P636-G695 WeakPolarHBondContact O-CA 3.19Å; P636-G695 PolarHBondContact O-N 3.28Å
637	L	94.7	Very high	92.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-69.6	-10.3	176.8	-51.9	-179	0	0	0	113.1	Q397 L634 I635 L674 P696	Q397-L637 PolarHBondContact NE2-O 3.25Å; L634-L637 HydrophobicContact CD1-CD1 4.31Å; L634-L637 WeakPolarHBondContact O-CB 3.38Å; L634-L637 WeakPolarHBondContact O-CG 3.29Å; L634-L637 PolarHBondContact O-N 3.3Å; I635-L637 PolarHBondContact O-N 3.01Å; L637-L674 HydrophobicContact CD1-CD2 4.43Å; L637-P696 HydrophobicContact CB-CB 4.5Å; L637-P696 HydrophobicContact CD2-CB 4.46Å
638	F	94.7	Very high	92.9	Very high	38 Å²	38	31.2 Å²	31.2	17%	0.167	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-36.2	177	-57.4	-87.6	0	0	0	112.2	W392 I393 V396 L634 I635 P636 H640 L674	W392-F638 AromaticContact CH2-CE1 3.94Å; W392-F638 HydrophobicContact CH2-CE1 3.94Å; W392-F638 HydrophobicContact CH2-CZ 4.31Å; W392-F638 HydrophobicContact CZ3-CE1 4.3Å; I393-F638 HydrophobicContact CD1-CD1 3.58Å; I393-F638 HydrophobicContact CD1-CE1 3.32Å; I393-F638 HydrophobicContact CD1-CZ 4.25Å; V396-F638 HydrophobicContact CB-CD1 4.41Å; V396-F638 HydrophobicContact CG1-CD1 3.63Å; V396-F638 HydrophobicContact CG1-CE1 4.2Å; L634-F638 HydrophobicContact CD1-CE2 3.97Å; L634-F638 HydrophobicContact CG-CE2 4.27Å; I635-F638 PolarHBondContact O-N 2.85Å; P636-F638 PolarHBondContact O-N 2.9Å; F638-H640 PolarHBondContact O-ND1 3.22Å; F638-L674 HydrophobicContact CZ-CD2 4.47Å
639	L	93.9	Very high	93.1	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	16%	0.157	C	C	.	.			trans	-65.6	160.2	171.5	-63.2	171.5	0	0	0	112	V400 L454 I635 V694 G695	V400-L639 HydrophobicContact CG1-CD2 3.81Å; L454-L639 HydrophobicContact CB-CD1 4.32Å; L454-L639 HydrophobicContact CB-CD2 4.09Å; I635-L639 HydrophobicContact CG2-CD1 3.9Å; I635-L639 HydrophobicContact CG2-CG 4.22Å; I635-L639 PolarHBondContact O-N 3.36Å; L639-V694 HydrophobicContact CB-CB 3.92Å; L639-V694 HydrophobicContact CB-CG1 3.66Å; L639-V694 HydrophobicContact CD1-CG1 3.95Å; L639-V694 HydrophobicContact CG-CG1 4.47Å; L639-G695 VanDerWaalsContact O-CA 3.27Å; L639-G695 WeakPolarHBondContact O-CA 3.32Å; L639-G695 PolarHBondContact O-N 3.24Å
640	H	95	Very high	93.4	Very high	5 Å²	5	31 Å²	31	2%	0.023	17%	0.167	C	C	.	.			trans	-147.8	153.5	173.2	-74.2	80.7	0	0	0	108.9	M401 F638 G642 H645 C646 T649 P696	M401-H640 HydrophobicContact CE-CB 3.61Å; M401-H640 VanDerWaalsContact CE-O 3.25Å; M401-H640 WeakPolarHBondContact CE-O 3.43Å; F638-H640 PolarHBondContact O-ND1 3.22Å; H640-G642 VanDerWaalsContact C-N 3.28Å; H640-G642 PolarHBondContact O-N 3Å; H640-H645 HydrophobicContact CB-CB 4.47Å; H640-H645 AromaticContact CD2-CD2 3.63Å; H640-H645 AromaticContact CD2-CG 3.97Å; H640-H645 AromaticContact CD2-NE2 3.97Å; H640-C646 HydrophobicContact CB-CB 4.17Å; H640-T649 VanDerWaalsContact NE2-CB 3.29Å; H640-T649 WeakPolarHBondContact NE2-CB 3.39Å; H640-T649 VanDerWaalsContact NE2-CG2 3.27Å; H640-T649 WeakPolarHBondContact NE2-CG2 3.41Å; H640-T649 PolarHBondContact NE2-OG1 3.42Å; H640-P696 WeakPolarHBondContact NE2-CD 3.09Å
641	A	92	Very high	93.5	Very high	12 Å²	12	30.3 Å²	30.3	10%	0.099	17%	0.166	C	C	.	.	S	Bend	trans	-68.5	-26.1	-176.9	0	0	0	0	0	113.4	N441 Y443 L451 H645 V694	N441-A641 PolarHBondContact ND2-O 3.13Å; Y443-A641 HydrophobicContact CD2-CB 3.43Å; Y443-A641 VanDerWaalsContact CD2-CB 3.43Å; Y443-A641 HydrophobicContact CE2-CB 3.97Å; Y443-A641 HydrophobicContact CG-CB 4.07Å; L451-A641 HydrophobicContact CD1-CB 4.43Å; A641-H645 HydrophobicContact CB-CB 4.46Å; A641-V694 HydrophobicContact CB-CG2 3.82Å; A641-V694 VanDerWaalsContact N-CG2 3.26Å
642	G	93.4	Very high	93.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-179.4	-177.3	177.8	0	0	0	0	0	112.4	M401 Y443 I444 H640 I644 H645 C646	M401-G642 VanDerWaalsContact CE-C 3.5Å; Y443-G642 CarbonylContact O-C 2.88Å; Y443-G642 WeakPolarHBondContact O-CA 3.46Å; I444-G642 CarbonylContact O-C 3.4Å; I444-G642 VanDerWaalsContact O-CA 3.23Å; I444-G642 WeakPolarHBondContact O-CA 3.36Å; H640-G642 VanDerWaalsContact C-N 3.28Å; H640-G642 PolarHBondContact O-N 3Å; G642-I644 VanDerWaalsContact C-N 3.3Å; G642-I644 PolarHBondContact O-N 3.47Å; G642-H645 PolarHBondContact O-N 2.92Å; G642-C646 PolarHBondContact O-N 3.45Å
643	I	95.4	Very high	93.6	Very high	63 Å²	63	30.8 Å²	30.8	32%	0.323	16%	0.164	S	C	.	.	H	α-helix	trans	-54.9	-45.3	-178	-63.1	175.4	0	0	0	110.9	M401 L405 F410 Y443 I444 H645 C646 L647	M401-I643 HydrophobicContact SD-CG1 4.4Å; L405-I643 HydrophobicContact CD1-CD1 3.9Å; L405-I643 HydrophobicContact CD1-CG1 3.72Å; F410-I643 HydrophobicContact CE1-CD1 3.97Å; F410-I643 HydrophobicContact CZ-CD1 4.41Å; Y443-I643 PolarHBondContact O-N 3.29Å; I444-I643 HydrophobicContact CG2-CD1 4.18Å; I444-I643 PolarHBondContact O-N 2.96Å; I643-H645 PolarHBondContact O-N 3.49Å; I643-C646 PolarHBondContact O-N 2.84Å; I643-L647 HydrophobicContact CG2-CD1 3.9Å; I643-L647 HydrophobicContact CG2-CG 4.29Å; I643-L647 WeakPolarHBondContact O-CG 3.18Å; I643-L647 PolarHBondContact O-N 3.34Å
644	I	93.7	Very high	93.4	Very high	73 Å²	73	33.2 Å²	33.2	37%	0.374	18%	0.175	S	C	.	.	H	α-helix	trans	-64.2	-44.8	-177.2	-63.1	174.4	0	0	0	110.6	Y443 I444 G642 C646 L647 V648	Y443-I644 HydrophobicContact CD1-CB 4.21Å; Y443-I644 HydrophobicContact CD1-CG2 4.25Å; Y443-I644 PolarHBondContact O-N 2.91Å; I444-I644 HydrophobicContact CD1-CD1 3.87Å; I444-I644 HydrophobicContact CD1-CG1 4.32Å; I444-I644 HydrophobicContact CG1-CD1 4.01Å; I444-I644 HydrophobicContact CG1-CG1 4.5Å; G642-I644 VanDerWaalsContact C-N 3.3Å; G642-I644 PolarHBondContact O-N 3.47Å; I644-C646 PolarHBondContact O-N 2.76Å; I644-L647 PolarHBondContact O-N 2.9Å; I644-V648 WeakPolarHBondContact O-CG2 3.24Å; I644-V648 PolarHBondContact O-N 2.88Å
645	H	93.8	Very high	93	Very high	29 Å²	29	33.3 Å²	33.3	13%	0.134	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-45.2	175.7	-169.1	168.5	0	0	0	110.7	Y443 H640 A641 G642 I643 L647 V648 T649 V694	Y443-H645 HydrophobicContact CD1-CB 3.63Å; Y443-H645 HydrophobicContact CE1-CB 3.92Å; Y443-H645 HydrophobicContact CG-CB 3.94Å; H640-H645 HydrophobicContact CB-CB 4.47Å; H640-H645 AromaticContact CD2-CD2 3.63Å; H640-H645 AromaticContact CD2-CG 3.97Å; H640-H645 AromaticContact CD2-NE2 3.97Å; A641-H645 HydrophobicContact CB-CB 4.46Å; G642-H645 PolarHBondContact O-N 2.92Å; I643-H645 PolarHBondContact O-N 3.49Å; H645-L647 PolarHBondContact O-N 3.12Å; H645-V648 PolarHBondContact O-N 2.98Å; H645-T649 WeakPolarHBondContact O-CB 3.46Å; H645-T649 PolarHBondContact O-N 2.91Å; H645-T649 PolarHBondContact O-OG1 3.31Å; H645-V694 PolarHBondContact CE1-O 3.15Å
646	C	95.9	Very high	92.9	Very high	7 Å²	7	33 Å²	33	5%	0.047	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-45.9	177.6	-167.5	0	0	0	0	112	M401 H640 G642 I643 I644 T649 V650	M401-C646 HydrophobicContact CG-CB 4.21Å; H640-C646 HydrophobicContact CB-CB 4.17Å; G642-C646 PolarHBondContact O-N 3.45Å; I643-C646 PolarHBondContact O-N 2.84Å; I644-C646 PolarHBondContact O-N 2.76Å; C646-T649 PolarHBondContact O-N 2.71Å; C646-V650 WeakPolarHBondContact O-CB 3.4Å; C646-V650 VanDerWaalsContact O-CG2 3.31Å; C646-V650 WeakPolarHBondContact O-CG2 3.42Å; C646-V650 PolarHBondContact O-N 2.9Å
647	L	95.1	Very high	92.7	Very high	105 Å²	105	32.9 Å²	32.9	55%	0.55	17%	0.172	S	C	.	.	H	α-helix	trans	-60.9	-47	177.6	-72.5	173	0	0	0	112.4	I643 I644 H645 V650 I651	I643-L647 HydrophobicContact CG2-CD1 3.9Å; I643-L647 HydrophobicContact CG2-CG 4.29Å; I643-L647 WeakPolarHBondContact O-CG 3.18Å; I643-L647 PolarHBondContact O-N 3.34Å; I644-L647 PolarHBondContact O-N 2.9Å; H645-L647 PolarHBondContact O-N 3.12Å; L647-V650 PolarHBondContact O-N 3.5Å; L647-I651 WeakPolarHBondContact O-CG1 3.48Å; L647-I651 PolarHBondContact O-N 2.95Å
648	V	92.6	Very high	92.4	Very high	74 Å²	74	35.5 Å²	35.5	45%	0.448	18%	0.181	S	C	.	.	H	α-helix	trans	-60.2	-47.4	177.4	170.7	0	0	0	0	110.7	I644 H645 V650 I651 I652	I644-V648 WeakPolarHBondContact O-CG2 3.24Å; I644-V648 PolarHBondContact O-N 2.88Å; H645-V648 PolarHBondContact O-N 2.98Å; V648-V650 PolarHBondContact O-N 3.11Å; V648-I651 PolarHBondContact O-N 3.28Å; V648-I652 HydrophobicContact CG1-CD1 3.7Å; V648-I652 HydrophobicContact CG1-CG1 4.48Å; V648-I652 WeakPolarHBondContact O-CG1 3.43Å; V648-I652 PolarHBondContact O-N 3.41Å
649	T	94.3	Very high	92	Very high	2 Å²	2	34 Å²	34	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-45.1	175.9	-76.7	0	0	0	0	112.4	H640 H645 C646 I651 I652 Q653 P696 Q700	H640-T649 VanDerWaalsContact NE2-CB 3.29Å; H640-T649 WeakPolarHBondContact NE2-CB 3.39Å; H640-T649 VanDerWaalsContact NE2-CG2 3.27Å; H640-T649 WeakPolarHBondContact NE2-CG2 3.41Å; H640-T649 PolarHBondContact NE2-OG1 3.42Å; H645-T649 WeakPolarHBondContact O-CB 3.46Å; H645-T649 PolarHBondContact O-N 2.91Å; H645-T649 PolarHBondContact O-OG1 3.31Å; C646-T649 PolarHBondContact O-N 2.71Å; T649-I651 VanDerWaalsContact C-N 3.32Å; T649-I651 PolarHBondContact O-N 3.32Å; T649-I652 PolarHBondContact O-N 2.99Å; T649-Q653 HydrophobicContact CG2-CG 4.17Å; T649-Q653 WeakPolarHBondContact O-CB 3.35Å; T649-Q653 WeakPolarHBondContact O-CG 3.32Å; T649-Q653 PolarHBondContact O-N 3.46Å; T649-P696 HydrophobicContact CG2-CG 3.58Å; T649-Q700 PolarHBondContact OG1-NE2 2.88Å; T649-Q700 VanDerWaalsContact OG1-NE2 3.08Å
650	V	94.3	Very high	91.8	Very high	38 Å²	38	34 Å²	34	23%	0.23	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-39	179.6	168.7	0	0	0	0	111.3	T394 V398 C646 L647 V648 H654	T394-V650 HydrophobicContact CG2-CG1 4.26Å; T394-V650 HydrophobicContact CG2-CG2 4.26Å; V398-V650 HydrophobicContact CG2-CG2 4.06Å; C646-V650 WeakPolarHBondContact O-CB 3.4Å; C646-V650 VanDerWaalsContact O-CG2 3.31Å; C646-V650 WeakPolarHBondContact O-CG2 3.42Å; C646-V650 PolarHBondContact O-N 2.9Å; L647-V650 PolarHBondContact O-N 3.5Å; V648-V650 PolarHBondContact O-N 3.11Å; V650-H654 VanDerWaalsContact O-CB 3.3Å; V650-H654 WeakPolarHBondContact O-CB 3.34Å; V650-H654 PolarHBondContact O-N 3.18Å
651	I	92.1	Very high	91.6	Very high	64 Å²	64	33.7 Å²	33.7	33%	0.328	17%	0.174	S	C	.	.	H	α-helix	trans	-63.2	-49.3	173.9	-67.6	165.1	0	0	0	110.6	L339 L647 V648 T649 Q653 H654 F655	L339-I651 HydrophobicContact CD2-CG2 4.03Å; L647-I651 WeakPolarHBondContact O-CG1 3.48Å; L647-I651 PolarHBondContact O-N 2.95Å; V648-I651 PolarHBondContact O-N 3.28Å; T649-I651 VanDerWaalsContact C-N 3.32Å; T649-I651 PolarHBondContact O-N 3.32Å; I651-Q653 PolarHBondContact O-N 3.19Å; I651-H654 PolarHBondContact O-N 3.28Å; I651-F655 WeakPolarHBondContact O-CB 3.44Å; I651-F655 PolarHBondContact O-N 3.06Å; I651-F655 VanDerWaalsContact O-N 3.08Å
652	I	90.8	Very high	91.3	Very high	54 Å²	54	35.2 Å²	35.2	28%	0.277	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-43.1	-179.1	-65.7	167.5	0	0	0	111.1	V648 T649 F655 L656 Q700	V648-I652 HydrophobicContact CG1-CD1 3.7Å; V648-I652 HydrophobicContact CG1-CG1 4.48Å; V648-I652 WeakPolarHBondContact O-CG1 3.43Å; V648-I652 PolarHBondContact O-N 3.41Å; T649-I652 PolarHBondContact O-N 2.99Å; I652-F655 PolarHBondContact O-N 2.72Å; I652-L656 HydrophobicContact CG2-CD1 3.57Å; I652-L656 HydrophobicContact CG2-CG 4.05Å; I652-L656 WeakPolarHBondContact O-CB 3.24Å; I652-L656 WeakPolarHBondContact O-CG 3.39Å; I652-L656 PolarHBondContact O-N 2.95Å; I652-Q700 HydrophobicContact CG2-CG 4.37Å; I652-Q700 VanDerWaalsContact CG2-OE1 3.26Å
653	Q	92.3	Very high	90.8	Very high	1 Å²	1	36 Å²	36	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-43.3	175.3	-71.7	-179.3	21.4	0	0	112.4	T394 T649 I651 F655 L656 L657 R658 Y673	T394-Q653 HydrophobicContact CG2-CB 4.25Å; T649-Q653 HydrophobicContact CG2-CG 4.17Å; T649-Q653 WeakPolarHBondContact O-CB 3.35Å; T649-Q653 WeakPolarHBondContact O-CG 3.32Å; T649-Q653 PolarHBondContact O-N 3.46Å; I651-Q653 PolarHBondContact O-N 3.19Å; Q653-F655 PolarHBondContact O-N 3.03Å; Q653-L656 PolarHBondContact O-N 3.2Å; Q653-L657 HydrophobicContact CB-CB 4.1Å; Q653-L657 HydrophobicContact CB-CD2 4.27Å; Q653-L657 HydrophobicContact CG-CB 4.48Å; Q653-L657 HydrophobicContact CG-CD2 4.24Å; Q653-L657 WeakPolarHBondContact O-CA 3.25Å; Q653-L657 VanDerWaalsContact O-CB 3.25Å; Q653-L657 WeakPolarHBondContact O-CB 3.45Å; Q653-L657 PolarHBondContact O-N 2.94Å; Q653-R658 PolarHBondContact O-N 2.92Å; Q653-Y673 PolarHBondContact NE2-OH 2.81Å
654	H	88.5	Confident	90.4	Very high	62 Å²	62	33.2 Å²	33.2	29%	0.287	17%	0.168	S	C	.	.	H	α-helix	trans	-66.9	-19.4	179.5	-163.7	95.3	0	0	0	112.9	L343 Y391 V650 I651 R658	L343-H654 PolarHBondContact O-NE2 3.16Å; L343-H654 VanDerWaalsContact O-NE2 3.16Å; Y391-H654 AromaticContact CE1-CE1 3.46Å; Y391-H654 VanDerWaalsContact CE1-CE1 3.46Å; Y391-H654 WeakPolarHBondContact CE1-CE1 3.42Å; V650-H654 VanDerWaalsContact O-CB 3.3Å; V650-H654 WeakPolarHBondContact O-CB 3.34Å; V650-H654 PolarHBondContact O-N 3.18Å; I651-H654 PolarHBondContact O-N 3.28Å; H654-R658 PolarHBondContact NE2-NH1 3.13Å; H654-R658 WeakPolarHBondContact O-CB 3.31Å; H654-R658 VanDerWaalsContact O-CD 3.26Å; H654-R658 WeakPolarHBondContact O-CD 3.38Å
655	F	84.7	Confident	90.1	Very high	45 Å²	45	29.8 Å²	29.8	20%	0.197	15%	0.151	C	C	.	.	H	α-helix	trans	-89.6	-49.7	173.6	-175.5	-105	0	0	0	113.3	I342 V356 V357 I651 I652 Q653 D659	I342-F655 HydrophobicContact CG2-CD2 4.01Å; I342-F655 HydrophobicContact CG2-CE2 4.03Å; V356-F655 HydrophobicContact CB-CE2 4.42Å; V356-F655 HydrophobicContact CG1-CD2 3.76Å; V356-F655 HydrophobicContact CG1-CE2 3.39Å; V356-F655 HydrophobicContact CG1-CZ 4.14Å; V357-F655 HydrophobicContact CG2-CD1 4.37Å; V357-F655 HydrophobicContact CG2-CE1 3.7Å; V357-F655 HydrophobicContact CG2-CZ 4.13Å; I651-F655 WeakPolarHBondContact O-CB 3.44Å; I651-F655 PolarHBondContact O-N 3.06Å; I651-F655 VanDerWaalsContact O-N 3.08Å; I652-F655 PolarHBondContact O-N 2.72Å; Q653-F655 PolarHBondContact O-N 3.03Å; F655-D659 WeakPolarHBondContact O-CB 3.07Å
656	L	89.3	Confident	89.8	Confident	16 Å²	16	32.2 Å²	32.2	8%	0.084	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-61.3	-176.2	-55.9	-178	0	0	0	112.9	V357 I652 Q653 R658 D659 L660 L707	V357-L656 HydrophobicContact CG2-CD2 3.79Å; I652-L656 HydrophobicContact CG2-CD1 3.57Å; I652-L656 HydrophobicContact CG2-CG 4.05Å; I652-L656 WeakPolarHBondContact O-CB 3.24Å; I652-L656 WeakPolarHBondContact O-CG 3.39Å; I652-L656 PolarHBondContact O-N 2.95Å; Q653-L656 PolarHBondContact O-N 3.2Å; L656-R658 PolarHBondContact O-N 3.4Å; L656-D659 PolarHBondContact O-N 2.81Å; L656-D659 VanDerWaalsContact O-N 3.1Å; L656-L660 PolarHBondContact O-N 3.06Å; L656-L707 HydrophobicContact CD2-CD1 3.78Å
657	L	91.4	Very high	89.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-47.4	-174.1	-177.8	66.8	0	0	0	110.9	F389 T390 I393 Q653 D659 L660 E661 V669 Y673 L703	F389-L657 HydrophobicContact CD1-CD1 4.16Å; F389-L657 HydrophobicContact CD1-CD2 4.13Å; F389-L657 HydrophobicContact CE1-CD1 4.19Å; F389-L657 HydrophobicContact CE1-CD2 4.13Å; T390-L657 HydrophobicContact CG2-CB 4.46Å; T390-L657 HydrophobicContact CG2-CD2 4.2Å; T390-L657 HydrophobicContact CG2-CG 4.33Å; I393-L657 HydrophobicContact CG2-CD2 3.62Å; Q653-L657 HydrophobicContact CB-CB 4.1Å; Q653-L657 HydrophobicContact CB-CD2 4.27Å; Q653-L657 HydrophobicContact CG-CB 4.48Å; Q653-L657 HydrophobicContact CG-CD2 4.24Å; Q653-L657 WeakPolarHBondContact O-CA 3.25Å; Q653-L657 VanDerWaalsContact O-CB 3.25Å; Q653-L657 WeakPolarHBondContact O-CB 3.45Å; Q653-L657 PolarHBondContact O-N 2.94Å; L657-D659 PolarHBondContact O-N 3.01Å; L657-D659 VanDerWaalsContact O-N 3.13Å; L657-L660 PolarHBondContact O-N 3.34Å; L657-E661 WeakPolarHBondContact O-CB 3.41Å; L657-E661 PolarHBondContact O-N 3.11Å; L657-V669 HydrophobicContact CD1-CG1 3.32Å; L657-Y673 HydrophobicContact CD1-CD2 4.13Å; L657-Y673 HydrophobicContact CD2-CD2 4.37Å; L657-Y673 HydrophobicContact CD2-CE2 4.33Å; L657-L703 HydrophobicContact CB-CD1 3.77Å; L657-L703 HydrophobicContact CD1-CD1 3.76Å; L657-L703 HydrophobicContact CD1-CD2 3.74Å; L657-L703 HydrophobicContact CD1-CG 4.4Å; L657-L703 HydrophobicContact CG-CD1 4.32Å
658	R	88.1	Confident	89.5	Confident	55 Å²	55	34.2 Å²	34.2	21%	0.208	17%	0.166	C	C	.	.	H	α-helix	trans	-56.9	-29.1	176.8	-161.2	-175.3	178.6	-146	6	113.5	P387 T390 Y391 Q653 H654 L656 K662	P387-R658 HydrophobicContact CB-CG 4.02Å; P387-R658 HydrophobicContact CG-CG 4Å; T390-R658 HydrophobicContact CG2-CB 3.89Å; T390-R658 HydrophobicContact CG2-CG 4.31Å; T390-R658 WeakPolarHBondContact OG1-CA 3.34Å; T390-R658 PolarHBondContact OG1-N 3.08Å; Y391-R658 PolarHBondContact OH-NE 3.04Å; Y391-R658 PolarHBondContact OH-NH2 3.14Å; Q653-R658 PolarHBondContact O-N 2.92Å; H654-R658 PolarHBondContact NE2-NH1 3.13Å; H654-R658 WeakPolarHBondContact O-CB 3.31Å; H654-R658 VanDerWaalsContact O-CD 3.26Å; H654-R658 WeakPolarHBondContact O-CD 3.38Å; L656-R658 PolarHBondContact O-N 3.4Å; R658-K662 WeakPolarHBondContact O-CE 3.47Å; R658-K662 WeakPolarHBondContact O-CG 3.35Å
659	D	85.4	Confident	89.5	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-86.4	-45.1	-176.7	-152.9	42.9	0	0	0	110.8	R350 G355 V356 F655 L656 L657 E661 K662	R350-D659 WeakPolarHBondContact CD-O 3.47Å; R350-D659 WeakPolarHBondContact CD-OD1 3.18Å; R350-D659 VanDerWaalsContact CZ-O 3.28Å; R350-D659 IonicContact CZ-OD2 3.25Å; R350-D659 PolarHBondContact NE-O 3.29Å; R350-D659 VanDerWaalsContact NE-O 3.1Å; R350-D659 IonicContact NE-OD1 3.59Å; R350-D659 PolarHBondContact NE-OD1 3.36Å; R350-D659 VanDerWaalsContact NE-OD1 3.13Å; R350-D659 IonicContact NE-OD2 2.74Å; R350-D659 PolarHBondContact NE-OD2 2.79Å; R350-D659 PolarHBondContact NH1-O 3.47Å; R350-D659 IonicContact NH2-OD2 3.94Å; R350-D659 PolarHBondContact NH2-OD2 3.5Å; G355-D659 WeakPolarHBondContact CA-OD2 3.36Å; V356-D659 HydrophobicContact CG2-CB 4.49Å; V356-D659 PolarHBondContact N-OD2 2.84Å; F655-D659 WeakPolarHBondContact O-CB 3.07Å; L656-D659 PolarHBondContact O-N 2.81Å; L656-D659 VanDerWaalsContact O-N 3.1Å; L657-D659 PolarHBondContact O-N 3.01Å; L657-D659 VanDerWaalsContact O-N 3.13Å; D659-E661 VanDerWaalsContact C-N 3.33Å; D659-E661 PolarHBondContact O-N 2.84Å; D659-K662 PolarHBondContact O-N 2.85Å; D659-K662 IonicContact OD1-NZ 2.71Å; D659-K662 PolarHBondContact OD1-NZ 2.98Å
660	L	89.3	Confident	89.5	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-60.2	-40.2	172	-71.7	172.8	0	0	0	112.6	L656 L657 K662 L663 V664 L703 L707 F764	L656-L660 PolarHBondContact O-N 3.06Å; L657-L660 PolarHBondContact O-N 3.34Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.37Å; L660-L663 PolarHBondContact O-N 3.03Å; L660-L663 VanDerWaalsContact O-N 3.08Å; L660-V664 PolarHBondContact O-N 2.94Å; L660-L703 HydrophobicContact CD1-CB 3.75Å; L660-L703 HydrophobicContact CD1-CD2 3.79Å; L660-L703 HydrophobicContact CD1-CG 4.3Å; L660-L703 WeakPolarHBondContact CD1-O 3.44Å; L660-L707 HydrophobicContact CD1-CG 4.43Å; L660-L707 HydrophobicContact CD2-CD2 3.72Å; L660-L707 HydrophobicContact CD2-CG 4.26Å; L660-L707 HydrophobicContact CG-CD2 4.17Å; L660-F764 HydrophobicContact CD2-CE2 4.09Å; L660-F764 HydrophobicContact CD2-CZ 3.76Å
661	E	90.8	Very high	89.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-35.4	-177.9	-154.4	-169.8	153	0	0	113.1	Y385 P387 F388 F389 T390 L657 D659 L663 G665 W666 V669	Y385-E661 WeakPolarHBondContact CB-O 3.42Å; P387-E661 VanDerWaalsContact C-OE2 3.27Å; P387-E661 WeakPolarHBondContact CA-OE1 3.31Å; P387-E661 WeakPolarHBondContact CA-OE2 3.32Å; P387-E661 HydrophobicContact CB-CB 4.23Å; P387-E661 WeakPolarHBondContact CB-OE2 3.31Å; F388-E661 PolarHBondContact N-OE1 3.35Å; F389-E661 WeakPolarHBondContact CB-OE1 3.34Å; F389-E661 PolarHBondContact N-OE1 3.25Å; F389-E661 PolarHBondContact N-OE2 3.03Å; T390-E661 WeakPolarHBondContact CB-OE2 3.39Å; T390-E661 PolarHBondContact N-OE2 3.5Å; T390-E661 PolarHBondContact OG1-OE2 3.41Å; L657-E661 WeakPolarHBondContact O-CB 3.41Å; L657-E661 PolarHBondContact O-N 3.11Å; D659-E661 VanDerWaalsContact C-N 3.33Å; D659-E661 PolarHBondContact O-N 2.84Å; E661-L663 VanDerWaalsContact C-N 3.26Å; E661-L663 PolarHBondContact O-N 3.45Å; E661-G665 VanDerWaalsContact O-CA 3.29Å; E661-G665 WeakPolarHBondContact O-CA 3.15Å; E661-G665 PolarHBondContact O-N 3.31Å; E661-W666 HydrophobicContact CG-CB 4.24Å; E661-W666 VanDerWaalsContact OE1-CA 3.3Å; E661-W666 WeakPolarHBondContact OE1-CA 3.47Å; E661-W666 WeakPolarHBondContact OE1-CB 3.49Å; E661-V669 HydrophobicContact CG-CB 4.36Å
662	K	86.5	Confident	89.6	Confident	44 Å²	44	30.5 Å²	30.5	19%	0.191	14%	0.144	C	C	.	.	H	α-helix	trans	-63.2	-31.4	175.2	-63.8	165	-159	151.2	0	113.1	R350 Y385 R658 D659 L660	R350-K662 HydrophobicContact CB-CB 4.25Å; R350-K662 HydrophobicContact CB-CD 4.14Å; Y385-K662 PolarHBondContact N-O 3.23Å; Y385-K662 WeakPolarHBondContact O-CA 3.43Å; R658-K662 WeakPolarHBondContact O-CE 3.47Å; R658-K662 WeakPolarHBondContact O-CG 3.35Å; D659-K662 PolarHBondContact O-N 2.85Å; D659-K662 IonicContact OD1-NZ 2.71Å; D659-K662 PolarHBondContact OD1-NZ 2.98Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.37Å
663	L	83.1	Confident	89.9	Confident	17 Å²	17	27.9 Å²	27.9	9%	0.089	13%	0.131	C	C	.	.	H	α-helix	trans	-87	-47.1	-177.1	171.8	70.1	0	0	0	112.3	R350 F352 L660 E661 P765	R350-L663 VanDerWaalsContact NH1-CB 3.25Å; F352-L663 HydrophobicContact CD2-CD1 3.61Å; F352-L663 HydrophobicContact CE2-CD1 3.98Å; F352-L663 HydrophobicContact CG-CD1 4.24Å; L660-L663 PolarHBondContact O-N 3.03Å; L660-L663 VanDerWaalsContact O-N 3.08Å; E661-L663 VanDerWaalsContact C-N 3.26Å; E661-L663 PolarHBondContact O-N 3.45Å; L663-P765 HydrophobicContact CD1-CG 4.47Å; L663-P765 HydrophobicContact CG-CG 4.47Å
664	V	86.8	Confident	90.1	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-102.1	-19.8	-166.4	-170.8	0	0	0	0	112	L660 R668 V669 F764	L660-V664 PolarHBondContact O-N 2.94Å; V664-R668 HydrophobicContact CG1-CB 3.81Å; V664-V669 HydrophobicContact CB-CG2 3.75Å; V664-V669 HydrophobicContact CG1-CG2 4.23Å; V664-F764 HydrophobicContact CG1-CD1 4.07Å; V664-F764 HydrophobicContact CG1-CE1 4.46Å; V664-F764 HydrophobicContact CG2-CD1 3.96Å; V664-F764 HydrophobicContact CG2-CD2 4.07Å; V664-F764 HydrophobicContact CG2-CE1 3.96Å; V664-F764 HydrophobicContact CG2-CE2 4.06Å; V664-F764 HydrophobicContact CG2-CG 4.02Å; V664-F764 HydrophobicContact CG2-CZ 4.02Å
665	G	86.8	Confident	90.4	Very high	2 Å²	2	29.4 Å²	29.4	2%	0.021	14%	0.142	C	C	.	.			trans	89.3	144.1	177.8	0	0	0	0	0	113.9	Y385 E661 S667 R668 V669	Y385-G665 VanDerWaalsContact CD2-CA 3.48Å; E661-G665 VanDerWaalsContact O-CA 3.29Å; E661-G665 WeakPolarHBondContact O-CA 3.15Å; E661-G665 PolarHBondContact O-N 3.31Å; G665-S667 PolarHBondContact O-N 3.49Å; G665-S667 VanDerWaalsContact O-N 3.17Å; G665-R668 PolarHBondContact O-N 3.03Å; G665-V669 PolarHBondContact O-N 3.42Å; G665-V669 VanDerWaalsContact O-N 3.12Å
666	W	88.6	Confident	91	Very high	79 Å²	79	27.2 Å²	27.2	30%	0.299	13%	0.133	S	C	.	.	H	α-helix	trans	-45.7	-49	-171	73	-87.2	0	0	0	114.8	L151 F389 E661 V669 A670	L151-W666 HydrophobicContact CD1-CE3 4.44Å; L151-W666 HydrophobicContact CD1-CZ3 4.14Å; L151-W666 HydrophobicContact CD2-CH2 4.41Å; L151-W666 HydrophobicContact CD2-CZ3 3.93Å; F389-W666 HydrophobicContact CB-CB 4.25Å; E661-W666 HydrophobicContact CG-CB 4.24Å; E661-W666 VanDerWaalsContact OE1-CA 3.3Å; E661-W666 WeakPolarHBondContact OE1-CA 3.47Å; E661-W666 WeakPolarHBondContact OE1-CB 3.49Å; W666-V669 PolarHBondContact O-N 2.9Å; W666-A670 VanDerWaalsContact O-CB 3.3Å; W666-A670 WeakPolarHBondContact O-CB 3.43Å; W666-A670 PolarHBondContact O-N 3.15Å
667	S	90.4	Very high	91.3	Very high	54 Å²	54	26.5 Å²	26.5	38%	0.378	13%	0.129	S	C	.	.	H	α-helix	trans	-71.8	-35.9	-173.4	55.5	0	0	0	0	113.3	G665 I671	G665-S667 PolarHBondContact O-N 3.49Å; G665-S667 VanDerWaalsContact O-N 3.17Å; S667-I671 WeakPolarHBondContact O-CD1 3.13Å; S667-I671 WeakPolarHBondContact O-CG1 3.42Å; S667-I671 PolarHBondContact O-N 3.25Å
668	R	93.1	Very high	91.5	Very high	100 Å²	100	28.6 Å²	28.6	38%	0.377	14%	0.14	S	C	.	.	H	α-helix	trans	-72.1	-41.1	177.3	-64.8	-168.8	-166.4	179.2	9.5	111.2	V664 G665 I671 I672 L763	V664-R668 HydrophobicContact CG1-CB 3.81Å; G665-R668 PolarHBondContact O-N 3.03Å; R668-I671 PolarHBondContact O-N 2.73Å; R668-I672 WeakPolarHBondContact O-CG1 3.39Å; R668-I672 PolarHBondContact O-N 2.75Å; R668-L763 VanDerWaalsContact CD-O 3.31Å; R668-L763 WeakPolarHBondContact CD-O 3.49Å; R668-L763 PolarHBondContact NH1-O 3Å
669	V	92.4	Very high	91.8	Very high	2 Å²	2	26 Å²	26	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-68.4	-36.1	177.3	175.8	0	0	0	0	111.3	L657 E661 V664 G665 W666 I671 I672 Y673 L703	L657-V669 HydrophobicContact CD1-CG1 3.32Å; E661-V669 HydrophobicContact CG-CB 4.36Å; V664-V669 HydrophobicContact CB-CG2 3.75Å; V664-V669 HydrophobicContact CG1-CG2 4.23Å; G665-V669 PolarHBondContact O-N 3.42Å; G665-V669 VanDerWaalsContact O-N 3.12Å; W666-V669 PolarHBondContact O-N 2.9Å; V669-I671 PolarHBondContact O-N 3.24Å; V669-I672 PolarHBondContact O-N 3.05Å; V669-Y673 VanDerWaalsContact O-CB 3.29Å; V669-Y673 WeakPolarHBondContact O-CB 3.41Å; V669-Y673 PolarHBondContact O-N 3.12Å; V669-L703 HydrophobicContact CG1-CD2 4.26Å
670	A	93.8	Very high	92.3	Very high	13 Å²	13	25.8 Å²	25.8	11%	0.107	13%	0.129	C	C	.	.	H	α-helix	trans	-59.2	-44.6	171.2	0	0	0	0	0	112.4	F389 W666 Y673 L674	F389-A670 HydrophobicContact CD1-CB 4.33Å; F389-A670 HydrophobicContact CD2-CB 3.54Å; F389-A670 HydrophobicContact CE1-CB 4.32Å; F389-A670 HydrophobicContact CE2-CB 3.51Å; F389-A670 HydrophobicContact CG-CB 3.97Å; F389-A670 HydrophobicContact CZ-CB 3.93Å; W666-A670 VanDerWaalsContact O-CB 3.3Å; W666-A670 WeakPolarHBondContact O-CB 3.43Å; W666-A670 PolarHBondContact O-N 3.15Å; A670-Y673 PolarHBondContact O-N 2.74Å; A670-L674 WeakPolarHBondContact O-CB 3.4Å; A670-L674 VanDerWaalsContact O-CG 3.32Å; A670-L674 WeakPolarHBondContact O-CG 3.05Å; A670-L674 PolarHBondContact O-N 3.28Å
671	I	94.8	Very high	92.5	Very high	82 Å²	82	25.9 Å²	25.9	42%	0.421	13%	0.13	S	C	.	.	H	α-helix	trans	-61.6	-46.2	175.8	-67.2	162.5	0	0	0	111	S667 R668 V669 V675 L763	S667-I671 WeakPolarHBondContact O-CD1 3.13Å; S667-I671 WeakPolarHBondContact O-CG1 3.42Å; S667-I671 PolarHBondContact O-N 3.25Å; R668-I671 PolarHBondContact O-N 2.73Å; V669-I671 PolarHBondContact O-N 3.24Å; I671-V675 HydrophobicContact CG2-CG2 4.33Å; I671-V675 WeakPolarHBondContact O-CB 3.23Å; I671-V675 WeakPolarHBondContact O-CG2 3.42Å; I671-V675 PolarHBondContact O-N 2.8Å; I671-L763 HydrophobicContact CB-CD1 4.22Å; I671-L763 HydrophobicContact CG2-CD1 3.81Å
672	I	95.6	Very high	92.7	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-51.1	177.6	-64.8	170.6	0	0	0	110.2	R668 V669 S676 L759 L763 F764	R668-I672 WeakPolarHBondContact O-CG1 3.39Å; R668-I672 PolarHBondContact O-N 2.75Å; V669-I672 PolarHBondContact O-N 3.05Å; I672-S676 VanDerWaalsContact O-CB 3.26Å; I672-S676 WeakPolarHBondContact O-CB 3.45Å; I672-S676 PolarHBondContact O-N 2.81Å; I672-S676 PolarHBondContact O-OG 2.99Å; I672-L759 HydrophobicContact CG1-CB 4.01Å; I672-L763 HydrophobicContact CD1-CB 4.26Å; I672-L763 HydrophobicContact CD1-CD1 4.33Å; I672-L763 HydrophobicContact CG1-CD1 3.74Å; I672-F764 HydrophobicContact CD1-CD1 3.97Å; I672-F764 HydrophobicContact CD1-CE1 3.64Å
673	Y	96.5	Very high	93	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.4	-50.6	-177.8	180	-84.7	0	0	0	112.3	F389 I393 Q397 Q653 L657 V669 A670 S676 G677 P696 S699 L703	F389-Y673 HydrophobicContact CE1-CD1 4Å; F389-Y673 HydrophobicContact CE1-CD2 4.3Å; F389-Y673 AromaticContact CE1-CG 3.82Å; F389-Y673 HydrophobicContact CE1-CG 3.82Å; F389-Y673 AromaticContact CZ-CD1 3.73Å; F389-Y673 HydrophobicContact CZ-CD1 3.73Å; F389-Y673 HydrophobicContact CZ-CE1 4.31Å; F389-Y673 HydrophobicContact CZ-CG 4.02Å; I393-Y673 HydrophobicContact CD1-CE1 4.19Å; I393-Y673 HydrophobicContact CG1-CE1 3.96Å; I393-Y673 WeakPolarHBondContact CG1-OH 3.49Å; Q397-Y673 PolarHBondContact NE2-OH 3.48Å; Q653-Y673 PolarHBondContact NE2-OH 2.81Å; L657-Y673 HydrophobicContact CD1-CD2 4.13Å; L657-Y673 HydrophobicContact CD2-CD2 4.37Å; L657-Y673 HydrophobicContact CD2-CE2 4.33Å; V669-Y673 VanDerWaalsContact O-CB 3.29Å; V669-Y673 WeakPolarHBondContact O-CB 3.41Å; V669-Y673 PolarHBondContact O-N 3.12Å; A670-Y673 PolarHBondContact O-N 2.74Å; Y673-S676 PolarHBondContact O-OG 2.91Å; Y673-G677 PolarHBondContact O-N 2.91Å; Y673-P696 HydrophobicContact CE2-CB 4.28Å; Y673-P696 WeakPolarHBondContact OH-CB 3.42Å; Y673-P696 WeakPolarHBondContact OH-CG 3.29Å; Y673-S699 VanDerWaalsContact O-CB 3.31Å; Y673-S699 WeakPolarHBondContact O-CB 3.25Å; Y673-S699 PolarHBondContact O-OG 3.06Å; Y673-L703 HydrophobicContact CD2-CD1 4.26Å
674	L	95.2	Very high	93.3	Very high	47 Å²	47	23 Å²	23	25%	0.246	12%	0.117	C	C	.	.	H	α-helix	trans	-70	-46.9	-176.2	-67.2	171.2	0	0	0	112	L634 L637 F638 A670 G677 I678	L634-L674 HydrophobicContact CD1-CD2 4.04Å; L637-L674 HydrophobicContact CD1-CD2 4.43Å; F638-L674 HydrophobicContact CZ-CD2 4.47Å; A670-L674 WeakPolarHBondContact O-CB 3.4Å; A670-L674 VanDerWaalsContact O-CG 3.32Å; A670-L674 WeakPolarHBondContact O-CG 3.05Å; A670-L674 PolarHBondContact O-N 3.28Å; L674-G677 PolarHBondContact O-N 3.45Å; L674-I678 VanDerWaalsContact O-CG1 3.29Å; L674-I678 WeakPolarHBondContact O-CG1 3.4Å; L674-I678 PolarHBondContact O-N 2.98Å
675	V	95.5	Very high	93.5	Very high	47 Å²	47	22.9 Å²	22.9	29%	0.285	12%	0.116	S	C	.	.	H	α-helix	trans	-74.6	-31.4	-175.9	-177.4	0	0	0	0	111.9	I671 G679 L759	I671-V675 HydrophobicContact CG2-CG2 4.33Å; I671-V675 WeakPolarHBondContact O-CB 3.23Å; I671-V675 WeakPolarHBondContact O-CG2 3.42Å; I671-V675 PolarHBondContact O-N 2.8Å; V675-G679 PolarHBondContact O-N 3.14Å; V675-L759 HydrophobicContact CB-CD1 3.67Å; V675-L759 HydrophobicContact CG1-CD1 3.78Å
676	S	97	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69.9	-34.3	169.4	58.2	0	0	0	0	113	I672 Y673 G680 G752	I672-S676 VanDerWaalsContact O-CB 3.26Å; I672-S676 WeakPolarHBondContact O-CB 3.45Å; I672-S676 PolarHBondContact O-N 2.81Å; I672-S676 PolarHBondContact O-OG 2.99Å; Y673-S676 PolarHBondContact O-OG 2.91Å; S676-G680 PolarHBondContact O-N 3.4Å; S676-G752 WeakPolarHBondContact CB-O 3.47Å; S676-G752 WeakPolarHBondContact O-CA 3.33Å
677	G	95.7	Very high	93.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.5	-52.9	172.2	0	0	0	0	0	112.4	Y673 L674 G679 G680 N681 S699	Y673-G677 PolarHBondContact O-N 2.91Å; L674-G677 PolarHBondContact O-N 3.45Å; G677-G679 VanDerWaalsContact C-N 3.33Å; G677-G679 PolarHBondContact O-N 2.82Å; G677-G680 PolarHBondContact O-N 3.49Å; G677-N681 WeakPolarHBondContact O-CB 3.16Å; G677-N681 PolarHBondContact O-N 2.71Å; G677-N681 PolarHBondContact O-OD1 2.83Å; G677-S699 WeakPolarHBondContact CA-OG 3.35Å; G677-S699 PolarHBondContact N-OG 3.06Å
678	I	95.5	Very high	92.8	Very high	45 Å²	45	20 Å²	20	23%	0.231	10%	0.101	C	C	.	.	H	α-helix	trans	-57.8	-44.7	176.7	-67.7	162.4	0	0	0	111.1	L633 L634 L674 N681 L682	L633-I678 HydrophobicContact CB-CG2 4.26Å; L634-I678 HydrophobicContact CB-CG1 4.47Å; L634-I678 HydrophobicContact CD1-CD1 4.3Å; L634-I678 HydrophobicContact CD1-CG1 4.49Å; L674-I678 VanDerWaalsContact O-CG1 3.29Å; L674-I678 WeakPolarHBondContact O-CG1 3.4Å; L674-I678 PolarHBondContact O-N 2.98Å; I678-N681 PolarHBondContact O-N 3.22Å; I678-L682 WeakPolarHBondContact O-CB 3.4Å; I678-L682 PolarHBondContact O-N 3.35Å
679	G	95.6	Very high	92.3	Very high	1 Å²	1	16 Å²	16	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-66.9	-34.2	178.2	0	0	0	0	0	113.7	V675 G677 G683 F751	V675-G679 PolarHBondContact O-N 3.14Å; G677-G679 VanDerWaalsContact C-N 3.33Å; G677-G679 PolarHBondContact O-N 2.82Å; G679-G683 PolarHBondContact O-N 3.46Å; G679-G683 VanDerWaalsContact O-N 3.07Å; G679-F751 WeakPolarHBondContact O-CB 3.48Å
680	G	95.2	Very high	91.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-55.2	169.7	0	0	0	0	0	111.8	S676 G677 L682 G683 S684 A748	S676-G680 PolarHBondContact O-N 3.4Å; G677-G680 PolarHBondContact O-N 3.49Å; G680-L682 VanDerWaalsContact C-N 3.29Å; G680-L682 PolarHBondContact O-N 3.48Å; G680-G683 PolarHBondContact O-N 2.91Å; G680-G683 VanDerWaalsContact O-N 3.11Å; G680-S684 PolarHBondContact O-N 3.45Å; G680-A748 WeakPolarHBondContact CA-O 3.23Å
681	N	94.5	Very high	90.9	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.027	11%	0.107	C	C	.	.	H	α-helix	trans	-59.6	-37.6	-179.4	-64.3	-6.4	0	0	0	112.3	K457 L633 G677 I678 A685	K457-N681 HydrophobicContact CG-CB 4.34Å; L633-N681 HydrophobicContact CD2-CB 4.35Å; L633-N681 PolarHBondContact O-ND2 2.86Å; G677-N681 WeakPolarHBondContact O-CB 3.16Å; G677-N681 PolarHBondContact O-N 2.71Å; G677-N681 PolarHBondContact O-OD1 2.83Å; I678-N681 PolarHBondContact O-N 3.22Å; N681-A685 VanDerWaalsContact O-CB 3.31Å; N681-A685 WeakPolarHBondContact O-CB 3.47Å; N681-A685 PolarHBondContact O-N 3.15Å
682	L	94	Very high	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-70.2	-41	175.1	-179.2	65.5	0	0	0	112	L633 I678 G680 A685 V686 L792 L795 F796 F799	L633-L682 HydrophobicContact CD1-CB 4.44Å; L633-L682 HydrophobicContact CD1-CD1 4.07Å; L633-L682 HydrophobicContact CD2-CB 4.09Å; L633-L682 HydrophobicContact CD2-CD1 4.26Å; I678-L682 WeakPolarHBondContact O-CB 3.4Å; I678-L682 PolarHBondContact O-N 3.35Å; G680-L682 VanDerWaalsContact C-N 3.29Å; G680-L682 PolarHBondContact O-N 3.48Å; L682-A685 PolarHBondContact O-N 3.14Å; L682-V686 WeakPolarHBondContact O-CG2 3.49Å; L682-V686 PolarHBondContact O-N 3.26Å; L682-L792 HydrophobicContact CD2-CD1 3.82Å; L682-L795 HydrophobicContact CD2-CB 3.66Å; L682-L795 HydrophobicContact CG-CB 3.99Å; L682-F796 HydrophobicContact CD1-CD1 4.05Å; L682-F796 HydrophobicContact CD1-CE1 3.95Å; L682-F796 HydrophobicContact CD2-CD1 4.07Å; L682-F796 HydrophobicContact CD2-CD2 4Å; L682-F796 HydrophobicContact CD2-CE1 3.98Å; L682-F796 HydrophobicContact CD2-CE2 3.91Å; L682-F796 HydrophobicContact CD2-CG 4.07Å; L682-F796 HydrophobicContact CD2-CZ 3.9Å; L682-F799 HydrophobicContact CD1-CB 4.24Å; L682-F799 HydrophobicContact CD1-CD2 4.47Å; L682-F799 HydrophobicContact CD1-CG 4.22Å
683	G	92.2	Very high	90.1	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58.8	-50.7	172.7	0	0	0	0	0	111.1	G679 G680 A685 V686 F687	G679-G683 PolarHBondContact O-N 3.46Å; G679-G683 VanDerWaalsContact O-N 3.07Å; G680-G683 PolarHBondContact O-N 2.91Å; G680-G683 VanDerWaalsContact O-N 3.11Å; G683-A685 PolarHBondContact O-N 2.75Å; G683-V686 WeakPolarHBondContact O-CB 3.3Å; G683-V686 PolarHBondContact O-N 3.41Å; G683-V686 VanDerWaalsContact O-N 3.08Å; G683-F687 VanDerWaalsContact O-CD2 3.24Å; G683-F687 WeakPolarHBondContact O-CD2 3.38Å; G683-F687 PolarHBondContact O-N 2.75Å
684	S	90.8	Very high	90	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-54.7	-46.6	174	-177.3	0	0	0	0	112.7	K457 G680 V686 F687 V688 E693 D745	K457-S684 WeakPolarHBondContact CE-OG 3.23Å; K457-S684 PolarHBondContact NZ-OG 3.45Å; G680-S684 PolarHBondContact O-N 3.45Å; S684-V686 PolarHBondContact O-N 2.98Å; S684-V686 VanDerWaalsContact O-N 3.1Å; S684-F687 PolarHBondContact O-N 2.87Å; S684-F687 VanDerWaalsContact O-N 3.16Å; S684-V688 CarbonylContact O-C 3.49Å; S684-V688 PolarHBondContact O-N 2.98Å; S684-E693 PolarHBondContact OG-OE1 3.4Å; S684-E693 PolarHBondContact OG-OE2 2.77Å; S684-D745 WeakPolarHBondContact CB-OD2 3.49Å; S684-D745 PolarHBondContact OG-OD2 3.29Å
685	A	90	Very high	89.8	Confident	1 Å²	1	18 Å²	18	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-65.2	-13.4	178.8	0	0	0	0	0	114.9	K457 M462 N681 L682 G683 F799	K457-A685 HydrophobicContact CD-CB 4.07Å; K457-A685 HydrophobicContact CG-CB 4.47Å; M462-A685 HydrophobicContact CE-CB 3.79Å; N681-A685 VanDerWaalsContact O-CB 3.31Å; N681-A685 WeakPolarHBondContact O-CB 3.47Å; N681-A685 PolarHBondContact O-N 3.15Å; L682-A685 PolarHBondContact O-N 3.14Å; G683-A685 PolarHBondContact O-N 2.75Å; A685-F799 HydrophobicContact CB-CD2 4.2Å; A685-F799 HydrophobicContact CB-CE2 3.8Å
686	V	87.7	Confident	89.8	Confident	4 Å²	4	15.8 Å²	15.8	2%	0.024	8%	0.08	C	C	.	.	H	α-helix	trans	-89.1	-36.5	172.9	170.8	0	0	0	0	112.3	L682 G683 S684 L798 F799 L804	L682-V686 WeakPolarHBondContact O-CG2 3.49Å; L682-V686 PolarHBondContact O-N 3.26Å; G683-V686 WeakPolarHBondContact O-CB 3.3Å; G683-V686 PolarHBondContact O-N 3.41Å; G683-V686 VanDerWaalsContact O-N 3.08Å; S684-V686 PolarHBondContact O-N 2.98Å; S684-V686 VanDerWaalsContact O-N 3.1Å; V686-L798 HydrophobicContact CG1-CB 3.95Å; V686-L798 HydrophobicContact CG2-CB 4.38Å; V686-F799 HydrophobicContact CG2-CB 3.8Å; V686-F799 HydrophobicContact CG2-CD2 4.06Å; V686-F799 HydrophobicContact CG2-CG 4.44Å; V686-L804 HydrophobicContact CG1-CD1 4.35Å; V686-L804 HydrophobicContact CG1-CG 4.48Å
687	F	84	Confident	89.6	Confident	48 Å²	48	17 Å²	17	21%	0.211	9%	0.09	C	C	.	.	H	α-helix	trans	-100.6	-29.9	-174	-66.7	-73	0	0	0	114.3	G683 S684 Y747 F751 L804 C810	G683-F687 VanDerWaalsContact O-CD2 3.24Å; G683-F687 WeakPolarHBondContact O-CD2 3.38Å; G683-F687 PolarHBondContact O-N 2.75Å; S684-F687 PolarHBondContact O-N 2.87Å; S684-F687 VanDerWaalsContact O-N 3.16Å; F687-Y747 HydrophobicContact CB-CD1 3.56Å; F687-Y747 HydrophobicContact CB-CD2 3.99Å; F687-Y747 HydrophobicContact CB-CE1 3.59Å; F687-Y747 HydrophobicContact CB-CE2 4.01Å; F687-Y747 HydrophobicContact CB-CG 3.76Å; F687-Y747 HydrophobicContact CD1-CD1 4.37Å; F687-Y747 AromaticContact CD1-CE1 3.84Å; F687-Y747 HydrophobicContact CD1-CE1 3.84Å; F687-Y747 AromaticContact CD2-CD1 3.45Å; F687-Y747 HydrophobicContact CD2-CD1 3.45Å; F687-Y747 VanDerWaalsContact CD2-CD1 3.45Å; F687-Y747 AromaticContact CD2-CE1 3.76Å; F687-Y747 HydrophobicContact CD2-CE1 3.76Å; F687-Y747 HydrophobicContact CD2-CG 4.26Å; F687-Y747 HydrophobicContact CE1-CE1 4.49Å; F687-Y747 HydrophobicContact CE2-CD1 4.29Å; F687-Y747 HydrophobicContact CE2-CE1 4.46Å; F687-Y747 AromaticContact CG-CD1 3.52Å; F687-Y747 HydrophobicContact CG-CD1 3.52Å; F687-Y747 AromaticContact CG-CE1 3.43Å; F687-Y747 HydrophobicContact CG-CE1 3.43Å; F687-Y747 VanDerWaalsContact CG-CE1 3.43Å; F687-Y747 HydrophobicContact CG-CG 4.23Å; F687-F751 AromaticContact CD2-CE2 3.87Å; F687-F751 HydrophobicContact CD2-CE2 3.87Å; F687-F751 HydrophobicContact CD2-CZ 4.47Å; F687-F751 AromaticContact CE2-CE2 3.48Å; F687-F751 HydrophobicContact CE2-CE2 3.48Å; F687-F751 VanDerWaalsContact CE2-CE2 3.48Å; F687-F751 AromaticContact CE2-CZ 3.65Å; F687-F751 HydrophobicContact CE2-CZ 3.65Å; F687-F751 HydrophobicContact CZ-CZ 4.42Å; F687-L804 HydrophobicContact CD1-CD1 4.46Å; F687-L804 HydrophobicContact CE1-CD1 3.63Å; F687-L804 HydrophobicContact CZ-CD1 4.04Å; F687-C810 HydrophobicContact CD1-CB 4.47Å; F687-C810 VanDerWaalsContact CD1-SG 3.59Å
688	V	79.7	Confident	89.5	Confident	23 Å²	23	17 Å²	17	14%	0.139	9%	0.09	C	C	.	.			trans	-133.9	74.6	180	-161.5	0	0	0	0	109.5	K457 S684 Y690 Q691 Y747	K457-V688 PolarHBondContact NZ-O 2.91Å; S684-V688 CarbonylContact O-C 3.49Å; S684-V688 PolarHBondContact O-N 2.98Å; V688-Y690 PolarHBondContact O-N 3.1Å; V688-Q691 HydrophobicContact CG1-CB 3.54Å; V688-Y747 HydrophobicContact CG2-CD2 3.59Å; V688-Y747 HydrophobicContact CG2-CE2 3.95Å; V688-Y747 HydrophobicContact CG2-CG 4.47Å
689	P	82.1	Confident	89.5	Confident	16 Å²	16	14.9 Å²	14.9	10%	0.104	8%	0.079	C	C	.	.	S	Bend	trans	-69	-32.7	-170.1	24.5	-33	0	0	0	114.4	A459	A459-P689 HydrophobicContact CB-CB 3.53Å; A459-P689 WeakPolarHBondContact CB-O 3.3Å; A459-P689 PolarHBondContact N-O 3.47Å
690	Y	78.7	Confident	89.5	Confident	88 Å²	88	16 Å²	16	35%	0.345	8%	0.084	S	C	.	.	S	Bend	trans	-93.3	-14.2	-172.3	-50.9	-65.2	0	0	0	114.5	Y458 P460 D465 N467 V688 A692	Y458-Y690 VanDerWaalsContact CE2-O 3.31Å; Y458-Y690 WeakPolarHBondContact CE2-O 3.22Å; P460-Y690 HydrophobicContact CG-CD1 4.12Å; P460-Y690 HydrophobicContact CG-CE1 4.21Å; D465-Y690 PolarHBondContact OD1-OH 2.85Å; N467-Y690 PolarHBondContact ND2-OH 2.93Å; V688-Y690 PolarHBondContact O-N 3.1Å; Y690-A692 PolarHBondContact O-N 3.35Å
691	Q	79.2	Confident	89.5	Confident	39 Å²	39	16.7 Å²	16.7	18%	0.182	9%	0.087	C	C	.	.	S	Bend	trans	-74.6	116.8	173.2	-174.8	175.6	-11.1	0	0	109.1	K457 V688 E693	K457-Q691 WeakPolarHBondContact CE-O 3.29Å; K457-Q691 PolarHBondContact NZ-O 2.95Å; V688-Q691 HydrophobicContact CG1-CB 3.54Å; Q691-E693 HydrophobicContact CG-CG 4.31Å
692	A	85.2	Confident	89.5	Confident	12 Å²	12	16.4 Å²	16.4	10%	0.099	9%	0.086	C	C	.	.			trans	-77.7	124.6	173.1	0	0	0	0	0	110.9	Y448 V452 A456 K457 Y458 Y690	Y448-A692 HydrophobicContact CE1-CB 3.92Å; Y448-A692 HydrophobicContact CE2-CB 4.1Å; Y448-A692 WeakPolarHBondContact OH-CB 3.44Å; Y448-A692 PolarHBondContact OH-N 3.22Å; Y448-A692 PolarHBondContact OH-O 2.89Å; V452-A692 HydrophobicContact CG2-CB 3.58Å; A456-A692 HydrophobicContact CB-CB 4.24Å; K457-A692 VanDerWaalsContact O-CA 3.28Å; K457-A692 WeakPolarHBondContact O-CA 3.18Å; Y458-A692 HydrophobicContact CD2-CB 4.48Å; Y690-A692 PolarHBondContact O-N 3.35Å
693	E	88.8	Confident	89.6	Confident	25 Å²	25	16.6 Å²	16.6	12%	0.117	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-124.1	148.3	-178.1	-74.7	159.3	-135.5	0	0	113.9	A456 K457 S684 Q691 D745	A456-E693 WeakPolarHBondContact CA-O 3.49Å; A456-E693 WeakPolarHBondContact CB-O 3.32Å; K457-E693 HydrophobicContact CB-CB 4.24Å; K457-E693 WeakPolarHBondContact CE-OE1 3.27Å; K457-E693 WeakPolarHBondContact CE-OE2 3.44Å; K457-E693 PolarHBondContact N-O 3.16Å; K457-E693 VanDerWaalsContact NZ-CD 3.3Å; K457-E693 IonicContact NZ-OE1 2.69Å; K457-E693 PolarHBondContact NZ-OE1 3.13Å; K457-E693 IonicContact NZ-OE2 2.73Å; K457-E693 PolarHBondContact O-N 3.16Å; K457-E693 VanDerWaalsContact O-N 3.14Å; S684-E693 PolarHBondContact OG-OE1 3.4Å; S684-E693 PolarHBondContact OG-OE2 2.77Å; Q691-E693 HydrophobicContact CG-CG 4.31Å; E693-D745 VanDerWaalsContact CD-CB 3.47Å; E693-D745 HydrophobicContact CG-CB 4.45Å; E693-D745 VanDerWaalsContact OE1-CB 3.22Å; E693-D745 WeakPolarHBondContact OE1-CB 3.33Å
694	V	92.9	Very high	89.6	Confident	19 Å²	19	16.8 Å²	16.8	12%	0.115	9%	0.088	C	C	.	.			trans	-144.9	153.6	178.4	-70.8	0	0	0	0	109.7	L451 A456 L639 A641 H645	L451-V694 HydrophobicContact CD1-CG2 4.41Å; A456-V694 HydrophobicContact CB-CG1 3.63Å; L639-V694 HydrophobicContact CB-CB 3.92Å; L639-V694 HydrophobicContact CB-CG1 3.66Å; L639-V694 HydrophobicContact CD1-CG1 3.95Å; L639-V694 HydrophobicContact CG-CG1 4.47Å; A641-V694 HydrophobicContact CB-CG2 3.82Å; A641-V694 VanDerWaalsContact N-CG2 3.26Å; H645-V694 PolarHBondContact CE1-O 3.15Å
695	G	92.7	Very high	89.9	Confident	6 Å²	6	16.8 Å²	16.8	6%	0.062	9%	0.088	C	C	.	.	S	Bend	trans	102.4	153.5	-177.3	0	0	0	0	0	112.8	P636 L639 A697	P636-G695 CarbonylContact O-C 3.52Å; P636-G695 WeakPolarHBondContact O-CA 3.19Å; P636-G695 PolarHBondContact O-N 3.28Å; L639-G695 VanDerWaalsContact O-CA 3.27Å; L639-G695 WeakPolarHBondContact O-CA 3.32Å; L639-G695 PolarHBondContact O-N 3.24Å; G695-A697 PolarHBondContact O-N 2.05Å; G695-A697 VanDerWaalsContact O-N 3.13Å
696	P	94.7	Very high	90	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-87.9	34.7	-175.1	38.3	-39.5	0	0	0	112.8	L637 H640 T649 Y673 G698 S699 Q700	L637-P696 HydrophobicContact CB-CB 4.5Å; L637-P696 HydrophobicContact CD2-CB 4.46Å; H640-P696 WeakPolarHBondContact NE2-CD 3.09Å; T649-P696 HydrophobicContact CG2-CG 3.58Å; Y673-P696 HydrophobicContact CE2-CB 4.28Å; Y673-P696 WeakPolarHBondContact OH-CB 3.42Å; Y673-P696 WeakPolarHBondContact OH-CG 3.29Å; P696-G698 PolarHBondContact O-N 3Å; P696-S699 WeakPolarHBondContact O-CA 3.36Å; P696-S699 VanDerWaalsContact O-CB 3.27Å; P696-S699 WeakPolarHBondContact O-CB 3.46Å; P696-S699 PolarHBondContact O-N 3.05Å; P696-Q700 WeakPolarHBondContact O-CG 3.31Å; P696-Q700 PolarHBondContact O-N 2.95Å
697	A	92.7	Very high	90.2	Very high	25 Å²	25	16.8 Å²	16.8	21%	0.207	9%	0.087	C	C	.	.	H	α-helix	trans	-63.9	-42.5	-168	0	0	0	0	0	112.3	G695 S699 Q700 F701 H749	G695-A697 PolarHBondContact O-N 2.05Å; G695-A697 VanDerWaalsContact O-N 3.13Å; A697-S699 VanDerWaalsContact C-N 3.3Å; A697-S699 PolarHBondContact O-N 2.81Å; A697-Q700 WeakPolarHBondContact O-CA 3.25Å; A697-Q700 WeakPolarHBondContact O-CB 3.43Å; A697-Q700 PolarHBondContact O-N 3.03Å; A697-F701 PolarHBondContact O-N 2.97Å; A697-H749 VanDerWaalsContact CB-NE2 3.32Å; A697-H749 WeakPolarHBondContact CB-NE2 3.32Å
698	G	93.6	Very high	90.6	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-56.4	-39.9	169.7	0	0	0	0	0	113.4	P696 Q700 F701 G702 A748 G752	P696-G698 PolarHBondContact O-N 3Å; G698-Q700 PolarHBondContact O-N 2.69Å; G698-F701 PolarHBondContact O-N 3.34Å; G698-G702 PolarHBondContact O-N 2.04Å; G698-A748 WeakPolarHBondContact CA-O 3.48Å; G698-G752 CarbonylContact O-C 3.58Å; G698-G752 WeakPolarHBondContact O-CA 3.44Å
699	S	95.7	Very high	91.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.7	-38.2	172.5	-55.1	0	0	0	0	112.4	Y673 G677 P696 A697 G702 L703	Y673-S699 VanDerWaalsContact O-CB 3.31Å; Y673-S699 WeakPolarHBondContact O-CB 3.25Å; Y673-S699 PolarHBondContact O-OG 3.06Å; G677-S699 WeakPolarHBondContact CA-OG 3.35Å; G677-S699 PolarHBondContact N-OG 3.06Å; P696-S699 WeakPolarHBondContact O-CA 3.36Å; P696-S699 VanDerWaalsContact O-CB 3.27Å; P696-S699 WeakPolarHBondContact O-CB 3.46Å; P696-S699 PolarHBondContact O-N 3.05Å; A697-S699 VanDerWaalsContact C-N 3.3Å; A697-S699 PolarHBondContact O-N 2.81Å; S699-G702 PolarHBondContact O-N 3.3Å; S699-L703 WeakPolarHBondContact O-CG 3.35Å; S699-L703 PolarHBondContact O-N 2.84Å
700	Q	94.8	Very high	91.6	Very high	23 Å²	23	14 Å²	14	11%	0.107	7%	0.073	C	C	.	.	H	α-helix	trans	-65.2	-42.8	177.7	-63.4	177.4	33.5	0	0	111.5	T649 I652 P696 A697 G698 G702 L703 L704	T649-Q700 PolarHBondContact OG1-NE2 2.88Å; T649-Q700 VanDerWaalsContact OG1-NE2 3.08Å; I652-Q700 HydrophobicContact CG2-CG 4.37Å; I652-Q700 VanDerWaalsContact CG2-OE1 3.26Å; P696-Q700 WeakPolarHBondContact O-CG 3.31Å; P696-Q700 PolarHBondContact O-N 2.95Å; A697-Q700 WeakPolarHBondContact O-CA 3.25Å; A697-Q700 WeakPolarHBondContact O-CB 3.43Å; A697-Q700 PolarHBondContact O-N 3.03Å; G698-Q700 PolarHBondContact O-N 2.69Å; Q700-G702 VanDerWaalsContact C-N 3.29Å; Q700-G702 PolarHBondContact O-N 2.88Å; Q700-L703 WeakPolarHBondContact O-CB 3.49Å; Q700-L703 PolarHBondContact O-N 2.83Å; Q700-L704 PolarHBondContact O-N 2.94Å
701	F	94.9	Very high	92	Very high	15 Å²	15	9.9 Å²	9.9	7%	0.066	6%	0.057	C	C	.	.	H	α-helix	trans	-63.3	-35.7	171.5	-86.6	-103.6	0	0	0	111.9	A697 G698 L704 A705 L735 F736 H749 F753	A697-F701 PolarHBondContact O-N 2.97Å; G698-F701 PolarHBondContact O-N 3.34Å; F701-L704 WeakPolarHBondContact O-CB 3.31Å; F701-L704 PolarHBondContact O-N 3Å; F701-A705 PolarHBondContact O-N 2.84Å; F701-L735 HydrophobicContact CE1-CB 4.23Å; F701-L735 HydrophobicContact CZ-CB 3.82Å; F701-F736 HydrophobicContact CD1-CE1 4.11Å; F701-F736 AromaticContact CD1-CE2 3.84Å; F701-F736 HydrophobicContact CD1-CE2 3.84Å; F701-F736 AromaticContact CD1-CZ 3.57Å; F701-F736 HydrophobicContact CD1-CZ 3.57Å; F701-F736 HydrophobicContact CE1-CD1 4.07Å; F701-F736 AromaticContact CE1-CD2 3.92Å; F701-F736 HydrophobicContact CE1-CD2 3.92Å; F701-F736 AromaticContact CE1-CE1 3.81Å; F701-F736 HydrophobicContact CE1-CE1 3.81Å; F701-F736 AromaticContact CE1-CE2 3.64Å; F701-F736 HydrophobicContact CE1-CE2 3.64Å; F701-F736 HydrophobicContact CE1-CG 4.13Å; F701-F736 AromaticContact CE1-CZ 3.58Å; F701-F736 HydrophobicContact CE1-CZ 3.58Å; F701-H749 WeakPolarHBondContact CB-O 3.46Å; F701-H749 HydrophobicContact CD1-CB 3.94Å; F701-H749 HydrophobicContact CD2-CB 3.92Å; F701-H749 AromaticContact CD2-CD2 3.32Å; F701-H749 WeakPolarHBondContact CD2-CD2 3.35Å; F701-H749 AromaticContact CD2-CG 3.61Å; F701-H749 AromaticContact CD2-NE2 3.8Å; F701-H749 HydrophobicContact CE1-CB 3.96Å; F701-H749 HydrophobicContact CE2-CB 3.95Å; F701-H749 AromaticContact CE2-CD2 3.33Å; F701-H749 WeakPolarHBondContact CE2-CD2 3.39Å; F701-H749 AromaticContact CE2-CE1 3.55Å; F701-H749 AromaticContact CE2-CG 3.37Å; F701-H749 AromaticContact CE2-ND1 3.54Å; F701-H749 AromaticContact CE2-NE2 3.42Å; F701-H749 WeakPolarHBondContact CE2-NE2 3.25Å; F701-H749 HydrophobicContact CG-CB 3.91Å; F701-H749 HydrophobicContact CZ-CB 3.95Å; F701-H749 AromaticContact CZ-CG 3.69Å; F701-H749 AromaticContact CZ-ND1 3.65Å; F701-F753 HydrophobicContact CB-CB 4.21Å
702	G	95.9	Very high	92.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.8	-37	171.9	0	0	0	0	0	114.2	G698 S699 Q700 G706 G752	G698-G702 PolarHBondContact O-N 2.04Å; S699-G702 PolarHBondContact O-N 3.3Å; Q700-G702 VanDerWaalsContact C-N 3.29Å; Q700-G702 PolarHBondContact O-N 2.88Å; G702-G706 PolarHBondContact O-N 3.27Å; G702-G752 WeakPolarHBondContact CA-O 3.28Å
703	L	95	Very high	92.7	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-67	-37.5	170.6	-64.2	174.2	0	0	0	111.9	L657 L660 V669 Y673 S699 Q700 G706 L707	L657-L703 HydrophobicContact CB-CD1 3.77Å; L657-L703 HydrophobicContact CD1-CD1 3.76Å; L657-L703 HydrophobicContact CD1-CD2 3.74Å; L657-L703 HydrophobicContact CD1-CG 4.4Å; L657-L703 HydrophobicContact CG-CD1 4.32Å; L660-L703 HydrophobicContact CD1-CB 3.75Å; L660-L703 HydrophobicContact CD1-CD2 3.79Å; L660-L703 HydrophobicContact CD1-CG 4.3Å; L660-L703 WeakPolarHBondContact CD1-O 3.44Å; V669-L703 HydrophobicContact CG1-CD2 4.26Å; Y673-L703 HydrophobicContact CD2-CD1 4.26Å; S699-L703 WeakPolarHBondContact O-CG 3.35Å; S699-L703 PolarHBondContact O-N 2.84Å; Q700-L703 WeakPolarHBondContact O-CB 3.49Å; Q700-L703 PolarHBondContact O-N 2.83Å; L703-G706 WeakPolarHBondContact O-CA 3.29Å; L703-G706 PolarHBondContact O-N 3.28Å; L703-L707 PolarHBondContact O-N 3.04Å; L703-L707 VanDerWaalsContact O-N 3.08Å
704	L	93.6	Very high	92.4	Very high	4 Å²	4	10.5 Å²	10.5	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-65.6	-39.4	178.3	-173.9	61.1	0	0	0	111.7	Q700 F701 G706 L707 I708 L728 F731 V732 L735	Q700-L704 PolarHBondContact O-N 2.94Å; F701-L704 WeakPolarHBondContact O-CB 3.31Å; F701-L704 PolarHBondContact O-N 3Å; L704-G706 VanDerWaalsContact C-N 3.28Å; L704-G706 PolarHBondContact O-N 3.35Å; L704-L707 HydrophobicContact CD1-CD1 4.31Å; L704-L707 WeakPolarHBondContact O-CB 3.41Å; L704-L707 PolarHBondContact O-N 2.96Å; L704-L707 VanDerWaalsContact O-N 3.1Å; L704-I708 PolarHBondContact O-N 3.41Å; L704-L728 HydrophobicContact CD1-CD1 3.85Å; L704-F731 HydrophobicContact CD1-CD1 4.19Å; L704-F731 HydrophobicContact CD1-CE1 4.23Å; L704-V732 HydrophobicContact CD1-CG2 4.23Å; L704-V732 HydrophobicContact CD2-CB 4.25Å; L704-V732 HydrophobicContact CD2-CG1 4.42Å; L704-V732 HydrophobicContact CD2-CG2 3.53Å; L704-V732 HydrophobicContact CG-CG2 3.69Å; L704-L735 HydrophobicContact CD2-CD1 3.75Å
705	A	95.1	Very high	92.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.9	-38.6	167.8	0	0	0	0	0	112.1	F701 L707 I708 V709 F753 L757	F701-A705 PolarHBondContact O-N 2.84Å; A705-L707 VanDerWaalsContact C-N 3.31Å; A705-L707 PolarHBondContact O-N 3.33Å; A705-I708 WeakPolarHBondContact O-CB 3.33Å; A705-I708 PolarHBondContact O-N 3.47Å; A705-I708 VanDerWaalsContact O-N 3.08Å; A705-V709 PolarHBondContact O-N 2.92Å; A705-F753 HydrophobicContact CB-CD1 4.49Å; A705-F753 HydrophobicContact CB-CD2 3.77Å; A705-F753 HydrophobicContact CB-CE2 3.82Å; A705-F753 HydrophobicContact CB-CG 4.13Å; A705-F753 HydrophobicContact CB-CZ 4.23Å; A705-F753 WeakPolarHBondContact CB-O 3.13Å; A705-L757 HydrophobicContact CB-CB 3.94Å
706	G	93.1	Very high	91.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.3	-36.2	171.8	0	0	0	0	0	114.1	G702 L703 L704 I708 V709 D710 S760 F764	G702-G706 PolarHBondContact O-N 3.27Å; L703-G706 WeakPolarHBondContact O-CA 3.29Å; L703-G706 PolarHBondContact O-N 3.28Å; L704-G706 VanDerWaalsContact C-N 3.28Å; L704-G706 PolarHBondContact O-N 3.35Å; G706-I708 VanDerWaalsContact C-N 3.3Å; G706-I708 PolarHBondContact O-N 2.92Å; G706-V709 PolarHBondContact O-N 3.35Å; G706-D710 PolarHBondContact O-N 2.77Å; G706-S760 VanDerWaalsContact CA-OG 3.22Å; G706-S760 WeakPolarHBondContact CA-OG 3.14Å; G706-F764 WeakPolarHBondContact O-CE2 3.46Å; G706-F764 WeakPolarHBondContact O-CZ 3.32Å
707	L	91	Very high	90.9	Very high	5 Å²	5	18.9 Å²	18.9	3%	0.026	9%	0.092	C	C	.	.	H	α-helix	trans	-68.9	-26.5	173.8	-69.9	174.2	0	0	0	113.2	V357 L656 L660 L703 L704 A705 V711 L728	V357-L707 HydrophobicContact CG2-CD1 3.8Å; L656-L707 HydrophobicContact CD2-CD1 3.78Å; L660-L707 HydrophobicContact CD1-CG 4.43Å; L660-L707 HydrophobicContact CD2-CD2 3.72Å; L660-L707 HydrophobicContact CD2-CG 4.26Å; L660-L707 HydrophobicContact CG-CD2 4.17Å; L703-L707 PolarHBondContact O-N 3.04Å; L703-L707 VanDerWaalsContact O-N 3.08Å; L704-L707 HydrophobicContact CD1-CD1 4.31Å; L704-L707 WeakPolarHBondContact O-CB 3.41Å; L704-L707 PolarHBondContact O-N 2.96Å; L704-L707 VanDerWaalsContact O-N 3.1Å; A705-L707 VanDerWaalsContact C-N 3.31Å; A705-L707 PolarHBondContact O-N 3.33Å; L707-V711 WeakPolarHBondContact O-CG2 3.41Å; L707-V711 PolarHBondContact O-N 3.08Å; L707-L728 HydrophobicContact CB-CD2 3.93Å; L707-L728 WeakPolarHBondContact O-CD2 3.29Å
708	I	92.7	Very high	90.3	Very high	22 Å²	22	17.8 Å²	17.8	11%	0.113	8%	0.083	C	C	.	.	H	α-helix	trans	-70.9	-44.2	170.9	-63.2	170.1	0	0	0	109.7	L704 A705 G706 D710 V711 V712 L725 L728 V732 F753	L704-I708 PolarHBondContact O-N 3.41Å; A705-I708 WeakPolarHBondContact O-CB 3.33Å; A705-I708 PolarHBondContact O-N 3.47Å; A705-I708 VanDerWaalsContact O-N 3.08Å; G706-I708 VanDerWaalsContact C-N 3.3Å; G706-I708 PolarHBondContact O-N 2.92Å; I708-D710 VanDerWaalsContact C-N 3.32Å; I708-D710 PolarHBondContact O-N 2.89Å; I708-V711 PolarHBondContact O-N 3.1Å; I708-V711 VanDerWaalsContact O-N 3.13Å; I708-V712 HydrophobicContact CG2-CG2 4.36Å; I708-V712 WeakPolarHBondContact O-CG2 3.41Å; I708-V712 PolarHBondContact O-N 3.23Å; I708-L725 HydrophobicContact CG2-CD1 3.82Å; I708-L728 HydrophobicContact CB-CD2 4.38Å; I708-L728 HydrophobicContact CG1-CD2 3.59Å; I708-L728 HydrophobicContact CG1-CG 3.98Å; I708-V732 HydrophobicContact CD1-CG2 4.11Å; I708-F753 HydrophobicContact CD1-CE2 3.75Å; I708-F753 HydrophobicContact CD1-CZ 3.56Å
709	V	93	Very high	89.8	Confident	3 Å²	3	19.9 Å²	19.9	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-61.2	-38.3	176	176.9	0	0	0	0	111.9	A705 G706 V711 V712 Y713 L757 L761 F764	A705-V709 PolarHBondContact O-N 2.92Å; G706-V709 PolarHBondContact O-N 3.35Å; V709-V711 PolarHBondContact O-N 3.03Å; V709-V712 PolarHBondContact O-N 3.28Å; V709-Y713 HydrophobicContact CG1-CD2 3.71Å; V709-Y713 HydrophobicContact CG1-CE1 4.35Å; V709-Y713 HydrophobicContact CG1-CE2 3.45Å; V709-Y713 VanDerWaalsContact CG1-CE2 3.45Å; V709-Y713 HydrophobicContact CG1-CG 4.26Å; V709-Y713 WeakPolarHBondContact O-CB 3.04Å; V709-Y713 PolarHBondContact O-N 2.94Å; V709-L757 HydrophobicContact CG2-CD1 3.77Å; V709-L761 HydrophobicContact CG1-CD2 4.19Å; V709-L761 HydrophobicContact CG2-CD2 4.06Å; V709-L761 HydrophobicContact CG2-CG 4.06Å; V709-F764 HydrophobicContact CG1-CB 4.45Å; V709-F764 HydrophobicContact CG1-CD2 4.24Å; V709-F764 HydrophobicContact CG1-CG 4.36Å
710	D	89.7	Confident	89.3	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-56.9	-46.6	171.8	-171.8	11.8	0	0	0	111.6	R350 G353 G706 I708 S714 F764	R350-D710 IonicContact NH1-OD2 3.03Å; R350-D710 IonicContact NH2-OD2 3.34Å; G353-D710 PolarHBondContact N-OD1 3.47Å; G706-D710 PolarHBondContact O-N 2.77Å; I708-D710 VanDerWaalsContact C-N 3.32Å; I708-D710 PolarHBondContact O-N 2.89Å; D710-S714 WeakPolarHBondContact O-CB 3.49Å; D710-S714 PolarHBondContact O-N 3.11Å; D710-S714 PolarHBondContact O-OG 3.35Å; D710-S714 PolarHBondContact OD1-OG 3.19Å; D710-F764 HydrophobicContact CB-CE2 4.2Å
711	V	87.9	Confident	88.8	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-64.8	-42.1	177	174.5	0	0	0	0	112	R363 L707 I708 V709 S714 W715 I718 A724 L725 L728	R363-V711 VanDerWaalsContact NH1-CG2 3.26Å; L707-V711 WeakPolarHBondContact O-CG2 3.41Å; L707-V711 PolarHBondContact O-N 3.08Å; I708-V711 PolarHBondContact O-N 3.1Å; I708-V711 VanDerWaalsContact O-N 3.13Å; V709-V711 PolarHBondContact O-N 3.03Å; V711-S714 CarbonylContact O-C 3.53Å; V711-S714 PolarHBondContact O-N 3.31Å; V711-W715 PolarHBondContact O-N 3.39Å; V711-W715 VanDerWaalsContact O-N 3.1Å; V711-I718 HydrophobicContact CG1-CD1 4.16Å; V711-A724 HydrophobicContact CG1-CB 4.35Å; V711-L725 HydrophobicContact CG1-CB 4.06Å; V711-L728 HydrophobicContact CG2-CD2 4.38Å
712	V	89.6	Confident	88.5	Confident	69 Å²	69	35.6 Å²	35.6	42%	0.418	16%	0.16	S	C	.	.	H	α-helix	trans	-68.1	-40.2	-179.8	172.1	0	0	0	0	111.7	I708 V709 W715	I708-V712 HydrophobicContact CG2-CG2 4.36Å; I708-V712 WeakPolarHBondContact O-CG2 3.41Å; I708-V712 PolarHBondContact O-N 3.23Å; V709-V712 PolarHBondContact O-N 3.28Å; V712-W715 WeakPolarHBondContact O-CB 3.42Å; V712-W715 PolarHBondContact O-N 2.88Å
713	Y	88.6	Confident	88.2	Confident	21 Å²	21	43.4 Å²	43.4	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-73.7	-29.1	173	-68.2	-12.6	0	0	0	112.3	V709 W715 L761 F764 Y766 R777	V709-Y713 HydrophobicContact CG1-CD2 3.71Å; V709-Y713 HydrophobicContact CG1-CE1 4.35Å; V709-Y713 HydrophobicContact CG1-CE2 3.45Å; V709-Y713 VanDerWaalsContact CG1-CE2 3.45Å; V709-Y713 HydrophobicContact CG1-CG 4.26Å; V709-Y713 WeakPolarHBondContact O-CB 3.04Å; V709-Y713 PolarHBondContact O-N 2.94Å; Y713-W715 VanDerWaalsContact C-N 3.29Å; Y713-W715 PolarHBondContact O-N 3.36Å; Y713-L761 HydrophobicContact CE1-CD2 4.27Å; Y713-L761 PolarHBondContact OH-O 3.32Å; Y713-F764 HydrophobicContact CD2-CB 4.28Å; Y713-F764 HydrophobicContact CE2-CB 4.05Å; Y713-Y766 AromaticContact CD1-CD2 3.8Å; Y713-Y766 HydrophobicContact CD1-CD2 3.8Å; Y713-Y766 AromaticContact CD1-CE2 3.91Å; Y713-Y766 HydrophobicContact CD1-CE2 3.91Å; Y713-Y766 HydrophobicContact CD2-CD2 4.07Å; Y713-Y766 AromaticContact CE1-CD2 3.86Å; Y713-Y766 HydrophobicContact CE1-CD2 3.86Å; Y713-Y766 HydrophobicContact CE1-CE2 4.06Å; Y713-Y766 HydrophobicContact CE2-CD2 4.16Å; Y713-Y766 AromaticContact CG-CD2 3.9Å; Y713-Y766 HydrophobicContact CG-CD2 3.9Å; Y713-Y766 HydrophobicContact CG-CE2 4.35Å; Y713-R777 PolarHBondContact OH-NH1 3.01Å; Y713-R777 VanDerWaalsContact OH-NH1 3.16Å
714	S	83.7	Confident	87.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	0.1	174.3	-64.7	0	0	0	0	115	F352 G353 D710 V711 K716 M717 I718	F352-S714 VanDerWaalsContact CD1-OG 3.24Å; F352-S714 WeakPolarHBondContact CD1-OG 3.48Å; F352-S714 VanDerWaalsContact CE1-OG 3.3Å; F352-S714 WeakPolarHBondContact CE1-OG 3.44Å; G353-S714 WeakPolarHBondContact CA-OG 3.41Å; D710-S714 WeakPolarHBondContact O-CB 3.49Å; D710-S714 PolarHBondContact O-N 3.11Å; D710-S714 PolarHBondContact O-OG 3.35Å; D710-S714 PolarHBondContact OD1-OG 3.19Å; V711-S714 CarbonylContact O-C 3.53Å; V711-S714 PolarHBondContact O-N 3.31Å; S714-K716 VanDerWaalsContact C-N 3.28Å; S714-K716 PolarHBondContact O-N 3.07Å; S714-M717 WeakPolarHBondContact O-CA 3.5Å; S714-M717 PolarHBondContact O-N 3.49Å; S714-I718 PolarHBondContact O-N 3.23Å; S714-I718 VanDerWaalsContact O-N 3.16Å
715	W	86.1	Confident	87.6	Confident	78 Å²	78	44.7 Å²	44.7	30%	0.295	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-38.5	-165.6	-164.8	-90.6	0	0	0	115.4	V711 V712 Y713 P721 W722 L725	V711-W715 PolarHBondContact O-N 3.39Å; V711-W715 VanDerWaalsContact O-N 3.1Å; V712-W715 WeakPolarHBondContact O-CB 3.42Å; V712-W715 PolarHBondContact O-N 2.88Å; Y713-W715 VanDerWaalsContact C-N 3.29Å; Y713-W715 PolarHBondContact O-N 3.36Å; W715-P721 HydrophobicContact CD2-CB 3.56Å; W715-P721 HydrophobicContact CD2-CG 3.99Å; W715-P721 HydrophobicContact CE3-CB 3.69Å; W715-P721 HydrophobicContact CG-CB 4.02Å; W715-P721 HydrophobicContact CG-CG 4.26Å; W715-P721 HydrophobicContact CH2-CB 4.25Å; W715-P721 HydrophobicContact CZ2-CB 4.13Å; W715-P721 HydrophobicContact CZ2-CG 4.15Å; W715-P721 HydrophobicContact CZ3-CB 4.02Å; W715-W722 AromaticContact CH2-CD2 3.65Å; W715-W722 HydrophobicContact CH2-CD2 3.65Å; W715-W722 AromaticContact CH2-CE2 3.95Å; W715-W722 AromaticContact CH2-CE3 3.77Å; W715-W722 HydrophobicContact CH2-CE3 3.77Å; W715-W722 HydrophobicContact CH2-CG 4.08Å; W715-W722 HydrophobicContact CH2-CH2 4.41Å; W715-W722 HydrophobicContact CH2-CZ2 4.33Å; W715-W722 HydrophobicContact CH2-CZ3 4.15Å; W715-W722 AromaticContact CZ2-CD2 3.71Å; W715-W722 HydrophobicContact CZ2-CD2 3.71Å; W715-W722 AromaticContact CZ2-CE2 3.56Å; W715-W722 HydrophobicContact CZ2-CE3 4.25Å; W715-W722 HydrophobicContact CZ2-CG 4.02Å; W715-W722 HydrophobicContact CZ2-CH2 4.47Å; W715-W722 AromaticContact CZ2-CZ2 3.97Å; W715-W722 HydrophobicContact CZ2-CZ2 3.97Å; W715-W722 AromaticContact CZ2-NE1 3.76Å; W715-L725 HydrophobicContact CH2-CD2 4.2Å; W715-L725 HydrophobicContact CZ3-CB 4.2Å; W715-L725 HydrophobicContact CZ3-CD2 3.85Å
716	K	83.6	Confident	87.4	Confident	119 Å²	119	46.2 Å²	46.2	52%	0.517	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.7	178.9	-68.2	-179.1	179.6	175.4	0	114	R366 S714 F769	R366-K716 WeakPolarHBondContact CD-O 3.47Å; R366-K716 PolarHBondContact NE-O 3.37Å; S714-K716 VanDerWaalsContact C-N 3.28Å; S714-K716 PolarHBondContact O-N 3.07Å; K716-F769 HydrophobicContact CB-CE1 4.08Å; K716-F769 HydrophobicContact CB-CZ 3.95Å; K716-F769 HydrophobicContact CD-CD1 3.84Å; K716-F769 HydrophobicContact CD-CD2 4.03Å; K716-F769 HydrophobicContact CD-CE1 3.91Å; K716-F769 HydrophobicContact CD-CE2 4.1Å; K716-F769 HydrophobicContact CD-CG 3.91Å; K716-F769 HydrophobicContact CD-CZ 4.04Å
717	M	77.7	Confident	87.2	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.015	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-24	-174.5	-55.5	-169.8	-67.9	0	0	112.8	F352 L365 R366 L371 V375 L379 S714 I767 F769	F352-M717 HydrophobicContact CB-CE 4.43Å; F352-M717 HydrophobicContact CD1-CE 3.43Å; F352-M717 VanDerWaalsContact CD1-CE 3.43Å; F352-M717 HydrophobicContact CE1-CE 3.92Å; F352-M717 HydrophobicContact CG-CE 4.11Å; L365-M717 HydrophobicContact CD2-CB 4.2Å; R366-M717 WeakPolarHBondContact CB-O 3.38Å; R366-M717 WeakPolarHBondContact CG-O 3.49Å; R366-M717 PolarHBondContact N-O 2.97Å; L371-M717 HydrophobicContact CD2-CB 4.37Å; L371-M717 HydrophobicContact CD2-CG 3.85Å; L371-M717 HydrophobicContact CD2-SD 3.96Å; V375-M717 HydrophobicContact CG1-SD 4.2Å; L379-M717 HydrophobicContact CD1-SD 3.95Å; L379-M717 HydrophobicContact CD2-SD 4.31Å; S714-M717 WeakPolarHBondContact O-CA 3.5Å; S714-M717 PolarHBondContact O-N 3.49Å; M717-I767 HydrophobicContact CE-CD1 3.49Å; M717-I767 VanDerWaalsContact CE-CD1 3.49Å; M717-I767 HydrophobicContact SD-CD1 3.99Å; M717-F769 HydrophobicContact CG-CZ 4.27Å
718	I	82.1	Confident	87.1	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.015	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-77.7	142.2	174.9	-62.5	168.5	0	0	0	109.6	L365 R366 V711 S714 P721 A724	L365-I718 HydrophobicContact CD2-CG1 4.35Å; R366-I718 PolarHBondContact NE-O 3.45Å; V711-I718 HydrophobicContact CG1-CD1 4.16Å; S714-I718 PolarHBondContact O-N 3.23Å; S714-I718 VanDerWaalsContact O-N 3.16Å; I718-P721 HydrophobicContact CB-CB 4.35Å; I718-P721 HydrophobicContact CG2-CB 4.42Å; I718-A724 HydrophobicContact CG2-CB 4.18Å
719	A	81.8	Confident	87	Confident	44 Å²	44	51.4 Å²	51.4	36%	0.364	24%	0.24	S	C	.	.	S	Bend	trans	-72	-35.7	-180	0	0	0	0	0	112.9	T364 R366	T364-A719 WeakPolarHBondContact O-CB 3.41Å; T364-A719 PolarHBondContact O-N 2.81Å; R366-A719 HydrophobicContact CG-CB 4.44Å
720	R	85.2	Confident	87	Confident	155 Å²	155	55.3 Å²	55.3	59%	0.585	26%	0.264	S	S	*	.	S	Bend	trans	-134	68	-178.9	-63	178.8	179.9	152.7	-3.2	111.5	W722 R723 A724	R720-W722 PolarHBondContact O-N 2.69Å; R720-R723 HydrophobicContact CB-CB 4.41Å; R720-R723 HydrophobicContact CB-CG 4.48Å; R720-R723 PolarHBondContact O-N 3.1Å; R720-A724 PolarHBondContact O-N 3.08Å
721	P	85.2	Confident	87	Confident	15 Å²	15	59.4 Å²	59.4	10%	0.097	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-39.8	-169.1	24.2	-34.5	0	0	0	113.7	W715 I718 R723 A724 L725	W715-P721 HydrophobicContact CD2-CB 3.56Å; W715-P721 HydrophobicContact CD2-CG 3.99Å; W715-P721 HydrophobicContact CE3-CB 3.69Å; W715-P721 HydrophobicContact CG-CB 4.02Å; W715-P721 HydrophobicContact CG-CG 4.26Å; W715-P721 HydrophobicContact CH2-CB 4.25Å; W715-P721 HydrophobicContact CZ2-CB 4.13Å; W715-P721 HydrophobicContact CZ2-CG 4.15Å; W715-P721 HydrophobicContact CZ3-CB 4.02Å; I718-P721 HydrophobicContact CB-CB 4.35Å; I718-P721 HydrophobicContact CG2-CB 4.42Å; P721-R723 VanDerWaalsContact C-N 3.3Å; P721-R723 PolarHBondContact O-N 2.79Å; P721-A724 WeakPolarHBondContact O-CB 3.41Å; P721-A724 PolarHBondContact O-N 3.5Å; P721-A724 VanDerWaalsContact O-N 3.14Å; P721-L725 PolarHBondContact O-N 3.18Å
722	W	88.6	Confident	87.2	Confident	198 Å²	198	59.7 Å²	59.7	75%	0.75	28%	0.284	S	S	*	.	H	α-helix	trans	-56.1	-40	175.6	-74.4	113.9	0	0	0	113.6	W715 R720 G726	W715-W722 AromaticContact CH2-CD2 3.65Å; W715-W722 HydrophobicContact CH2-CD2 3.65Å; W715-W722 AromaticContact CH2-CE2 3.95Å; W715-W722 AromaticContact CH2-CE3 3.77Å; W715-W722 HydrophobicContact CH2-CE3 3.77Å; W715-W722 HydrophobicContact CH2-CG 4.08Å; W715-W722 HydrophobicContact CH2-CH2 4.41Å; W715-W722 HydrophobicContact CH2-CZ2 4.33Å; W715-W722 HydrophobicContact CH2-CZ3 4.15Å; W715-W722 AromaticContact CZ2-CD2 3.71Å; W715-W722 HydrophobicContact CZ2-CD2 3.71Å; W715-W722 AromaticContact CZ2-CE2 3.56Å; W715-W722 HydrophobicContact CZ2-CE3 4.25Å; W715-W722 HydrophobicContact CZ2-CG 4.02Å; W715-W722 HydrophobicContact CZ2-CH2 4.47Å; W715-W722 AromaticContact CZ2-CZ2 3.97Å; W715-W722 HydrophobicContact CZ2-CZ2 3.97Å; W715-W722 AromaticContact CZ2-NE1 3.76Å; R720-W722 PolarHBondContact O-N 2.69Å; W722-G726 PolarHBondContact O-N 3.16Å
723	R	88.9	Confident	87.3	Confident	165 Å²	165	59.6 Å²	59.6	62%	0.623	29%	0.285	S	S	*	.	H	α-helix	trans	-70	-43.9	176.2	-62.8	-170	-172.7	-174.6	-0	111	R720 P721 L725 G726 Q727	R720-R723 HydrophobicContact CB-CB 4.41Å; R720-R723 HydrophobicContact CB-CG 4.48Å; R720-R723 PolarHBondContact O-N 3.1Å; P721-R723 VanDerWaalsContact C-N 3.3Å; P721-R723 PolarHBondContact O-N 2.79Å; R723-L725 VanDerWaalsContact C-N 3.3Å; R723-L725 PolarHBondContact O-N 2.87Å; R723-G726 PolarHBondContact O-N 3.11Å; R723-Q727 WeakPolarHBondContact O-CB 3.47Å; R723-Q727 VanDerWaalsContact O-CG 3.24Å; R723-Q727 WeakPolarHBondContact O-CG 3.39Å; R723-Q727 PolarHBondContact O-N 3.28Å; R723-Q727 PolarHBondContact O-OE1 3.34Å
724	A	84.8	Confident	87.4	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-36.9	178	0	0	0	0	0	113.2	R363 V711 I718 R720 P721	R363-A724 HydrophobicContact CG-CB 4Å; R363-A724 PolarHBondContact NH2-O 3.4Å; V711-A724 HydrophobicContact CG1-CB 4.35Å; I718-A724 HydrophobicContact CG2-CB 4.18Å; R720-A724 PolarHBondContact O-N 3.08Å; P721-A724 WeakPolarHBondContact O-CB 3.41Å; P721-A724 PolarHBondContact O-N 3.5Å; P721-A724 VanDerWaalsContact O-N 3.14Å
725	L	90.7	Very high	87.7	Confident	31 Å²	31	66 Å²	66	16%	0.162	32%	0.32	C	S	.	.	H	α-helix	trans	-72.5	-51.9	172.6	178.8	62.3	0	0	0	110.9	I708 V711 W715 P721 R723 Q727 L728 V729	I708-L725 HydrophobicContact CG2-CD1 3.82Å; V711-L725 HydrophobicContact CG1-CB 4.06Å; W715-L725 HydrophobicContact CH2-CD2 4.2Å; W715-L725 HydrophobicContact CZ3-CB 4.2Å; W715-L725 HydrophobicContact CZ3-CD2 3.85Å; P721-L725 PolarHBondContact O-N 3.18Å; R723-L725 VanDerWaalsContact C-N 3.3Å; R723-L725 PolarHBondContact O-N 2.87Å; L725-Q727 PolarHBondContact O-N 3.25Å; L725-L728 WeakPolarHBondContact O-CA 3.39Å; L725-L728 PolarHBondContact O-N 2.82Å; L725-V729 HydrophobicContact CD1-CG2 3.87Å; L725-V729 HydrophobicContact CG-CG2 4.15Å; L725-V729 WeakPolarHBondContact O-CG2 3.22Å; L725-V729 PolarHBondContact O-N 3.07Å
726	G	90.8	Very high	87.9	Confident	32 Å²	32	64.6 Å²	64.6	33%	0.33	32%	0.316	S	S	.	.	H	α-helix	trans	-54	-49.2	-179.2	0	0	0	0	0	112.8	W722 R723 L728 V729 T730	W722-G726 PolarHBondContact O-N 3.16Å; R723-G726 PolarHBondContact O-N 3.11Å; G726-L728 PolarHBondContact O-N 3.14Å; G726-V729 PolarHBondContact O-N 2.95Å; G726-T730 WeakPolarHBondContact O-CB 3.38Å; G726-T730 PolarHBondContact O-N 3.34Å; G726-T730 PolarHBondContact O-OG1 3.48Å
727	Q	89.1	Confident	88	Confident	76 Å²	76	64 Å²	64	36%	0.355	32%	0.318	S	S	.	.	H	α-helix	trans	-55	-37.9	174.8	-71.3	169.1	-63.4	0	0	113.1	L361 R723 L725 F731	L361-Q727 HydrophobicContact CD1-CB 4.04Å; L361-Q727 HydrophobicContact CD2-CB 4.23Å; L361-Q727 PolarHBondContact O-NE2 2.87Å; R723-Q727 WeakPolarHBondContact O-CB 3.47Å; R723-Q727 VanDerWaalsContact O-CG 3.24Å; R723-Q727 WeakPolarHBondContact O-CG 3.39Å; R723-Q727 PolarHBondContact O-N 3.28Å; R723-Q727 PolarHBondContact O-OE1 3.34Å; L725-Q727 PolarHBondContact O-N 3.25Å; Q727-F731 WeakPolarHBondContact O-CB 3.43Å; Q727-F731 PolarHBondContact O-N 2.87Å; Q727-F731 VanDerWaalsContact O-N 3.14Å
728	L	88.8	Confident	88.3	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-78.5	-38.1	-179	-174.3	60.3	0	0	0	111.8	L704 L707 I708 V711 L725 G726 F731 V732	L704-L728 HydrophobicContact CD1-CD1 3.85Å; L707-L728 HydrophobicContact CB-CD2 3.93Å; L707-L728 WeakPolarHBondContact O-CD2 3.29Å; I708-L728 HydrophobicContact CB-CD2 4.38Å; I708-L728 HydrophobicContact CG1-CD2 3.59Å; I708-L728 HydrophobicContact CG1-CG 3.98Å; V711-L728 HydrophobicContact CG2-CD2 4.38Å; L725-L728 WeakPolarHBondContact O-CA 3.39Å; L725-L728 PolarHBondContact O-N 2.82Å; G726-L728 PolarHBondContact O-N 3.14Å; L728-F731 HydrophobicContact CD1-CD1 4.46Å; L728-F731 PolarHBondContact O-N 2.69Å; L728-V732 WeakPolarHBondContact O-CG2 3.3Å; L728-V732 PolarHBondContact O-N 2.82Å
729	V	92.2	Very high	88	Confident	61 Å²	61	67.6 Å²	67.6	37%	0.37	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-44.5	173.7	173.6	0	0	0	0	110.4	L725 G726 F731 V732 C733	L725-V729 HydrophobicContact CD1-CG2 3.87Å; L725-V729 HydrophobicContact CG-CG2 4.15Å; L725-V729 WeakPolarHBondContact O-CG2 3.22Å; L725-V729 PolarHBondContact O-N 3.07Å; G726-V729 PolarHBondContact O-N 2.95Å; V729-F731 VanDerWaalsContact C-N 3.3Å; V729-F731 PolarHBondContact O-N 2.96Å; V729-V732 WeakPolarHBondContact O-CB 3.43Å; V729-V732 PolarHBondContact O-N 3.25Å; V729-V732 VanDerWaalsContact O-N 3.13Å; V729-C733 PolarHBondContact O-N 3.34Å; V729-C733 PolarHBondContact O-SG 2.9Å
730	T	92	Very high	87.6	Confident	84 Å²	84	69.2 Å²	69.2	52%	0.515	34%	0.342	S	S	.	.	H	α-helix	trans	-57.8	-42.6	173	-57.1	0	0	0	0	111.7	G726 C733 L734	G726-T730 WeakPolarHBondContact O-CB 3.38Å; G726-T730 PolarHBondContact O-N 3.34Å; G726-T730 PolarHBondContact O-OG1 3.48Å; T730-C733 PolarHBondContact O-N 3.32Å; T730-L734 HydrophobicContact CG2-CD1 4.16Å; T730-L734 WeakPolarHBondContact O-CB 3.49Å; T730-L734 VanDerWaalsContact O-CG 3.3Å; T730-L734 WeakPolarHBondContact O-CG 3.29Å; T730-L734 PolarHBondContact O-N 3.43Å
731	F	90.5	Very high	86.8	Confident	89 Å²	89	66.6 Å²	66.6	39%	0.39	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.1	180	-105.8	0	0	0	112.7	L704 Q727 L728 V729 L734 L735	L704-F731 HydrophobicContact CD1-CD1 4.19Å; L704-F731 HydrophobicContact CD1-CE1 4.23Å; Q727-F731 WeakPolarHBondContact O-CB 3.43Å; Q727-F731 PolarHBondContact O-N 2.87Å; Q727-F731 VanDerWaalsContact O-N 3.14Å; L728-F731 HydrophobicContact CD1-CD1 4.46Å; L728-F731 PolarHBondContact O-N 2.69Å; V729-F731 VanDerWaalsContact C-N 3.3Å; V729-F731 PolarHBondContact O-N 2.96Å; F731-L734 PolarHBondContact O-N 2.88Å; F731-L735 HydrophobicContact CD1-CD1 4.12Å; F731-L735 HydrophobicContact CE1-CD1 3.6Å; F731-L735 HydrophobicContact CE1-CG 4.42Å; F731-L735 HydrophobicContact CZ-CD1 3.85Å; F731-L735 HydrophobicContact CZ-CG 4.33Å; F731-L735 WeakPolarHBondContact O-CG 3.49Å; F731-L735 PolarHBondContact O-N 2.75Å; F731-L735 VanDerWaalsContact O-N 3.1Å
732	V	91.5	Very high	85.7	Confident	8 Å²	8	69.3 Å²	69.3	5%	0.048	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-46.8	173.9	176.2	0	0	0	0	111.1	L704 I708 L728 V729 L734 L735 F736 F753	L704-V732 HydrophobicContact CD1-CG2 4.23Å; L704-V732 HydrophobicContact CD2-CB 4.25Å; L704-V732 HydrophobicContact CD2-CG1 4.42Å; L704-V732 HydrophobicContact CD2-CG2 3.53Å; L704-V732 HydrophobicContact CG-CG2 3.69Å; I708-V732 HydrophobicContact CD1-CG2 4.11Å; L728-V732 WeakPolarHBondContact O-CG2 3.3Å; L728-V732 PolarHBondContact O-N 2.82Å; V729-V732 WeakPolarHBondContact O-CB 3.43Å; V729-V732 PolarHBondContact O-N 3.25Å; V729-V732 VanDerWaalsContact O-N 3.13Å; V732-L734 VanDerWaalsContact C-N 3.33Å; V732-L734 PolarHBondContact O-N 3.4Å; V732-L735 PolarHBondContact O-N 2.91Å; V732-L735 VanDerWaalsContact O-N 3.16Å; V732-F736 HydrophobicContact CG1-CD2 3.83Å; V732-F736 HydrophobicContact CG1-CE2 3.68Å; V732-F736 WeakPolarHBondContact O-CD2 3.42Å; V732-F736 PolarHBondContact O-N 2.89Å; V732-F753 HydrophobicContact CG1-CD2 4.35Å; V732-F753 HydrophobicContact CG1-CE2 3.83Å; V732-F753 HydrophobicContact CG1-CZ 4.35Å; V732-F753 HydrophobicContact CG2-CE2 4.34Å
733	C	91.7	Very high	84.7	Confident	66 Å²	66	65.6 Å²	65.6	45%	0.446	34%	0.343	S	S	.	.	H	α-helix	trans	-62.4	-39.2	177.9	-65.5	0	0	0	0	112	V729 T730 L735 F736 L737	V729-C733 PolarHBondContact O-N 3.34Å; V729-C733 PolarHBondContact O-SG 2.9Å; T730-C733 PolarHBondContact O-N 3.32Å; C733-L735 VanDerWaalsContact C-N 3.32Å; C733-L735 PolarHBondContact O-N 2.93Å; C733-F736 PolarHBondContact O-N 3.14Å; C733-L737 WeakPolarHBondContact O-CG 3.41Å; C733-L737 PolarHBondContact O-N 3.31Å
734	L	90.9	Very high	84.3	Confident	96 Å²	96	59.9 Å²	59.9	50%	0.503	32%	0.324	S	S	.	.	H	α-helix	trans	-63.4	-36.7	174	-73.7	168.4	0	0	0	112.2	T730 F731 V732 L737 V738	T730-L734 HydrophobicContact CG2-CD1 4.16Å; T730-L734 WeakPolarHBondContact O-CB 3.49Å; T730-L734 VanDerWaalsContact O-CG 3.3Å; T730-L734 WeakPolarHBondContact O-CG 3.29Å; T730-L734 PolarHBondContact O-N 3.43Å; F731-L734 PolarHBondContact O-N 2.88Å; V732-L734 VanDerWaalsContact C-N 3.33Å; V732-L734 PolarHBondContact O-N 3.4Å; L734-L737 HydrophobicContact CD2-CD1 4.49Å; L734-L737 PolarHBondContact O-N 2.67Å; L734-V738 WeakPolarHBondContact O-CG2 3.38Å; L734-V738 PolarHBondContact O-N 2.81Å
735	L	89.7	Confident	84.3	Confident	59 Å²	59	60 Å²	60	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-69.2	-35.9	175	-70.1	173.8	0	0	0	112.8	F701 L704 F731 V732 C733 G739	F701-L735 HydrophobicContact CE1-CB 4.23Å; F701-L735 HydrophobicContact CZ-CB 3.82Å; L704-L735 HydrophobicContact CD2-CD1 3.75Å; F731-L735 HydrophobicContact CD1-CD1 4.12Å; F731-L735 HydrophobicContact CE1-CD1 3.6Å; F731-L735 HydrophobicContact CE1-CG 4.42Å; F731-L735 HydrophobicContact CZ-CD1 3.85Å; F731-L735 HydrophobicContact CZ-CG 4.33Å; F731-L735 WeakPolarHBondContact O-CG 3.49Å; F731-L735 PolarHBondContact O-N 2.75Å; F731-L735 VanDerWaalsContact O-N 3.1Å; V732-L735 PolarHBondContact O-N 2.91Å; V732-L735 VanDerWaalsContact O-N 3.16Å; C733-L735 VanDerWaalsContact C-N 3.32Å; C733-L735 PolarHBondContact O-N 2.93Å; L735-G739 PolarHBondContact O-N 2.93Å
736	F	89.1	Confident	84.2	Confident	49 Å²	49	58.7 Å²	58.7	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-35.2	171	-80.2	-69	0	0	0	112.6	F701 V732 C733 G739 L740 H749 A750 F753	F701-F736 HydrophobicContact CD1-CE1 4.11Å; F701-F736 AromaticContact CD1-CE2 3.84Å; F701-F736 HydrophobicContact CD1-CE2 3.84Å; F701-F736 AromaticContact CD1-CZ 3.57Å; F701-F736 HydrophobicContact CD1-CZ 3.57Å; F701-F736 HydrophobicContact CE1-CD1 4.07Å; F701-F736 AromaticContact CE1-CD2 3.92Å; F701-F736 HydrophobicContact CE1-CD2 3.92Å; F701-F736 AromaticContact CE1-CE1 3.81Å; F701-F736 HydrophobicContact CE1-CE1 3.81Å; F701-F736 AromaticContact CE1-CE2 3.64Å; F701-F736 HydrophobicContact CE1-CE2 3.64Å; F701-F736 HydrophobicContact CE1-CG 4.13Å; F701-F736 AromaticContact CE1-CZ 3.58Å; F701-F736 HydrophobicContact CE1-CZ 3.58Å; V732-F736 HydrophobicContact CG1-CD2 3.83Å; V732-F736 HydrophobicContact CG1-CE2 3.68Å; V732-F736 WeakPolarHBondContact O-CD2 3.42Å; V732-F736 PolarHBondContact O-N 2.89Å; C733-F736 PolarHBondContact O-N 3.14Å; F736-G739 WeakPolarHBondContact O-CA 3.39Å; F736-G739 PolarHBondContact O-N 3.32Å; F736-G739 VanDerWaalsContact O-N 3.16Å; F736-L740 PolarHBondContact O-N 2.89Å; F736-H749 HydrophobicContact CD1-CB 4.35Å; F736-H749 HydrophobicContact CE1-CB 3.65Å; F736-H749 HydrophobicContact CZ-CB 4.33Å; F736-A750 HydrophobicContact CE1-CB 4.18Å; F736-F753 HydrophobicContact CZ-CB 4.37Å
737	L	86.6	Confident	84.1	Confident	108 Å²	108	58.1 Å²	58.1	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-67.7	-39.3	173.9	-72.7	167.6	0	0	0	112.3	C733 L734 G739 L740	C733-L737 WeakPolarHBondContact O-CG 3.41Å; C733-L737 PolarHBondContact O-N 3.31Å; L734-L737 HydrophobicContact CD2-CD1 4.49Å; L734-L737 PolarHBondContact O-N 2.67Å; L737-G739 PolarHBondContact O-N 2.83Å; L737-L740 HydrophobicContact CD2-CD1 4.02Å; L737-L740 WeakPolarHBondContact O-CB 3.35Å; L737-L740 PolarHBondContact O-N 3.29Å
738	V	84.9	Confident	84.3	Confident	79 Å²	79	54.8 Å²	54.8	48%	0.479	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-30.9	170	169	0	0	0	0	111.1	L734 L740 L741	L734-V738 WeakPolarHBondContact O-CG2 3.38Å; L734-V738 PolarHBondContact O-N 2.81Å; V738-L740 PolarHBondContact O-N 3.2Å; V738-L741 HydrophobicContact CG1-CD1 4.17Å; V738-L741 WeakPolarHBondContact O-CB 3.19Å; V738-L741 WeakPolarHBondContact O-CD1 3.5Å; V738-L741 VanDerWaalsContact O-CG 3.29Å; V738-L741 WeakPolarHBondContact O-CG 3.2Å; V738-L741 PolarHBondContact O-N 3.03Å
739	G	75.1	Confident	84.5	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.01	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-8	173.5	0	0	0	0	0	115.4	L735 F736 L737 L741 N746	L735-G739 PolarHBondContact O-N 2.93Å; F736-G739 WeakPolarHBondContact O-CA 3.39Å; F736-G739 PolarHBondContact O-N 3.32Å; F736-G739 VanDerWaalsContact O-N 3.16Å; L737-G739 PolarHBondContact O-N 2.83Å; G739-L741 PolarHBondContact O-N 3.2Å; G739-N746 VanDerWaalsContact C-ND2 3.34Å; G739-N746 WeakPolarHBondContact CA-OD1 3.45Å; G739-N746 PolarHBondContact O-ND2 2.78Å; G739-N746 PolarHBondContact O-OD1 3.35Å
740	L	73	Confident	84.6	Confident	78 Å²	78	53.9 Å²	53.9	41%	0.408	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.8	170.4	-60.3	172.9	0	0	0	113	F736 L737 V738 Q819	F736-L740 PolarHBondContact O-N 2.89Å; L737-L740 HydrophobicContact CD2-CD1 4.02Å; L737-L740 WeakPolarHBondContact O-CB 3.35Å; L737-L740 PolarHBondContact O-N 3.29Å; V738-L740 PolarHBondContact O-N 3.2Å; L740-Q819 PolarHBondContact O-NE2 2.95Å
741	L	69	Low	84.7	Confident	101 Å²	101	51.3 Å²	51.3	53%	0.529	27%	0.269	S	S	.	.	S	Bend	trans	-67.1	147.9	169.6	-68.4	170.9	0	0	0	110.9	V738 G739 I744	V738-L741 HydrophobicContact CG1-CD1 4.17Å; V738-L741 WeakPolarHBondContact O-CB 3.19Å; V738-L741 WeakPolarHBondContact O-CD1 3.5Å; V738-L741 VanDerWaalsContact O-CG 3.29Å; V738-L741 WeakPolarHBondContact O-CG 3.2Å; V738-L741 PolarHBondContact O-N 3.03Å; G739-L741 PolarHBondContact O-N 3.2Å; L741-I744 HydrophobicContact CB-CD1 4.24Å; L741-I744 PolarHBondContact O-N 2.6Å
742	P	62.8	Low	85	Confident	72 Å²	72	47.1 Å²	47.1	47%	0.468	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	157.8	170.5	25.5	-34.9	0	0	0	111.5	I744	P742-I744 PolarHBondContact O-N 3.31Å
743	W	67	Low	85.3	Confident	120 Å²	120	48.6 Å²	48.6	46%	0.455	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	-3.9	-174.6	-41.8	103.3	0	0	0	116.5	Q439 F442	Q439-W743 HydrophobicContact CG-CH2 3.63Å; Q439-W743 HydrophobicContact CG-CZ2 4.35Å; Q439-W743 HydrophobicContact CG-CZ3 4.3Å; F442-W743 HydrophobicContact CE1-CB 4.37Å; F442-W743 AromaticContact CE1-CD1 3.88Å; F442-W743 HydrophobicContact CE1-CG 4.08Å
744	I	79.8	Confident	85.5	Confident	45 Å²	45	48.7 Å²	48.7	23%	0.231	25%	0.252	C	S	.	.			trans	-110.1	123.6	179.1	-54.3	-178.5	0	0	0	110.6	L741 P742 H749	L741-I744 HydrophobicContact CB-CD1 4.24Å; L741-I744 PolarHBondContact O-N 2.6Å; P742-I744 PolarHBondContact O-N 3.31Å; I744-H749 WeakPolarHBondContact CG2-CE1 3.43Å
745	D	85	Confident	85.8	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.032	23%	0.228	C	C	.	.			trans	-90.3	115.3	176	179.3	31.4	0	0	0	113.1	S684 E693 Y747 A748 H749	S684-D745 WeakPolarHBondContact CB-OD2 3.49Å; S684-D745 PolarHBondContact OG-OD2 3.29Å; E693-D745 VanDerWaalsContact CD-CB 3.47Å; E693-D745 HydrophobicContact CG-CB 4.45Å; E693-D745 VanDerWaalsContact OE1-CB 3.22Å; E693-D745 WeakPolarHBondContact OE1-CB 3.33Å; D745-Y747 VanDerWaalsContact C-N 3.34Å; D745-Y747 WeakPolarHBondContact OD1-CB 3.4Å; D745-Y747 WeakPolarHBondContact OD1-CD2 3.37Å; D745-Y747 PolarHBondContact OD1-N 3.19Å; D745-A748 HydrophobicContact CB-CB 4.35Å; D745-A748 VanDerWaalsContact OD2-CB 3.24Å; D745-A748 WeakPolarHBondContact OD2-CB 3.46Å; D745-A748 PolarHBondContact OD2-N 3.48Å; D745-H749 VanDerWaalsContact O-CG 3.29Å; D745-H749 PolarHBondContact O-N 2.86Å; D745-H749 PolarHBondContact O-ND1 3.4Å
746	N	88	Confident	86.2	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-73	-22.7	174	-69	-54	0	0	0	113.6	G739 H749 A750 F813	G739-N746 VanDerWaalsContact C-ND2 3.34Å; G739-N746 WeakPolarHBondContact CA-OD1 3.45Å; G739-N746 PolarHBondContact O-ND2 2.78Å; G739-N746 PolarHBondContact O-OD1 3.35Å; N746-H749 PolarHBondContact O-N 2.92Å; N746-A750 WeakPolarHBondContact O-CB 3.3Å; N746-A750 PolarHBondContact O-N 3.35Å; N746-F813 HydrophobicContact CB-CD1 3.94Å; N746-F813 HydrophobicContact CB-CE1 4Å
747	Y	89.4	Confident	86.5	Confident	20 Å²	20	41.7 Å²	41.7	8%	0.078	22%	0.217	C	C	.	.	H	α-helix	trans	-71.2	-47.8	178.5	-70.5	-82.8	0	0	0	111.3	F687 V688 D745 H749 A750 F751 C810 F813	F687-Y747 HydrophobicContact CB-CD1 3.56Å; F687-Y747 HydrophobicContact CB-CD2 3.99Å; F687-Y747 HydrophobicContact CB-CE1 3.59Å; F687-Y747 HydrophobicContact CB-CE2 4.01Å; F687-Y747 HydrophobicContact CB-CG 3.76Å; F687-Y747 HydrophobicContact CD1-CD1 4.37Å; F687-Y747 AromaticContact CD1-CE1 3.84Å; F687-Y747 HydrophobicContact CD1-CE1 3.84Å; F687-Y747 AromaticContact CD2-CD1 3.45Å; F687-Y747 HydrophobicContact CD2-CD1 3.45Å; F687-Y747 VanDerWaalsContact CD2-CD1 3.45Å; F687-Y747 AromaticContact CD2-CE1 3.76Å; F687-Y747 HydrophobicContact CD2-CE1 3.76Å; F687-Y747 HydrophobicContact CD2-CG 4.26Å; F687-Y747 HydrophobicContact CE1-CE1 4.49Å; F687-Y747 HydrophobicContact CE2-CD1 4.29Å; F687-Y747 HydrophobicContact CE2-CE1 4.46Å; F687-Y747 AromaticContact CG-CD1 3.52Å; F687-Y747 HydrophobicContact CG-CD1 3.52Å; F687-Y747 AromaticContact CG-CE1 3.43Å; F687-Y747 HydrophobicContact CG-CE1 3.43Å; F687-Y747 VanDerWaalsContact CG-CE1 3.43Å; F687-Y747 HydrophobicContact CG-CG 4.23Å; V688-Y747 HydrophobicContact CG2-CD2 3.59Å; V688-Y747 HydrophobicContact CG2-CE2 3.95Å; V688-Y747 HydrophobicContact CG2-CG 4.47Å; D745-Y747 VanDerWaalsContact C-N 3.34Å; D745-Y747 WeakPolarHBondContact OD1-CB 3.4Å; D745-Y747 WeakPolarHBondContact OD1-CD2 3.37Å; D745-Y747 PolarHBondContact OD1-N 3.19Å; Y747-H749 VanDerWaalsContact C-N 3.26Å; Y747-H749 PolarHBondContact O-N 3.43Å; Y747-A750 PolarHBondContact O-N 3.12Å; Y747-F751 HydrophobicContact CD1-CE2 4.3Å; Y747-F751 WeakPolarHBondContact O-CD2 3.24Å; Y747-F751 PolarHBondContact O-N 3.1Å; Y747-C810 WeakPolarHBondContact OH-CA 3.39Å; Y747-C810 WeakPolarHBondContact OH-CB 3.21Å; Y747-C810 PolarHBondContact OH-O 2.73Å; Y747-C810 VanDerWaalsContact OH-O 3.04Å; Y747-F813 HydrophobicContact CE2-CB 4.09Å; Y747-F813 WeakPolarHBondContact OH-CB 3.5Å
748	A	92.6	Very high	87	Confident	5 Å²	5	37.4 Å²	37.4	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-55.8	-41.8	171.8	0	0	0	0	0	111.8	G680 G698 D745 G752	G680-A748 WeakPolarHBondContact CA-O 3.23Å; G698-A748 WeakPolarHBondContact CA-O 3.48Å; D745-A748 HydrophobicContact CB-CB 4.35Å; D745-A748 VanDerWaalsContact OD2-CB 3.24Å; D745-A748 WeakPolarHBondContact OD2-CB 3.46Å; D745-A748 PolarHBondContact OD2-N 3.48Å; A748-G752 WeakPolarHBondContact O-CA 3.31Å; A748-G752 PolarHBondContact O-N 3.48Å
749	H	93.9	Very high	87.6	Confident	18 Å²	18	34.1 Å²	34.1	8%	0.083	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-47.6	174.7	-67.9	165.7	0	0	0	113.2	A697 F701 F736 I744 D745 N746 Y747 F753	A697-H749 VanDerWaalsContact CB-NE2 3.32Å; A697-H749 WeakPolarHBondContact CB-NE2 3.32Å; F701-H749 WeakPolarHBondContact CB-O 3.46Å; F701-H749 HydrophobicContact CD1-CB 3.94Å; F701-H749 HydrophobicContact CD2-CB 3.92Å; F701-H749 AromaticContact CD2-CD2 3.32Å; F701-H749 WeakPolarHBondContact CD2-CD2 3.35Å; F701-H749 AromaticContact CD2-CG 3.61Å; F701-H749 AromaticContact CD2-NE2 3.8Å; F701-H749 HydrophobicContact CE1-CB 3.96Å; F701-H749 HydrophobicContact CE2-CB 3.95Å; F701-H749 AromaticContact CE2-CD2 3.33Å; F701-H749 WeakPolarHBondContact CE2-CD2 3.39Å; F701-H749 AromaticContact CE2-CE1 3.55Å; F701-H749 AromaticContact CE2-CG 3.37Å; F701-H749 AromaticContact CE2-ND1 3.54Å; F701-H749 AromaticContact CE2-NE2 3.42Å; F701-H749 WeakPolarHBondContact CE2-NE2 3.25Å; F701-H749 HydrophobicContact CG-CB 3.91Å; F701-H749 HydrophobicContact CZ-CB 3.95Å; F701-H749 AromaticContact CZ-CG 3.69Å; F701-H749 AromaticContact CZ-ND1 3.65Å; F736-H749 HydrophobicContact CD1-CB 4.35Å; F736-H749 HydrophobicContact CE1-CB 3.65Å; F736-H749 HydrophobicContact CZ-CB 4.33Å; I744-H749 WeakPolarHBondContact CG2-CE1 3.43Å; D745-H749 VanDerWaalsContact O-CG 3.29Å; D745-H749 PolarHBondContact O-N 2.86Å; D745-H749 PolarHBondContact O-ND1 3.4Å; N746-H749 PolarHBondContact O-N 2.92Å; Y747-H749 VanDerWaalsContact C-N 3.26Å; Y747-H749 PolarHBondContact O-N 3.43Å; H749-F753 VanDerWaalsContact O-CB 3.29Å; H749-F753 WeakPolarHBondContact O-CB 3.15Å; H749-F753 PolarHBondContact O-N 3.49Å
750	A	93.6	Very high	88.5	Confident	25 Å²	25	34 Å²	34	21%	0.207	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-49.3	-177	0	0	0	0	0	111.8	F736 N746 Y747 F753 I754	F736-A750 HydrophobicContact CE1-CB 4.18Å; N746-A750 WeakPolarHBondContact O-CB 3.3Å; N746-A750 PolarHBondContact O-N 3.35Å; Y747-A750 PolarHBondContact O-N 3.12Å; A750-F753 WeakPolarHBondContact O-CB 3.32Å; A750-F753 PolarHBondContact O-N 2.94Å; A750-I754 VanDerWaalsContact O-CG1 3.27Å; A750-I754 WeakPolarHBondContact O-CG1 3.46Å; A750-I754 PolarHBondContact O-N 3.21Å
751	F	95.2	Very high	89.6	Confident	30 Å²	30	32.4 Å²	32.4	13%	0.132	17%	0.165	C	C	.	.	H	α-helix	trans	-67.7	-39.4	176.9	-78	-80.4	0	0	0	111.6	G679 F687 Y747 F753 I754 F755 L791 L795	G679-F751 WeakPolarHBondContact O-CB 3.48Å; F687-F751 AromaticContact CD2-CE2 3.87Å; F687-F751 HydrophobicContact CD2-CE2 3.87Å; F687-F751 HydrophobicContact CD2-CZ 4.47Å; F687-F751 AromaticContact CE2-CE2 3.48Å; F687-F751 HydrophobicContact CE2-CE2 3.48Å; F687-F751 VanDerWaalsContact CE2-CE2 3.48Å; F687-F751 AromaticContact CE2-CZ 3.65Å; F687-F751 HydrophobicContact CE2-CZ 3.65Å; F687-F751 HydrophobicContact CZ-CZ 4.42Å; Y747-F751 HydrophobicContact CD1-CE2 4.3Å; Y747-F751 WeakPolarHBondContact O-CD2 3.24Å; Y747-F751 PolarHBondContact O-N 3.1Å; F751-F753 VanDerWaalsContact C-N 3.33Å; F751-F753 PolarHBondContact O-N 2.92Å; F751-I754 PolarHBondContact O-N 2.95Å; F751-F755 HydrophobicContact CD1-CE2 4.43Å; F751-F755 VanDerWaalsContact O-CD2 3.31Å; F751-F755 WeakPolarHBondContact O-CD2 3.31Å; F751-F755 PolarHBondContact O-N 3.48Å; F751-L791 HydrophobicContact CE1-CD1 4.33Å; F751-L795 HydrophobicContact CD1-CD1 3.84Å; F751-L795 HydrophobicContact CD1-CD2 4.44Å; F751-L795 HydrophobicContact CE1-CD1 4.03Å; F751-L795 HydrophobicContact CE1-CD2 3.91Å; F751-L795 HydrophobicContact CE1-CG 4.41Å; F751-L795 HydrophobicContact CZ-CD2 4.17Å
752	G	96.4	Very high	90.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-43.8	172.1	0	0	0	0	0	113	S676 G698 G702 A748 G756	S676-G752 WeakPolarHBondContact CB-O 3.47Å; S676-G752 WeakPolarHBondContact O-CA 3.33Å; G698-G752 CarbonylContact O-C 3.58Å; G698-G752 WeakPolarHBondContact O-CA 3.44Å; G702-G752 WeakPolarHBondContact CA-O 3.28Å; A748-G752 WeakPolarHBondContact O-CA 3.31Å; A748-G752 PolarHBondContact O-N 3.48Å; G752-G756 PolarHBondContact O-N 2.71Å
753	F	97	Very high	92.2	Very high	39 Å²	39	26.4 Å²	26.4	17%	0.171	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-45.9	173	-174.7	-90.5	0	0	0	112.4	F701 A705 I708 V732 F736 H749 A750 F751 G756 L757	F701-F753 HydrophobicContact CB-CB 4.21Å; A705-F753 HydrophobicContact CB-CD1 4.49Å; A705-F753 HydrophobicContact CB-CD2 3.77Å; A705-F753 HydrophobicContact CB-CE2 3.82Å; A705-F753 HydrophobicContact CB-CG 4.13Å; A705-F753 HydrophobicContact CB-CZ 4.23Å; A705-F753 WeakPolarHBondContact CB-O 3.13Å; I708-F753 HydrophobicContact CD1-CE2 3.75Å; I708-F753 HydrophobicContact CD1-CZ 3.56Å; V732-F753 HydrophobicContact CG1-CD2 4.35Å; V732-F753 HydrophobicContact CG1-CE2 3.83Å; V732-F753 HydrophobicContact CG1-CZ 4.35Å; V732-F753 HydrophobicContact CG2-CE2 4.34Å; F736-F753 HydrophobicContact CZ-CB 4.37Å; H749-F753 VanDerWaalsContact O-CB 3.29Å; H749-F753 WeakPolarHBondContact O-CB 3.15Å; H749-F753 PolarHBondContact O-N 3.49Å; A750-F753 WeakPolarHBondContact O-CB 3.32Å; A750-F753 PolarHBondContact O-N 2.94Å; F751-F753 VanDerWaalsContact C-N 3.33Å; F751-F753 PolarHBondContact O-N 2.92Å; F753-G756 PolarHBondContact O-N 3.35Å; F753-L757 VanDerWaalsContact O-CB 3.32Å; F753-L757 WeakPolarHBondContact O-CB 3.43Å; F753-L757 PolarHBondContact O-N 2.67Å
754	I	97.1	Very high	93.3	Very high	69 Å²	69	20.8 Å²	20.8	35%	0.354	11%	0.109	S	C	.	.	H	α-helix	trans	-63.4	-51.1	-180	-68.2	162.5	0	0	0	111.2	A750 F751 G756 L757 L758 L791	A750-I754 VanDerWaalsContact O-CG1 3.27Å; A750-I754 WeakPolarHBondContact O-CG1 3.46Å; A750-I754 PolarHBondContact O-N 3.21Å; F751-I754 PolarHBondContact O-N 2.95Å; I754-G756 VanDerWaalsContact C-N 3.35Å; I754-G756 PolarHBondContact O-N 2.76Å; I754-L757 WeakPolarHBondContact O-CB 3.49Å; I754-L757 PolarHBondContact O-N 3.49Å; I754-L758 HydrophobicContact CG2-CD1 4.32Å; I754-L758 WeakPolarHBondContact O-CG 3.35Å; I754-L758 PolarHBondContact O-N 3.03Å; I754-L758 VanDerWaalsContact O-N 3.11Å; I754-L791 HydrophobicContact CG2-CD2 3.56Å
755	F	97.6	Very high	93.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.7	-43.2	176.8	-82.9	-77.4	0	0	0	111.3	F751 L757 L758 L759 L791 L792 L795	F751-F755 HydrophobicContact CD1-CE2 4.43Å; F751-F755 VanDerWaalsContact O-CD2 3.31Å; F751-F755 WeakPolarHBondContact O-CD2 3.31Å; F751-F755 PolarHBondContact O-N 3.48Å; F755-L757 VanDerWaalsContact C-N 3.33Å; F755-L757 PolarHBondContact O-N 2.73Å; F755-L758 PolarHBondContact O-N 3.33Å; F755-L759 WeakPolarHBondContact O-CB 3.11Å; F755-L759 WeakPolarHBondContact O-CD1 3.44Å; F755-L759 WeakPolarHBondContact O-CG 3.44Å; F755-L759 PolarHBondContact O-N 2.9Å; F755-L791 HydrophobicContact CD2-CD2 4.3Å; F755-L791 HydrophobicContact CE1-CB 4.48Å; F755-L791 HydrophobicContact CE1-CD2 4.28Å; F755-L791 HydrophobicContact CE1-CG 4.44Å; F755-L791 HydrophobicContact CE2-CD2 3.83Å; F755-L791 HydrophobicContact CE2-CG 4.11Å; F755-L791 HydrophobicContact CZ-CB 4.2Å; F755-L791 HydrophobicContact CZ-CD2 3.82Å; F755-L791 HydrophobicContact CZ-CG 3.78Å; F755-L792 HydrophobicContact CE1-CB 4.13Å; F755-L792 HydrophobicContact CZ-CB 4.18Å; F755-L792 HydrophobicContact CZ-CD1 4.28Å; F755-L795 HydrophobicContact CE2-CD1 3.7Å; F755-L795 HydrophobicContact CZ-CD1 4Å
756	G	96.7	Very high	93.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.6	-35.3	176.2	0	0	0	0	0	113.8	G752 F753 I754 S760	G752-G756 PolarHBondContact O-N 2.71Å; F753-G756 PolarHBondContact O-N 3.35Å; I754-G756 VanDerWaalsContact C-N 3.35Å; I754-G756 PolarHBondContact O-N 2.76Å; G756-S760 WeakPolarHBondContact O-CB 3.16Å; G756-S760 PolarHBondContact O-N 3.37Å; G756-S760 PolarHBondContact O-OG 3.04Å
757	L	96.8	Very high	92.5	Very high	57 Å²	57	22.2 Å²	22.2	30%	0.298	11%	0.114	S	C	.	.	H	α-helix	trans	-63.4	-51.7	174.3	-177.2	62.6	0	0	0	111	A705 V709 F753 I754 F755 S760 L761	A705-L757 HydrophobicContact CB-CB 3.94Å; V709-L757 HydrophobicContact CG2-CD1 3.77Å; F753-L757 VanDerWaalsContact O-CB 3.32Å; F753-L757 WeakPolarHBondContact O-CB 3.43Å; F753-L757 PolarHBondContact O-N 2.67Å; I754-L757 WeakPolarHBondContact O-CB 3.49Å; I754-L757 PolarHBondContact O-N 3.49Å; F755-L757 VanDerWaalsContact C-N 3.33Å; F755-L757 PolarHBondContact O-N 2.73Å; L757-S760 PolarHBondContact O-N 3.37Å; L757-L761 HydrophobicContact CG-CD1 4.38Å; L757-L761 VanDerWaalsContact O-CG 3.3Å; L757-L761 WeakPolarHBondContact O-CG 3.13Å; L757-L761 PolarHBondContact O-N 3.22Å
758	L	96.9	Very high	91.9	Very high	17 Å²	17	25.3 Å²	25.3	9%	0.089	13%	0.129	C	C	.	.	H	α-helix	trans	-62	-46.8	-180	-63.9	174.1	0	0	0	111.6	I754 F755 S760 L761 A762 S784 L787 C788	I754-L758 HydrophobicContact CG2-CD1 4.32Å; I754-L758 WeakPolarHBondContact O-CG 3.35Å; I754-L758 PolarHBondContact O-N 3.03Å; I754-L758 VanDerWaalsContact O-N 3.11Å; F755-L758 PolarHBondContact O-N 3.33Å; L758-S760 PolarHBondContact O-N 3.25Å; L758-L761 PolarHBondContact O-N 2.62Å; L758-A762 PolarHBondContact O-N 3.33Å; L758-S784 WeakPolarHBondContact O-CB 3.29Å; L758-L787 HydrophobicContact CD1-CB 4.45Å; L758-L787 HydrophobicContact CD1-CD2 4.42Å; L758-L787 HydrophobicContact CD1-CG 4.01Å; L758-L787 HydrophobicContact CD2-CB 4.41Å; L758-L787 HydrophobicContact CD2-CD2 3.77Å; L758-L787 HydrophobicContact CD2-CG 4.16Å; L758-C788 HydrophobicContact CB-CB 4.31Å; L758-C788 HydrophobicContact CD1-CB 4.24Å
759	L	96.2	Very high	91.1	Very high	10 Å²	10	28.2 Å²	28.2	5%	0.052	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-36.4	178.6	-66.1	165.6	0	0	0	112.1	I672 V675 F755 A762 L763	I672-L759 HydrophobicContact CG1-CB 4.01Å; V675-L759 HydrophobicContact CB-CD1 3.67Å; V675-L759 HydrophobicContact CG1-CD1 3.78Å; F755-L759 WeakPolarHBondContact O-CB 3.11Å; F755-L759 WeakPolarHBondContact O-CD1 3.44Å; F755-L759 WeakPolarHBondContact O-CG 3.44Å; F755-L759 PolarHBondContact O-N 2.9Å; L759-A762 PolarHBondContact O-N 3.18Å; L759-L763 HydrophobicContact CB-CD1 4.47Å; L759-L763 VanDerWaalsContact O-CB 3.25Å; L759-L763 WeakPolarHBondContact O-CB 3.5Å; L759-L763 WeakPolarHBondContact O-CG 3.27Å; L759-L763 PolarHBondContact O-N 3.02Å
760	S	95.3	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-67.3	-42	175.7	-64.4	0	0	0	0	111.8	G706 G756 L757 L758 A762 L763 F764	G706-S760 VanDerWaalsContact CA-OG 3.22Å; G706-S760 WeakPolarHBondContact CA-OG 3.14Å; G756-S760 WeakPolarHBondContact O-CB 3.16Å; G756-S760 PolarHBondContact O-N 3.37Å; G756-S760 PolarHBondContact O-OG 3.04Å; L757-S760 PolarHBondContact O-N 3.37Å; L758-S760 PolarHBondContact O-N 3.25Å; S760-A762 VanDerWaalsContact C-N 3.28Å; S760-A762 PolarHBondContact O-N 3.43Å; S760-L763 PolarHBondContact O-N 3.31Å; S760-F764 VanDerWaalsContact O-CB 3.27Å; S760-F764 WeakPolarHBondContact O-CB 3.5Å; S760-F764 WeakPolarHBondContact O-CD1 3.26Å; S760-F764 PolarHBondContact O-N 3.06Å; S760-F764 WeakPolarHBondContact OG-CE1 3.22Å
761	L	94.7	Very high	89.4	Confident	44 Å²	44	38.3 Å²	38.3	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-57.1	-42.4	172.1	-72.6	168.7	0	0	0	111.5	V709 Y713 L757 L758 R777 I780	V709-L761 HydrophobicContact CG1-CD2 4.19Å; V709-L761 HydrophobicContact CG2-CD2 4.06Å; V709-L761 HydrophobicContact CG2-CG 4.06Å; Y713-L761 HydrophobicContact CE1-CD2 4.27Å; Y713-L761 PolarHBondContact OH-O 3.32Å; L757-L761 HydrophobicContact CG-CD1 4.38Å; L757-L761 VanDerWaalsContact O-CG 3.3Å; L757-L761 WeakPolarHBondContact O-CG 3.13Å; L757-L761 PolarHBondContact O-N 3.22Å; L758-L761 PolarHBondContact O-N 2.62Å; L761-R777 VanDerWaalsContact O-CZ 3.26Å; L761-R777 PolarHBondContact O-NH1 3.07Å; L761-R777 PolarHBondContact O-NH2 2.87Å; L761-I780 HydrophobicContact CB-CG2 4.24Å
762	A	93.7	Very high	88.7	Confident	8 Å²	8	41.9 Å²	41.9	7%	0.066	21%	0.208	C	C	.	.	H	α-helix	trans	-70.1	-42.3	178.1	0	0	0	0	0	114.1	L758 L759 S760 R777 L785	L758-A762 PolarHBondContact O-N 3.33Å; L759-A762 PolarHBondContact O-N 3.18Å; S760-A762 VanDerWaalsContact C-N 3.28Å; S760-A762 PolarHBondContact O-N 3.43Å; A762-R777 PolarHBondContact O-NH2 3.28Å; A762-L785 HydrophobicContact CB-CD2 3.87Å; A762-L785 HydrophobicContact CB-CG 3.95Å
763	L	93.2	Very high	88	Confident	38 Å²	38	42.3 Å²	42.3	20%	0.199	21%	0.211	C	C	.	.	H	α-helix	trans	-105.5	-23.2	-163.5	-64	171.6	0	0	0	115.4	R668 I671 I672 L759 S760	R668-L763 VanDerWaalsContact CD-O 3.31Å; R668-L763 WeakPolarHBondContact CD-O 3.49Å; R668-L763 PolarHBondContact NH1-O 3Å; I671-L763 HydrophobicContact CB-CD1 4.22Å; I671-L763 HydrophobicContact CG2-CD1 3.81Å; I672-L763 HydrophobicContact CD1-CB 4.26Å; I672-L763 HydrophobicContact CD1-CD1 4.33Å; I672-L763 HydrophobicContact CG1-CD1 3.74Å; L759-L763 HydrophobicContact CB-CD1 4.47Å; L759-L763 VanDerWaalsContact O-CB 3.25Å; L759-L763 WeakPolarHBondContact O-CB 3.5Å; L759-L763 WeakPolarHBondContact O-CG 3.27Å; L759-L763 PolarHBondContact O-N 3.02Å; S760-L763 PolarHBondContact O-N 3.31Å
764	F	90.2	Very high	87.4	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.013	24%	0.235	C	C	.	.	S	Bend	trans	-64.9	143.6	-179.1	-86.9	42.5	0	0	0	111.8	L660 V664 I672 G706 V709 D710 Y713 S760 R777	L660-F764 HydrophobicContact CD2-CE2 4.09Å; L660-F764 HydrophobicContact CD2-CZ 3.76Å; V664-F764 HydrophobicContact CG1-CD1 4.07Å; V664-F764 HydrophobicContact CG1-CE1 4.46Å; V664-F764 HydrophobicContact CG2-CD1 3.96Å; V664-F764 HydrophobicContact CG2-CD2 4.07Å; V664-F764 HydrophobicContact CG2-CE1 3.96Å; V664-F764 HydrophobicContact CG2-CE2 4.06Å; V664-F764 HydrophobicContact CG2-CG 4.02Å; V664-F764 HydrophobicContact CG2-CZ 4.02Å; I672-F764 HydrophobicContact CD1-CD1 3.97Å; I672-F764 HydrophobicContact CD1-CE1 3.64Å; G706-F764 WeakPolarHBondContact O-CE2 3.46Å; G706-F764 WeakPolarHBondContact O-CZ 3.32Å; V709-F764 HydrophobicContact CG1-CB 4.45Å; V709-F764 HydrophobicContact CG1-CD2 4.24Å; V709-F764 HydrophobicContact CG1-CG 4.36Å; D710-F764 HydrophobicContact CB-CE2 4.2Å; Y713-F764 HydrophobicContact CD2-CB 4.28Å; Y713-F764 HydrophobicContact CE2-CB 4.05Å; S760-F764 VanDerWaalsContact O-CB 3.27Å; S760-F764 WeakPolarHBondContact O-CB 3.5Å; S760-F764 WeakPolarHBondContact O-CD1 3.26Å; S760-F764 PolarHBondContact O-N 3.06Å; S760-F764 WeakPolarHBondContact OG-CE1 3.22Å; F764-R777 VanDerWaalsContact O-CZ 3.27Å; F764-R777 PolarHBondContact O-NH1 2.96Å; F764-R777 PolarHBondContact O-NH2 3.16Å
765	P	82	Confident	87	Confident	18 Å²	18	54.9 Å²	54.9	12%	0.117	25%	0.252	C	S	.	.			trans	-60	142.4	171.4	27.1	-33.8	0	0	0	111.1	F352 F382 L663	F352-P765 HydrophobicContact CE2-CG 4.16Å; F382-P765 HydrophobicContact CE1-CB 3.85Å; F382-P765 HydrophobicContact CE1-CG 4.39Å; F382-P765 HydrophobicContact CZ-CB 4Å; L663-P765 HydrophobicContact CD1-CG 4.47Å; L663-P765 HydrophobicContact CG-CG 4.47Å
766	Y	79.7	Confident	86.5	Confident	60 Å²	60	60.6 Å²	60.6	24%	0.235	28%	0.277	C	S	.	.			trans	-127.7	123.7	-175.9	-179.1	-87.6	0	0	0	111.3	Y713 Q768 D773 R777	Y713-Y766 AromaticContact CD1-CD2 3.8Å; Y713-Y766 HydrophobicContact CD1-CD2 3.8Å; Y713-Y766 AromaticContact CD1-CE2 3.91Å; Y713-Y766 HydrophobicContact CD1-CE2 3.91Å; Y713-Y766 HydrophobicContact CD2-CD2 4.07Å; Y713-Y766 AromaticContact CE1-CD2 3.86Å; Y713-Y766 HydrophobicContact CE1-CD2 3.86Å; Y713-Y766 HydrophobicContact CE1-CE2 4.06Å; Y713-Y766 HydrophobicContact CE2-CD2 4.16Å; Y713-Y766 AromaticContact CG-CD2 3.9Å; Y713-Y766 HydrophobicContact CG-CD2 3.9Å; Y713-Y766 HydrophobicContact CG-CE2 4.35Å; Y766-Q768 HydrophobicContact CD1-CG 4.28Å; Y766-D773 HydrophobicContact CE1-CB 4Å; Y766-R777 HydrophobicContact CD1-CB 4.3Å; Y766-R777 HydrophobicContact CD1-CG 4.43Å; Y766-R777 HydrophobicContact CG-CG 4.4Å
767	I	75.5	Confident	86.2	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	28%	0.283	C	S	.	.			trans	-82	125.7	-179	-68.5	161.3	0	0	0	109.4	F352 V375 L379 F382 M717 F769	F352-I767 HydrophobicContact CD1-CD1 3.99Å; F352-I767 HydrophobicContact CD2-CD1 3.8Å; F352-I767 HydrophobicContact CE1-CD1 3.97Å; F352-I767 HydrophobicContact CE2-CD1 3.78Å; F352-I767 HydrophobicContact CE2-CG1 4.26Å; F352-I767 HydrophobicContact CG-CD1 3.92Å; F352-I767 HydrophobicContact CZ-CD1 3.87Å; F352-I767 HydrophobicContact CZ-CG1 4.43Å; V375-I767 HydrophobicContact CG1-CG2 3.93Å; V375-I767 HydrophobicContact CG2-CG2 4.13Å; L379-I767 HydrophobicContact CD1-CD1 3.69Å; F382-I767 HydrophobicContact CE2-CG1 4.35Å; M717-I767 HydrophobicContact CE-CD1 3.49Å; M717-I767 VanDerWaalsContact CE-CD1 3.49Å; M717-I767 HydrophobicContact SD-CD1 3.99Å; I767-F769 HydrophobicContact CB-CE2 4.3Å; I767-F769 HydrophobicContact CG2-CD2 4.42Å; I767-F769 HydrophobicContact CG2-CE1 4.45Å; I767-F769 HydrophobicContact CG2-CE2 3.89Å; I767-F769 HydrophobicContact CG2-CZ 3.9Å; I767-F769 WeakPolarHBondContact O-CD2 3.48Å
768	Q	76.5	Confident	85.9	Confident	86 Å²	86	65.9 Å²	65.9	40%	0.402	30%	0.302	S	S	.	.			trans	-93.2	110.4	-173.5	-64.9	-179.8	16.6	0	0	110.8	Y766	Y766-Q768 HydrophobicContact CD1-CG 4.28Å
769	F	74.1	Confident	85.7	Confident	65 Å²	65	70.8 Å²	70.8	29%	0.285	33%	0.327	S	S	.	.	S	Bend	trans	-89.3	-19.1	177.6	-64.8	-88.4	0	0	0	113.1	V375 K716 M717 I767 D773	V375-F769 HydrophobicContact CG1-CE1 4.22Å; V375-F769 HydrophobicContact CG2-CD1 3.81Å; V375-F769 HydrophobicContact CG2-CE1 3.79Å; K716-F769 HydrophobicContact CB-CE1 4.08Å; K716-F769 HydrophobicContact CB-CZ 3.95Å; K716-F769 HydrophobicContact CD-CD1 3.84Å; K716-F769 HydrophobicContact CD-CD2 4.03Å; K716-F769 HydrophobicContact CD-CE1 3.91Å; K716-F769 HydrophobicContact CD-CE2 4.1Å; K716-F769 HydrophobicContact CD-CG 3.91Å; K716-F769 HydrophobicContact CD-CZ 4.04Å; M717-F769 HydrophobicContact CG-CZ 4.27Å; I767-F769 HydrophobicContact CB-CE2 4.3Å; I767-F769 HydrophobicContact CG2-CD2 4.42Å; I767-F769 HydrophobicContact CG2-CE1 4.45Å; I767-F769 HydrophobicContact CG2-CE2 3.89Å; I767-F769 HydrophobicContact CG2-CZ 3.9Å; I767-F769 WeakPolarHBondContact O-CD2 3.48Å; F769-D773 PolarHBondContact N-OD2 3.49Å
770	S	77.1	Confident	85.5	Confident	61 Å²	61	73.2 Å²	73.2	43%	0.427	34%	0.34	S	S	.	.	S	Bend	trans	-147.8	153.8	-180	179.4	0	0	0	0	112	N772 D773	S770-N772 PolarHBondContact O-N 2.89Å; S770-D773 WeakPolarHBondContact CB-OD2 3.41Å; S770-D773 PolarHBondContact N-OD2 3.18Å; S770-D773 WeakPolarHBondContact O-CB 3.07Å; S770-D773 PolarHBondContact O-N 3.36Å
771	K	75.3	Confident	85.4	Confident	195 Å²	195	74.9 Å²	74.9	85%	0.848	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.6	175.9	-65.4	-178.6	179.8	178.2	0	112.8	D773	K771-D773 VanDerWaalsContact C-N 3.3Å; K771-D773 PolarHBondContact O-N 3.1Å
772	N	81.9	Confident	85.3	Confident	104 Å²	104	74.5 Å²	74.5	56%	0.556	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-19.9	177.9	-76	-4.4	0	0	0	113.1	S770 R774 R775 K776	S770-N772 PolarHBondContact O-N 2.89Å; N772-R774 PolarHBondContact O-N 3.36Å; N772-R775 PolarHBondContact O-N 2.95Å; N772-R775 VanDerWaalsContact O-N 3.1Å; N772-K776 PolarHBondContact O-N 2.86Å
773	D	81.2	Confident	85.4	Confident	10 Å²	10	76.9 Å²	76.9	5%	0.053	38%	0.376	C	S	.	.	H	α-helix	trans	-69.3	-23.2	-177.3	-58.6	-24	0	0	0	111.8	Y766 F769 S770 K771 R775 K776 R777	Y766-D773 HydrophobicContact CE1-CB 4Å; F769-D773 PolarHBondContact N-OD2 3.49Å; S770-D773 WeakPolarHBondContact CB-OD2 3.41Å; S770-D773 PolarHBondContact N-OD2 3.18Å; S770-D773 WeakPolarHBondContact O-CB 3.07Å; S770-D773 PolarHBondContact O-N 3.36Å; K771-D773 VanDerWaalsContact C-N 3.3Å; K771-D773 PolarHBondContact O-N 3.1Å; D773-R775 VanDerWaalsContact C-N 3.34Å; D773-R775 PolarHBondContact O-N 2.79Å; D773-K776 PolarHBondContact O-N 2.85Å; D773-K776 IonicContact OD1-NZ 3.87Å; D773-R777 WeakPolarHBondContact O-CB 3.24Å; D773-R777 PolarHBondContact O-N 3.18Å
774	R	84.1	Confident	85.5	Confident	181 Å²	181	75.4 Å²	75.4	68%	0.683	37%	0.369	S	S	*	.	H	α-helix	trans	-61.8	-39.3	170.4	-167	-179.9	78.7	173.6	4.4	112.3	N772 L778	N772-R774 PolarHBondContact O-N 3.36Å; R774-L778 PolarHBondContact O-N 3.36Å
775	R	88.4	Confident	85.7	Confident	191 Å²	191	79 Å²	79	72%	0.721	39%	0.388	S	S	*	.	H	α-helix	trans	-69.1	-46.4	174.8	-75	-176.4	173.2	175.7	-2.3	110.7	N772 D773 R777 L778 I779	N772-R775 PolarHBondContact O-N 2.95Å; N772-R775 VanDerWaalsContact O-N 3.1Å; D773-R775 VanDerWaalsContact C-N 3.34Å; D773-R775 PolarHBondContact O-N 2.79Å; R775-R777 VanDerWaalsContact C-N 3.34Å; R775-R777 PolarHBondContact O-N 3.28Å; R775-L778 PolarHBondContact O-N 2.77Å; R775-I779 WeakPolarHBondContact O-CG1 3.38Å; R775-I779 PolarHBondContact O-N 3.45Å
776	K	88.1	Confident	86.4	Confident	119 Å²	119	82.9 Å²	82.9	52%	0.517	41%	0.411	S	S	.	.	H	α-helix	trans	-56.8	-45.8	176.1	-65.1	178.8	-178.6	170.6	0	112	N772 D773 L778 I779 I780	N772-K776 PolarHBondContact O-N 2.86Å; D773-K776 PolarHBondContact O-N 2.85Å; D773-K776 IonicContact OD1-NZ 3.87Å; K776-L778 PolarHBondContact O-N 3.44Å; K776-I779 PolarHBondContact O-N 3.23Å; K776-I780 VanDerWaalsContact O-CG1 3.31Å; K776-I780 WeakPolarHBondContact O-CG1 3.43Å; K776-I780 PolarHBondContact O-N 3.33Å
777	R	89.2	Confident	87.2	Confident	34 Å²	34	84.7 Å²	84.7	13%	0.128	43%	0.425	C	S	.	.	H	α-helix	trans	-62.6	-41.6	178	177.3	57.1	-168.7	-135.8	-5.8	111.9	Y713 L761 A762 F764 Y766 D773 R775 I779 I780 V781	Y713-R777 PolarHBondContact OH-NH1 3.01Å; Y713-R777 VanDerWaalsContact OH-NH1 3.16Å; L761-R777 VanDerWaalsContact O-CZ 3.26Å; L761-R777 PolarHBondContact O-NH1 3.07Å; L761-R777 PolarHBondContact O-NH2 2.87Å; A762-R777 PolarHBondContact O-NH2 3.28Å; F764-R777 VanDerWaalsContact O-CZ 3.27Å; F764-R777 PolarHBondContact O-NH1 2.96Å; F764-R777 PolarHBondContact O-NH2 3.16Å; Y766-R777 HydrophobicContact CD1-CB 4.3Å; Y766-R777 HydrophobicContact CD1-CG 4.43Å; Y766-R777 HydrophobicContact CG-CG 4.4Å; D773-R777 WeakPolarHBondContact O-CB 3.24Å; D773-R777 PolarHBondContact O-N 3.18Å; R775-R777 VanDerWaalsContact C-N 3.34Å; R775-R777 PolarHBondContact O-N 3.28Å; R777-I779 VanDerWaalsContact C-N 3.34Å; R777-I779 PolarHBondContact O-N 2.89Å; R777-I780 PolarHBondContact O-N 3.1Å; R777-V781 HydrophobicContact CG-CG2 4.37Å; R777-V781 VanDerWaalsContact O-CG2 3.25Å; R777-V781 WeakPolarHBondContact O-CG2 3.45Å; R777-V781 PolarHBondContact O-N 3.4Å
778	L	90.1	Very high	88.1	Confident	134 Å²	134	84.9 Å²	84.9	70%	0.702	43%	0.427	S	S	*	.	H	α-helix	trans	-62.4	-41.6	176.5	-174.5	63	0	0	0	111.8	R774 R775 K776 V781 G782	R774-L778 PolarHBondContact O-N 3.36Å; R775-L778 PolarHBondContact O-N 2.77Å; K776-L778 PolarHBondContact O-N 3.44Å; L778-V781 PolarHBondContact O-N 2.87Å; L778-G782 PolarHBondContact O-N 3.09Å
779	I	92.7	Very high	89	Confident	120 Å²	120	85.6 Å²	85.6	62%	0.615	44%	0.436	S	S	*	.	H	α-helix	trans	-62.9	-45.8	175.5	-65.6	162.9	0	0	0	111	R775 K776 R777 V781 G782 A783	R775-I779 WeakPolarHBondContact O-CG1 3.38Å; R775-I779 PolarHBondContact O-N 3.45Å; K776-I779 PolarHBondContact O-N 3.23Å; R777-I779 VanDerWaalsContact C-N 3.34Å; R777-I779 PolarHBondContact O-N 2.89Å; I779-V781 PolarHBondContact O-N 3.02Å; I779-G782 PolarHBondContact O-N 3.31Å; I779-A783 VanDerWaalsContact O-CB 3.32Å; I779-A783 WeakPolarHBondContact O-CB 3.31Å; I779-A783 PolarHBondContact O-N 3.03Å
780	I	92.4	Very high	90	Very high	62 Å²	62	85 Å²	85	32%	0.318	44%	0.444	S	S	.	.	H	α-helix	trans	-60.8	-44.1	177.4	-69.2	163.1	0	0	0	111.2	L761 K776 R777 S784	L761-I780 HydrophobicContact CB-CG2 4.24Å; K776-I780 VanDerWaalsContact O-CG1 3.31Å; K776-I780 WeakPolarHBondContact O-CG1 3.43Å; K776-I780 PolarHBondContact O-N 3.33Å; R777-I780 PolarHBondContact O-N 3.1Å; I780-S784 WeakPolarHBondContact O-CB 3.23Å; I780-S784 PolarHBondContact O-N 3.26Å; I780-S784 PolarHBondContact O-OG 3.19Å
781	V	93	Very high	90.9	Very high	35 Å²	35	83.6 Å²	83.6	21%	0.212	43%	0.431	C	S	.	.	H	α-helix	trans	-64.7	-45.5	178	173.3	0	0	0	0	111.1	R777 L778 I779 S784 L785	R777-V781 HydrophobicContact CG-CG2 4.37Å; R777-V781 VanDerWaalsContact O-CG2 3.25Å; R777-V781 WeakPolarHBondContact O-CG2 3.45Å; R777-V781 PolarHBondContact O-N 3.4Å; L778-V781 PolarHBondContact O-N 2.87Å; I779-V781 PolarHBondContact O-N 3.02Å; V781-S784 PolarHBondContact O-OG 3.11Å; V781-L785 HydrophobicContact CG1-CD1 3.82Å; V781-L785 HydrophobicContact CG1-CG 4.49Å; V781-L785 WeakPolarHBondContact O-CB 2.97Å; V781-L785 VanDerWaalsContact O-CG 3.27Å; V781-L785 WeakPolarHBondContact O-CG 2.98Å; V781-L785 PolarHBondContact O-N 3.15Å; V781-L785 VanDerWaalsContact O-N 3.08Å
782	G	93.2	Very high	91.8	Very high	35 Å²	35	76.7 Å²	76.7	36%	0.361	40%	0.403	S	S	.	.	H	α-helix	trans	-59.8	-55.1	176.5	0	0	0	0	0	111.8	L778 I779 S784 L785 T786	L778-G782 PolarHBondContact O-N 3.09Å; I779-G782 PolarHBondContact O-N 3.31Å; G782-S784 PolarHBondContact O-N 3.37Å; G782-L785 PolarHBondContact O-N 3.2Å; G782-T786 PolarHBondContact O-N 3.38Å; G782-T786 PolarHBondContact O-OG1 2.92Å; G782-T786 VanDerWaalsContact O-OG1 3.12Å
783	A	95.4	Very high	92.3	Very high	59 Å²	59	74.2 Å²	74.2	49%	0.488	40%	0.397	S	S	.	.	H	α-helix	trans	-61	-42.3	-178	0	0	0	0	0	113.1	I779 L787	I779-A783 VanDerWaalsContact O-CB 3.32Å; I779-A783 WeakPolarHBondContact O-CB 3.31Å; I779-A783 PolarHBondContact O-N 3.03Å; A783-L787 VanDerWaalsContact O-CB 3.26Å; A783-L787 WeakPolarHBondContact O-CB 3.32Å; A783-L787 PolarHBondContact O-N 2.83Å
784	S	95.3	Very high	92.9	Very high	6 Å²	6	78.2 Å²	78.2	4%	0.042	42%	0.418	C	S	.	.	H	α-helix	trans	-70.4	-34.5	179.1	54.8	0	0	0	0	113.2	L758 I780 V781 G782 C788	L758-S784 WeakPolarHBondContact O-CB 3.29Å; I780-S784 WeakPolarHBondContact O-CB 3.23Å; I780-S784 PolarHBondContact O-N 3.26Å; I780-S784 PolarHBondContact O-OG 3.19Å; V781-S784 PolarHBondContact O-OG 3.11Å; G782-S784 PolarHBondContact O-N 3.37Å; S784-C788 WeakPolarHBondContact O-CB 3.08Å; S784-C788 PolarHBondContact O-N 2.83Å
785	L	94.8	Very high	93.3	Very high	79 Å²	79	69.8 Å²	69.8	41%	0.414	39%	0.387	S	S	.	.	H	α-helix	trans	-70.8	-43.4	172.8	-69.8	174.1	0	0	0	111.9	A762 V781 G782 L787 C788 V789	A762-L785 HydrophobicContact CB-CD2 3.87Å; A762-L785 HydrophobicContact CB-CG 3.95Å; V781-L785 HydrophobicContact CG1-CD1 3.82Å; V781-L785 HydrophobicContact CG1-CG 4.49Å; V781-L785 WeakPolarHBondContact O-CB 2.97Å; V781-L785 VanDerWaalsContact O-CG 3.27Å; V781-L785 WeakPolarHBondContact O-CG 2.98Å; V781-L785 PolarHBondContact O-N 3.15Å; V781-L785 VanDerWaalsContact O-N 3.08Å; G782-L785 PolarHBondContact O-N 3.2Å; L785-L787 PolarHBondContact O-N 3.42Å; L785-C788 WeakPolarHBondContact O-CB 3.47Å; L785-C788 PolarHBondContact O-N 2.74Å; L785-V789 WeakPolarHBondContact O-CG2 3.27Å; L785-V789 PolarHBondContact O-N 3.16Å
786	T	95.7	Very high	93.4	Very high	99 Å²	99	63.7 Å²	63.7	61%	0.607	37%	0.366	S	S	*	.	H	α-helix	trans	-60.6	-44.9	175	-61.5	0	0	0	0	111.4	G782 V789 A790	G782-T786 PolarHBondContact O-N 3.38Å; G782-T786 PolarHBondContact O-OG1 2.92Å; G782-T786 VanDerWaalsContact O-OG1 3.12Å; T786-V789 PolarHBondContact O-N 3.31Å; T786-A790 WeakPolarHBondContact O-CB 3.49Å; T786-A790 PolarHBondContact O-N 3.2Å
787	L	96.5	Very high	93.5	Very high	98 Å²	98	61.9 Å²	61.9	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-66.6	-36.7	177.2	-177.5	55.1	0	0	0	112.3	L758 A783 L785 A790 L791	L758-L787 HydrophobicContact CD1-CB 4.45Å; L758-L787 HydrophobicContact CD1-CD2 4.42Å; L758-L787 HydrophobicContact CD1-CG 4.01Å; L758-L787 HydrophobicContact CD2-CB 4.41Å; L758-L787 HydrophobicContact CD2-CD2 3.77Å; L758-L787 HydrophobicContact CD2-CG 4.16Å; A783-L787 VanDerWaalsContact O-CB 3.26Å; A783-L787 WeakPolarHBondContact O-CB 3.32Å; A783-L787 PolarHBondContact O-N 2.83Å; L785-L787 PolarHBondContact O-N 3.42Å; L787-A790 PolarHBondContact O-N 2.92Å; L787-L791 VanDerWaalsContact O-CB 3.28Å; L787-L791 WeakPolarHBondContact O-CB 3.48Å; L787-L791 PolarHBondContact O-N 2.88Å
788	C	95.8	Very high	93.5	Very high	10 Å²	10	61.9 Å²	61.9	7%	0.068	37%	0.367	C	S	.	.	H	α-helix	trans	-62.7	-42.2	174.3	-175.3	0	0	0	0	112.1	L758 S784 L785 L792	L758-C788 HydrophobicContact CB-CB 4.31Å; L758-C788 HydrophobicContact CD1-CB 4.24Å; S784-C788 WeakPolarHBondContact O-CB 3.08Å; S784-C788 PolarHBondContact O-N 2.83Å; L785-C788 WeakPolarHBondContact O-CB 3.47Å; L785-C788 PolarHBondContact O-N 2.74Å; C788-L792 WeakPolarHBondContact O-CB 3.45Å; C788-L792 PolarHBondContact O-N 3.29Å; C788-L792 VanDerWaalsContact O-N 3.14Å
789	V	95.4	Very high	93.4	Very high	100 Å²	100	55.7 Å²	55.7	61%	0.606	33%	0.334	S	S	*	.	H	α-helix	trans	-71.8	-41.2	177.2	173.6	0	0	0	0	111.3	L785 T786 L792 A793	L785-V789 WeakPolarHBondContact O-CG2 3.27Å; L785-V789 PolarHBondContact O-N 3.16Å; T786-V789 PolarHBondContact O-N 3.31Å; V789-L792 PolarHBondContact O-N 2.75Å; V789-A793 WeakPolarHBondContact O-CB 3.46Å; V789-A793 PolarHBondContact O-N 2.81Å
790	A	95.7	Very high	93	Very high	54 Å²	54	55.7 Å²	55.7	45%	0.446	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-41.2	177.3	0	0	0	0	0	112.3	T786 L787 A793 L794	T786-A790 WeakPolarHBondContact O-CB 3.49Å; T786-A790 PolarHBondContact O-N 3.2Å; L787-A790 PolarHBondContact O-N 2.92Å; A790-A793 PolarHBondContact O-N 3.29Å; A790-L794 WeakPolarHBondContact O-CB 3.4Å; A790-L794 PolarHBondContact O-N 3.13Å
791	L	95.6	Very high	92.3	Very high	30 Å²	30	57.3 Å²	57.3	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-65.7	-41.8	175.5	-176.9	62	0	0	0	111.9	F751 I754 F755 L787 L794 L795	F751-L791 HydrophobicContact CE1-CD1 4.33Å; I754-L791 HydrophobicContact CG2-CD2 3.56Å; F755-L791 HydrophobicContact CD2-CD2 4.3Å; F755-L791 HydrophobicContact CE1-CB 4.48Å; F755-L791 HydrophobicContact CE1-CD2 4.28Å; F755-L791 HydrophobicContact CE1-CG 4.44Å; F755-L791 HydrophobicContact CE2-CD2 3.83Å; F755-L791 HydrophobicContact CE2-CG 4.11Å; F755-L791 HydrophobicContact CZ-CB 4.2Å; F755-L791 HydrophobicContact CZ-CD2 3.82Å; F755-L791 HydrophobicContact CZ-CG 3.78Å; L787-L791 VanDerWaalsContact O-CB 3.28Å; L787-L791 WeakPolarHBondContact O-CB 3.48Å; L787-L791 PolarHBondContact O-N 2.88Å; L791-L794 PolarHBondContact O-N 2.87Å; L791-L795 HydrophobicContact CG-CD1 4.38Å; L791-L795 WeakPolarHBondContact O-CG 3.3Å; L791-L795 PolarHBondContact O-N 3.29Å
792	L	93.3	Very high	90.9	Very high	50 Å²	50	60.4 Å²	60.4	26%	0.262	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-43.9	176.5	-173.6	65.2	0	0	0	111.6	L682 F755 C788 V789 L795 F796	L682-L792 HydrophobicContact CD2-CD1 3.82Å; F755-L792 HydrophobicContact CE1-CB 4.13Å; F755-L792 HydrophobicContact CZ-CB 4.18Å; F755-L792 HydrophobicContact CZ-CD1 4.28Å; C788-L792 WeakPolarHBondContact O-CB 3.45Å; C788-L792 PolarHBondContact O-N 3.29Å; C788-L792 VanDerWaalsContact O-N 3.14Å; V789-L792 PolarHBondContact O-N 2.75Å; L792-L795 PolarHBondContact O-N 3.3Å; L792-F796 HydrophobicContact CD1-CD2 4.25Å; L792-F796 HydrophobicContact CD1-CE2 3.77Å; L792-F796 HydrophobicContact CD2-CE2 4.43Å; L792-F796 HydrophobicContact CG-CD2 4.08Å; L792-F796 HydrophobicContact CG-CE2 3.84Å; L792-F796 VanDerWaalsContact O-CD2 3.25Å; L792-F796 WeakPolarHBondContact O-CD2 3.44Å; L792-F796 PolarHBondContact O-N 3.29Å
793	A	93.4	Very high	89.4	Confident	52 Å²	52	60.5 Å²	60.5	43%	0.43	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-42.8	175.9	0	0	0	0	0	112.2	V789 A790 F796 V797	V789-A793 WeakPolarHBondContact O-CB 3.46Å; V789-A793 PolarHBondContact O-N 2.81Å; A790-A793 PolarHBondContact O-N 3.29Å; A793-F796 PolarHBondContact O-N 3.38Å; A793-V797 WeakPolarHBondContact O-CG2 3.47Å; A793-V797 PolarHBondContact O-N 2.94Å
794	L	93.1	Very high	87.6	Confident	95 Å²	95	60.7 Å²	60.7	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-45.5	175.1	176.7	61.8	0	0	0	111.6	A790 L791 F796 V797 L798	A790-L794 WeakPolarHBondContact O-CB 3.4Å; A790-L794 PolarHBondContact O-N 3.13Å; L791-L794 PolarHBondContact O-N 2.87Å; L794-F796 PolarHBondContact O-N 3.16Å; L794-V797 PolarHBondContact O-N 2.95Å; L794-L798 HydrophobicContact CD1-CD1 4.34Å; L794-L798 HydrophobicContact CD1-CG 4.32Å; L794-L798 HydrophobicContact CG-CD1 4.2Å; L794-L798 WeakPolarHBondContact O-CG 3.11Å; L794-L798 PolarHBondContact O-N 3.16Å
795	L	92.7	Very high	85.6	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-37.7	178.1	-74.1	173.4	0	0	0	112.5	L682 F751 F755 L791 L792 L798 F799	L682-L795 HydrophobicContact CD2-CB 3.66Å; L682-L795 HydrophobicContact CG-CB 3.99Å; F751-L795 HydrophobicContact CD1-CD1 3.84Å; F751-L795 HydrophobicContact CD1-CD2 4.44Å; F751-L795 HydrophobicContact CE1-CD1 4.03Å; F751-L795 HydrophobicContact CE1-CD2 3.91Å; F751-L795 HydrophobicContact CE1-CG 4.41Å; F751-L795 HydrophobicContact CZ-CD2 4.17Å; F755-L795 HydrophobicContact CE2-CD1 3.7Å; F755-L795 HydrophobicContact CZ-CD1 4Å; L791-L795 HydrophobicContact CG-CD1 4.38Å; L791-L795 WeakPolarHBondContact O-CG 3.3Å; L791-L795 PolarHBondContact O-N 3.29Å; L792-L795 PolarHBondContact O-N 3.3Å; L795-L798 PolarHBondContact O-N 2.96Å; L795-F799 VanDerWaalsContact O-CB 3.29Å; L795-F799 WeakPolarHBondContact O-CB 3.47Å; L795-F799 PolarHBondContact O-N 3.37Å
796	F	91.1	Very high	83.4	Confident	64 Å²	64	66.1 Å²	66.1	28%	0.281	37%	0.373	S	S	.	.	H	α-helix	trans	-66.4	-40.4	172.1	-81	-61.5	0	0	0	112.7	L633 L682 L792 A793 L794 F799 Y800	L633-F796 HydrophobicContact CD1-CE1 4.11Å; L633-F796 HydrophobicContact CD1-CZ 4.25Å; L682-F796 HydrophobicContact CD1-CD1 4.05Å; L682-F796 HydrophobicContact CD1-CE1 3.95Å; L682-F796 HydrophobicContact CD2-CD1 4.07Å; L682-F796 HydrophobicContact CD2-CD2 4Å; L682-F796 HydrophobicContact CD2-CE1 3.98Å; L682-F796 HydrophobicContact CD2-CE2 3.91Å; L682-F796 HydrophobicContact CD2-CG 4.07Å; L682-F796 HydrophobicContact CD2-CZ 3.9Å; L792-F796 HydrophobicContact CD1-CD2 4.25Å; L792-F796 HydrophobicContact CD1-CE2 3.77Å; L792-F796 HydrophobicContact CD2-CE2 4.43Å; L792-F796 HydrophobicContact CG-CD2 4.08Å; L792-F796 HydrophobicContact CG-CE2 3.84Å; L792-F796 VanDerWaalsContact O-CD2 3.25Å; L792-F796 WeakPolarHBondContact O-CD2 3.44Å; L792-F796 PolarHBondContact O-N 3.29Å; A793-F796 PolarHBondContact O-N 3.38Å; L794-F796 PolarHBondContact O-N 3.16Å; F796-F799 PolarHBondContact O-N 3.01Å; F796-Y800 AromaticContact CD1-CE2 3.98Å; F796-Y800 HydrophobicContact CD1-CE2 3.98Å; F796-Y800 WeakPolarHBondContact O-CD2 3.38Å; F796-Y800 PolarHBondContact O-N 3.34Å; F796-Y800 VanDerWaalsContact O-N 3.07Å
797	V	89.7	Confident	81.4	Confident	80 Å²	80	63.4 Å²	63.4	49%	0.485	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-41.2	175.7	170.3	0	0	0	0	111.2	A793 L794 V801	A793-V797 WeakPolarHBondContact O-CG2 3.47Å; A793-V797 PolarHBondContact O-N 2.94Å; L794-V797 PolarHBondContact O-N 2.95Å; V797-V801 HydrophobicContact CG1-CB 4.48Å; V797-V801 HydrophobicContact CG1-CG2 4.3Å; V797-V801 VanDerWaalsContact O-CB 3.25Å; V797-V801 WeakPolarHBondContact O-CB 3.49Å; V797-V801 WeakPolarHBondContact O-CG2 3.21Å; V797-V801 PolarHBondContact O-N 2.92Å
798	L	87.9	Confident	79.1	Confident	35 Å²	35	64.2 Å²	64.2	18%	0.183	36%	0.359	C	S	.	.	H	α-helix	trans	-63.4	-44.9	171.9	-69	172.4	0	0	0	111.2	V686 L794 L795 Y800 N802 P803 L804	V686-L798 HydrophobicContact CG1-CB 3.95Å; V686-L798 HydrophobicContact CG2-CB 4.38Å; L794-L798 HydrophobicContact CD1-CD1 4.34Å; L794-L798 HydrophobicContact CD1-CG 4.32Å; L794-L798 HydrophobicContact CG-CD1 4.2Å; L794-L798 WeakPolarHBondContact O-CG 3.11Å; L794-L798 PolarHBondContact O-N 3.16Å; L795-L798 PolarHBondContact O-N 2.96Å; L798-Y800 PolarHBondContact O-N 3.45Å; L798-N802 HydrophobicContact CD2-CB 4.46Å; L798-N802 CarbonylContact O-C 3.57Å; L798-N802 PolarHBondContact O-N 3.37Å; L798-N802 VanDerWaalsContact O-O 3.13Å; L798-P803 WeakPolarHBondContact O-CA 3.35Å; L798-L804 HydrophobicContact CD1-CD1 4.34Å; L798-L804 HydrophobicContact CD2-CD1 4.24Å; L798-L804 HydrophobicContact CD2-CD2 4.29Å; L798-L804 HydrophobicContact CD2-CG 4.3Å
799	F	88.2	Confident	77.1	Confident	3 Å²	3	69.5 Å²	69.5	1%	0.013	39%	0.386	C	S	.	.	H	α-helix	trans	-60	-40.5	-178.1	-173.9	-105.1	0	0	0	113.8	A459 M462 R463 F630 L682 A685 V686 L795 F796	A459-F799 HydrophobicContact CB-CE2 4.15Å; M462-F799 HydrophobicContact CB-CE1 4.21Å; M462-F799 HydrophobicContact CB-CZ 3.81Å; M462-F799 HydrophobicContact CE-CE2 4.4Å; M462-F799 HydrophobicContact CE-CZ 4.14Å; R463-F799 HydrophobicContact CB-CE1 3.95Å; R463-F799 HydrophobicContact CB-CZ 4.18Å; R463-F799 WeakPolarHBondContact CD-O 3.32Å; R463-F799 HydrophobicContact CG-CE1 3.84Å; R463-F799 HydrophobicContact CG-CE2 4.31Å; R463-F799 HydrophobicContact CG-CZ 3.62Å; R463-F799 PolarHBondContact NE-O 3.03Å; F630-F799 HydrophobicContact CE1-CE1 4.37Å; L682-F799 HydrophobicContact CD1-CB 4.24Å; L682-F799 HydrophobicContact CD1-CD2 4.47Å; L682-F799 HydrophobicContact CD1-CG 4.22Å; A685-F799 HydrophobicContact CB-CD2 4.2Å; A685-F799 HydrophobicContact CB-CE2 3.8Å; V686-F799 HydrophobicContact CG2-CB 3.8Å; V686-F799 HydrophobicContact CG2-CD2 4.06Å; V686-F799 HydrophobicContact CG2-CG 4.44Å; L795-F799 VanDerWaalsContact O-CB 3.29Å; L795-F799 WeakPolarHBondContact O-CB 3.47Å; L795-F799 PolarHBondContact O-N 3.37Å; F796-F799 PolarHBondContact O-N 3.01Å
800	Y	84.2	Confident	75	Confident	120 Å²	120	65.8 Å²	65.8	47%	0.471	36%	0.364	S	S	.	.	H	α-helix	trans	-94.7	-37.1	-178.1	-66.2	-69.3	0	0	0	115.1	F630 F796 L798	F630-Y800 AromaticContact CE1-CE1 3.84Å; F630-Y800 HydrophobicContact CE1-CE1 3.84Å; F630-Y800 AromaticContact CE1-CZ 3.73Å; F630-Y800 WeakPolarHBondContact CE1-OH 3.34Å; F630-Y800 AromaticContact CZ-CE1 3.9Å; F630-Y800 HydrophobicContact CZ-CE1 3.9Å; F630-Y800 AromaticContact CZ-CZ 3.94Å; F630-Y800 WeakPolarHBondContact CZ-OH 3.4Å; F796-Y800 AromaticContact CD1-CE2 3.98Å; F796-Y800 HydrophobicContact CD1-CE2 3.98Å; F796-Y800 WeakPolarHBondContact O-CD2 3.38Å; F796-Y800 PolarHBondContact O-N 3.34Å; F796-Y800 VanDerWaalsContact O-N 3.07Å; L798-Y800 PolarHBondContact O-N 3.45Å
801	V	77.3	Confident	72.8	Confident	97 Å²	97	65.7 Å²	65.7	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-103.7	-40.5	-165.8	-167.6	0	0	0	0	112.3	V797	V797-V801 HydrophobicContact CG1-CB 4.48Å; V797-V801 HydrophobicContact CG1-CG2 4.3Å; V797-V801 VanDerWaalsContact O-CB 3.25Å; V797-V801 WeakPolarHBondContact O-CB 3.49Å; V797-V801 WeakPolarHBondContact O-CG2 3.21Å; V797-V801 PolarHBondContact O-N 2.92Å
802	N	65.5	Low	70.6	Confident	99 Å²	99	69.7 Å²	69.7	53%	0.529	37%	0.369	S	S	.	.			trans	-136.6	65.5	-178.9	-69.2	-85.8	0	0	0	110.1	L798 L804	L798-N802 HydrophobicContact CD2-CB 4.46Å; L798-N802 CarbonylContact O-C 3.57Å; L798-N802 PolarHBondContact O-N 3.37Å; L798-N802 VanDerWaalsContact O-O 3.13Å; N802-L804 PolarHBondContact O-N 3.26Å
803	P	61.2	Low	68.6	Low	38 Å²	38	72.5 Å²	72.5	25%	0.247	38%	0.38	C	S	.	.			trans	-67.5	129.9	178.1	31.8	-36.4	0	0	0	108	L798 W805	L798-P803 WeakPolarHBondContact O-CA 3.35Å; P803-W805 VanDerWaalsContact C-CD1 3.47Å; P803-W805 VanDerWaalsContact O-CD1 3.25Å; P803-W805 PolarHBondContact O-N 3.29Å
804	L	57.8	Low	66.6	Low	63 Å²	63	71.3 Å²	71.3	33%	0.33	37%	0.366	S	S	.	.			trans	-85.5	54.4	-156.8	-66.8	176.4	0	0	0	113.8	V686 F687 L798 N802 S806 C807	V686-L804 HydrophobicContact CG1-CD1 4.35Å; V686-L804 HydrophobicContact CG1-CG 4.48Å; F687-L804 HydrophobicContact CD1-CD1 4.46Å; F687-L804 HydrophobicContact CE1-CD1 3.63Å; F687-L804 HydrophobicContact CZ-CD1 4.04Å; L798-L804 HydrophobicContact CD1-CD1 4.34Å; L798-L804 HydrophobicContact CD2-CD1 4.24Å; L798-L804 HydrophobicContact CD2-CD2 4.29Å; L798-L804 HydrophobicContact CD2-CG 4.3Å; N802-L804 PolarHBondContact O-N 3.26Å; L804-S806 VanDerWaalsContact C-N 3.28Å; L804-S806 PolarHBondContact O-N 2.87Å; L804-C807 HydrophobicContact CB-CB 4.32Å; L804-C807 WeakPolarHBondContact O-CB 3.42Å; L804-C807 PolarHBondContact O-N 3.42Å
805	W	52.1	Low	64.8	Low	89 Å²	89	68.2 Å²	68.2	34%	0.337	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.5	-172	-62.1	10.6	0	0	0	114.2	D465 L466 N467 P803	D465-W805 VanDerWaalsContact CG-CZ2 3.5Å; D465-W805 WeakPolarHBondContact OD1-CH2 3.28Å; D465-W805 WeakPolarHBondContact OD1-CZ2 3.43Å; D465-W805 WeakPolarHBondContact OD2-CZ2 3.31Å; L466-W805 HydrophobicContact CB-CH2 3.56Å; L466-W805 HydrophobicContact CB-CZ3 3.75Å; L466-W805 HydrophobicContact CD1-CH2 4.5Å; L466-W805 HydrophobicContact CD1-CZ3 4.46Å; L466-W805 HydrophobicContact CG-CH2 4.15Å; L466-W805 HydrophobicContact CG-CZ3 4.48Å; L466-W805 VanDerWaalsContact N-CH2 3.27Å; N467-W805 HydrophobicContact CB-CH2 4.36Å; N467-W805 HydrophobicContact CB-CZ3 4.25Å; N467-W805 VanDerWaalsContact CG-CZ3 3.49Å; N467-W805 VanDerWaalsContact OD1-CZ3 3.31Å; N467-W805 WeakPolarHBondContact OD1-CZ3 3.32Å; P803-W805 VanDerWaalsContact C-CD1 3.47Å; P803-W805 VanDerWaalsContact O-CD1 3.25Å; P803-W805 PolarHBondContact O-N 3.29Å
806	S	49.7	Very low	63.3	Low	109 Å²	109	72.9 Å²	72.9	76%	0.762	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	23.4	-178.4	53.1	0	0	0	0	112.9	L804 Q808	L804-S806 VanDerWaalsContact C-N 3.28Å; L804-S806 PolarHBondContact O-N 2.87Å; S806-Q808 VanDerWaalsContact C-N 3.31Å; S806-Q808 PolarHBondContact O-N 3.07Å
807	C	53.6	Low	62.1	Low	43 Å²	43	70.2 Å²	70.2	29%	0.291	36%	0.362	S	S	.	.			trans	-71.6	85.6	175.8	-179	0	0	0	0	111.1	L804 N809 C810	L804-C807 HydrophobicContact CB-CB 4.32Å; L804-C807 WeakPolarHBondContact O-CB 3.42Å; L804-C807 PolarHBondContact O-N 3.42Å; C807-N809 PolarHBondContact O-N 3.19Å; C807-C810 HydrophobicContact CB-CB 3.57Å; C807-C810 WeakPolarHBondContact CB-SG 3.3Å; C807-C810 WeakPolarHBondContact O-CB 3.25Å; C807-C810 PolarHBondContact O-N 3Å; C807-C810 WeakPolarHBondContact SG-CB 3.44Å; C807-C810 PolarHBondContact SG-N 3.02Å; C807-C810 CovalentContact SG-SG 2.04Å; C807-C810 PolarHBondContact SG-SG 2.85Å
808	Q	48.6	Very low	61	Low	115 Å²	115	67.7 Å²	67.7	54%	0.537	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-31.1	178.3	-147.7	-177.7	36.3	0	0	113.2	S806 Y812 E870	S806-Q808 VanDerWaalsContact C-N 3.31Å; S806-Q808 PolarHBondContact O-N 3.07Å; Q808-Y812 VanDerWaalsContact O-CE2 3.32Å; Q808-Y812 WeakPolarHBondContact O-CE2 3.43Å; Q808-E870 PolarHBondContact NE2-OE2 2.92Å
809	N	52.7	Low	60.1	Low	120 Å²	120	69.1 Å²	69.1	64%	0.642	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-11	178	-74.4	-24.3	0	0	0	115.4	C807 Y812	C807-N809 PolarHBondContact O-N 3.19Å; N809-Y812 HydrophobicContact CB-CD2 4.44Å
810	C	52.2	Low	59.5	Low	22 Å²	22	69.9 Å²	69.9	15%	0.149	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-34.2	-177	-67	0	0	0	0	111.9	F687 Y747 C807 Y812 F813	F687-C810 HydrophobicContact CD1-CB 4.47Å; F687-C810 VanDerWaalsContact CD1-SG 3.59Å; Y747-C810 WeakPolarHBondContact OH-CA 3.39Å; Y747-C810 WeakPolarHBondContact OH-CB 3.21Å; Y747-C810 PolarHBondContact OH-O 2.73Å; Y747-C810 VanDerWaalsContact OH-O 3.04Å; C807-C810 HydrophobicContact CB-CB 3.57Å; C807-C810 WeakPolarHBondContact CB-SG 3.3Å; C807-C810 WeakPolarHBondContact O-CB 3.25Å; C807-C810 PolarHBondContact O-N 3Å; C807-C810 WeakPolarHBondContact SG-CB 3.44Å; C807-C810 PolarHBondContact SG-N 3.02Å; C807-C810 CovalentContact SG-SG 2.04Å; C807-C810 PolarHBondContact SG-SG 2.85Å; C810-Y812 PolarHBondContact O-N 3.49Å; C810-F813 WeakPolarHBondContact O-CB 3.34Å; C810-F813 PolarHBondContact O-N 3.4Å
811	M	47.9	Very low	59.3	Low	52 Å²	52	64.5 Å²	64.5	26%	0.256	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-56.2	-35.1	175.4	-172.7	174.4	68.1	0	0	112.2	F813 N814 S815 Q817	M811-F813 PolarHBondContact O-N 3.24Å; M811-F813 VanDerWaalsContact O-N 3.13Å; M811-N814 PolarHBondContact O-N 3.48Å; M811-S815 PolarHBondContact O-N 2.96Å; M811-Q817 HydrophobicContact CE-CG 4.11Å; M811-Q817 HydrophobicContact SD-CG 4.24Å
812	Y	50.1	Low	59.4	Low	114 Å²	114	64.1 Å²	64.1	45%	0.447	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-62.9	-17.3	177.3	-56.6	-52.1	0	0	0	114.6	Q808 N809 C810 Y839	Q808-Y812 VanDerWaalsContact O-CE2 3.32Å; Q808-Y812 WeakPolarHBondContact O-CE2 3.43Å; N809-Y812 HydrophobicContact CB-CD2 4.44Å; C810-Y812 PolarHBondContact O-N 3.49Å; Y812-Y839 HydrophobicContact CE1-CG 4.28Å
813	F	51.9	Low	60.1	Low	110 Å²	110	61.2 Å²	61.2	48%	0.482	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-81.2	-20.3	179.6	-136.5	-92.1	0	0	0	113.3	N746 Y747 C810 M811	N746-F813 HydrophobicContact CB-CD1 3.94Å; N746-F813 HydrophobicContact CB-CE1 4Å; Y747-F813 HydrophobicContact CE2-CB 4.09Å; Y747-F813 WeakPolarHBondContact OH-CB 3.5Å; C810-F813 WeakPolarHBondContact O-CB 3.34Å; C810-F813 PolarHBondContact O-N 3.4Å; M811-F813 PolarHBondContact O-N 3.24Å; M811-F813 VanDerWaalsContact O-N 3.13Å
814	N	50.6	Low	61.2	Low	26 Å²	26	59.4 Å²	59.4	14%	0.139	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-16.6	173	-72	7.3	0	0	0	112.9	M811 E816 Q819	M811-N814 PolarHBondContact O-N 3.48Å; N814-E816 PolarHBondContact O-N 3.14Å; N814-Q819 PolarHBondContact O-NE2 2.89Å
815	S	56	Low	62.5	Low	31 Å²	31	61.4 Å²	61.4	22%	0.217	32%	0.323	C	S	.	.			trans	65.9	21.5	160.5	71.5	0	0	0	0	118.4	M811 Q817 A818 Q819	M811-S815 PolarHBondContact O-N 2.96Å; S815-Q817 PolarHBondContact O-N 3.33Å; S815-A818 WeakPolarHBondContact O-CA 3.37Å; S815-A818 WeakPolarHBondContact O-CB 3.1Å; S815-A818 PolarHBondContact O-N 3.44Å; S815-Q819 PolarHBondContact O-N 3.4Å; S815-Q819 PolarHBondContact OG-NE2 2.84Å
816	E	60.4	Low	63.8	Low	101 Å²	101	61.2 Å²	61.2	47%	0.472	34%	0.34	S	S	.	.	H	α-helix	trans	-48.9	-51.9	-173.2	-61.7	178.1	164.6	0	0	114.1	N814 A818 Q819 E820	N814-E816 PolarHBondContact O-N 3.14Å; E816-A818 VanDerWaalsContact C-N 3.27Å; E816-A818 PolarHBondContact O-N 3.13Å; E816-Q819 PolarHBondContact O-N 3.26Å; E816-Q819 VanDerWaalsContact O-N 3.09Å; E816-E820 PolarHBondContact O-N 2.92Å
817	Q	66.8	Low	65.5	Low	7 Å²	7	61.2 Å²	61.2	3%	0.033	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-35.5	176.7	-66	-168.9	-3.5	0	0	113.4	M811 S815 V821 Y839 F868 T869 Y872	M811-Q817 HydrophobicContact CE-CG 4.11Å; M811-Q817 HydrophobicContact SD-CG 4.24Å; S815-Q817 PolarHBondContact O-N 3.33Å; Q817-V821 WeakPolarHBondContact O-CB 2.98Å; Q817-V821 WeakPolarHBondContact O-CG2 2.97Å; Q817-V821 PolarHBondContact O-N 3.35Å; Q817-V821 VanDerWaalsContact O-N 3.09Å; Q817-Y839 HydrophobicContact CB-CD1 4.43Å; Q817-Y839 HydrophobicContact CB-CE1 4.13Å; Q817-F868 HydrophobicContact CB-CD2 4.09Å; Q817-F868 HydrophobicContact CB-CE2 3.92Å; Q817-F868 HydrophobicContact CG-CD2 4.05Å; Q817-F868 HydrophobicContact CG-CE2 4.18Å; Q817-T869 PolarHBondContact NE2-O 3.42Å; Q817-Y872 HydrophobicContact CG-CD1 4.26Å; Q817-Y872 PolarHBondContact NE2-O 2.99Å
818	A	67.4	Low	67	Low	27 Å²	27	61.4 Å²	61.4	22%	0.223	33%	0.325	C	S	.	.	H	α-helix	trans	-74.5	-32.3	178.8	0	0	0	0	0	111.7	S815 E816 T822 Y839	S815-A818 WeakPolarHBondContact O-CA 3.37Å; S815-A818 WeakPolarHBondContact O-CB 3.1Å; S815-A818 PolarHBondContact O-N 3.44Å; E816-A818 VanDerWaalsContact C-N 3.27Å; E816-A818 PolarHBondContact O-N 3.13Å; A818-T822 VanDerWaalsContact O-CB 3.3Å; A818-T822 WeakPolarHBondContact O-CB 3.1Å; A818-T822 PolarHBondContact O-N 2.85Å; A818-T822 PolarHBondContact O-OG1 3.3Å; A818-Y839 WeakPolarHBondContact CA-OH 3.35Å; A818-Y839 HydrophobicContact CB-CE1 4.44Å; A818-Y839 VanDerWaalsContact CB-OH 3.26Å; A818-Y839 WeakPolarHBondContact CB-OH 3.33Å
819	Q	68.5	Low	68.8	Low	66 Å²	66	57.8 Å²	57.8	31%	0.308	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-42.7	175.2	-63.4	-175.4	19	0	0	111.1	L740 N814 S815 E816 T822 A823	L740-Q819 PolarHBondContact O-NE2 2.95Å; N814-Q819 PolarHBondContact O-NE2 2.89Å; S815-Q819 PolarHBondContact O-N 3.4Å; S815-Q819 PolarHBondContact OG-NE2 2.84Å; E816-Q819 PolarHBondContact O-N 3.26Å; E816-Q819 VanDerWaalsContact O-N 3.09Å; Q819-T822 PolarHBondContact O-N 3.49Å; Q819-A823 WeakPolarHBondContact O-CB 3.21Å; Q819-A823 PolarHBondContact O-N 3.02Å
820	E	74.7	Confident	70.3	Confident	18 Å²	18	59.8 Å²	59.8	8%	0.084	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-49.3	173.9	-173.8	173	-158.1	0	0	111.3	E816 T822 A823 L824 Y872 I912	E816-E820 PolarHBondContact O-N 2.92Å; E820-T822 VanDerWaalsContact C-N 3.31Å; E820-T822 PolarHBondContact O-N 2.95Å; E820-A823 PolarHBondContact O-N 2.9Å; E820-A823 VanDerWaalsContact O-N 3.11Å; E820-L824 HydrophobicContact CG-CD1 3.93Å; E820-L824 HydrophobicContact CG-CG 4.29Å; E820-L824 VanDerWaalsContact O-CG 3.3Å; E820-L824 WeakPolarHBondContact O-CG 3.09Å; E820-L824 PolarHBondContact O-N 3.37Å; E820-Y872 PolarHBondContact OE1-OH 3.4Å; E820-Y872 WeakPolarHBondContact OE2-CE1 3.45Å; E820-Y872 PolarHBondContact OE2-OH 2.96Å; E820-I912 WeakPolarHBondContact OE1-CB 3.05Å; E820-I912 WeakPolarHBondContact OE1-CG1 3.46Å; E820-I912 PolarHBondContact OE1-N 3.05Å
821	V	80.7	Confident	72.1	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-58.8	-40.8	176.8	167.1	0	0	0	0	112	Q817 L824 Q825 F832 M834 A841 F843 F868	Q817-V821 WeakPolarHBondContact O-CB 2.98Å; Q817-V821 WeakPolarHBondContact O-CG2 2.97Å; Q817-V821 PolarHBondContact O-N 3.35Å; Q817-V821 VanDerWaalsContact O-N 3.09Å; V821-L824 PolarHBondContact O-N 2.89Å; V821-Q825 WeakPolarHBondContact O-CB 3.41Å; V821-Q825 PolarHBondContact O-N 3Å; V821-F832 HydrophobicContact CG1-CZ 4.18Å; V821-M834 HydrophobicContact CG1-CE 4.45Å; V821-M834 HydrophobicContact CG1-SD 3.86Å; V821-A841 HydrophobicContact CG2-CB 4.18Å; V821-F843 HydrophobicContact CG2-CD1 4.07Å; V821-F843 HydrophobicContact CG2-CE1 3.83Å; V821-F868 HydrophobicContact CG2-CE2 3.78Å; V821-F868 HydrophobicContact CG2-CZ 4.19Å
822	T	78.3	Confident	74.1	Confident	89 Å²	89	59.7 Å²	59.7	55%	0.546	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-38.8	176.4	-56.7	0	0	0	0	111.7	A818 Q819 E820 A826	A818-T822 VanDerWaalsContact O-CB 3.3Å; A818-T822 WeakPolarHBondContact O-CB 3.1Å; A818-T822 PolarHBondContact O-N 2.85Å; A818-T822 PolarHBondContact O-OG1 3.3Å; Q819-T822 PolarHBondContact O-N 3.49Å; E820-T822 VanDerWaalsContact C-N 3.31Å; E820-T822 PolarHBondContact O-N 2.95Å; T822-A826 VanDerWaalsContact O-CB 3.29Å; T822-A826 WeakPolarHBondContact O-CB 3.05Å; T822-A826 PolarHBondContact O-N 2.92Å
823	A	80.8	Confident	75.9	Confident	39 Å²	39	62.3 Å²	62.3	32%	0.322	34%	0.337	S	S	.	.	H	α-helix	trans	-68.3	-43.3	176.9	0	0	0	0	0	112.2	Q819 E820 A826 I827 F913	Q819-A823 WeakPolarHBondContact O-CB 3.21Å; Q819-A823 PolarHBondContact O-N 3.02Å; E820-A823 PolarHBondContact O-N 2.9Å; E820-A823 VanDerWaalsContact O-N 3.11Å; A823-A826 PolarHBondContact O-N 2.9Å; A823-I827 WeakPolarHBondContact O-CB 3.34Å; A823-I827 WeakPolarHBondContact O-CG1 3.01Å; A823-I827 PolarHBondContact O-N 3.31Å; A823-F913 HydrophobicContact CB-CZ 4.38Å
824	L	85.1	Confident	77.5	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-47.8	174.5	-68.1	167.2	0	0	0	111	E820 V821 A826 I827 Y828 F832 F843 I845 I912 F913	E820-L824 HydrophobicContact CG-CD1 3.93Å; E820-L824 HydrophobicContact CG-CG 4.29Å; E820-L824 VanDerWaalsContact O-CG 3.3Å; E820-L824 WeakPolarHBondContact O-CG 3.09Å; E820-L824 PolarHBondContact O-N 3.37Å; V821-L824 PolarHBondContact O-N 2.89Å; L824-A826 VanDerWaalsContact C-N 3.3Å; L824-A826 PolarHBondContact O-N 3.4Å; L824-I827 PolarHBondContact O-N 3.27Å; L824-Y828 HydrophobicContact CB-CD2 4.5Å; L824-Y828 HydrophobicContact CD2-CD2 4.28Å; L824-Y828 HydrophobicContact CD2-CE2 3.81Å; L824-Y828 WeakPolarHBondContact O-CD2 3.2Å; L824-Y828 PolarHBondContact O-N 2.89Å; L824-F832 HydrophobicContact CB-CD2 4.07Å; L824-F832 HydrophobicContact CB-CE2 3.64Å; L824-F832 HydrophobicContact CB-CZ 4.43Å; L824-F832 HydrophobicContact CD1-CE2 4.46Å; L824-F843 HydrophobicContact CD1-CE2 3.8Å; L824-F843 HydrophobicContact CD1-CZ 3.73Å; L824-I845 HydrophobicContact CD2-CD1 4.15Å; L824-I912 HydrophobicContact CD1-CB 4Å; L824-I912 HydrophobicContact CD1-CG1 4.38Å; L824-I912 HydrophobicContact CD1-CG2 3.73Å; L824-I912 HydrophobicContact CD2-CB 4.2Å; L824-I912 HydrophobicContact CD2-CG2 3.81Å; L824-I912 HydrophobicContact CG-CG2 4.46Å; L824-F913 HydrophobicContact CD2-CD1 4.15Å; L824-F913 HydrophobicContact CD2-CD2 4.23Å; L824-F913 HydrophobicContact CD2-CE1 3.71Å; L824-F913 HydrophobicContact CD2-CE2 3.79Å; L824-F913 HydrophobicContact CD2-CG 4.39Å; L824-F913 HydrophobicContact CD2-CZ 3.51Å; L824-F913 HydrophobicContact CG-CE2 4.24Å; L824-F913 HydrophobicContact CG-CZ 4.04Å
825	Q	84.9	Confident	79.1	Confident	105 Å²	105	65.1 Å²	65.1	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-36.8	177	-171.6	175.7	20.2	0	0	112.3	V821 G829 F832	V821-Q825 WeakPolarHBondContact O-CB 3.41Å; V821-Q825 PolarHBondContact O-N 3Å; Q825-G829 WeakPolarHBondContact O-CA 3.45Å; Q825-G829 PolarHBondContact O-N 2.68Å; Q825-G829 VanDerWaalsContact O-N 3.09Å; Q825-F832 HydrophobicContact CB-CD1 3.78Å; Q825-F832 HydrophobicContact CB-CE1 3.87Å; Q825-F832 HydrophobicContact CB-CG 4.25Å; Q825-F832 HydrophobicContact CB-CZ 4.43Å; Q825-F832 HydrophobicContact CG-CD1 3.79Å; Q825-F832 HydrophobicContact CG-CE1 4.18Å; Q825-F832 HydrophobicContact CG-CG 4.47Å
826	A	79.9	Confident	80.1	Confident	85 Å²	85	65 Å²	65	70%	0.702	35%	0.351	S	S	*	.	H	α-helix	trans	-72.3	-25.8	177.2	0	0	0	0	0	113.9	T822 A823 L824	T822-A826 VanDerWaalsContact O-CB 3.29Å; T822-A826 WeakPolarHBondContact O-CB 3.05Å; T822-A826 PolarHBondContact O-N 2.92Å; A823-A826 PolarHBondContact O-N 2.9Å; L824-A826 VanDerWaalsContact C-N 3.3Å; L824-A826 PolarHBondContact O-N 3.4Å
827	I	84.1	Confident	80.3	Confident	108 Å²	108	68.3 Å²	68.3	55%	0.554	37%	0.366	S	S	*	.	H	α-helix	trans	-90.8	-43.1	-178.3	-74.7	167.2	0	0	0	112.1	A823 L824 F913	A823-I827 WeakPolarHBondContact O-CB 3.34Å; A823-I827 WeakPolarHBondContact O-CG1 3.01Å; A823-I827 PolarHBondContact O-N 3.31Å; L824-I827 PolarHBondContact O-N 3.27Å; I827-F913 HydrophobicContact CB-CE1 4.45Å; I827-F913 HydrophobicContact CD1-CE1 3.57Å; I827-F913 HydrophobicContact CD1-CZ 3.68Å; I827-F913 HydrophobicContact CG2-CE1 4.3Å
828	Y	86.4	Confident	80.2	Confident	47 Å²	47	71.7 Å²	71.7	18%	0.184	39%	0.391	C	S	.	.	H	α-helix	trans	-94.5	-15.5	-176.6	-61	-71.9	0	0	0	114.1	L824 D830 D831 I845 F913 V916	L824-Y828 HydrophobicContact CB-CD2 4.5Å; L824-Y828 HydrophobicContact CD2-CD2 4.28Å; L824-Y828 HydrophobicContact CD2-CE2 3.81Å; L824-Y828 WeakPolarHBondContact O-CD2 3.2Å; L824-Y828 PolarHBondContact O-N 2.89Å; Y828-D830 PolarHBondContact O-N 3.04Å; Y828-D831 PolarHBondContact O-N 2.85Å; Y828-D831 VanDerWaalsContact O-N 3.08Å; Y828-I845 HydrophobicContact CD1-CG2 3.95Å; Y828-I845 HydrophobicContact CD2-CD1 4.05Å; Y828-I845 HydrophobicContact CD2-CG2 4.07Å; Y828-I845 HydrophobicContact CE1-CG2 4.43Å; Y828-I845 HydrophobicContact CE2-CD1 4.15Å; Y828-I845 HydrophobicContact CG-CG2 3.77Å; Y828-F913 HydrophobicContact CE2-CD1 4.3Å; Y828-F913 AromaticContact CE2-CE1 3.94Å; Y828-F913 HydrophobicContact CE2-CE1 3.94Å; Y828-V916 HydrophobicContact CE1-CG1 3.87Å; Y828-V916 HydrophobicContact CE2-CG2 4.38Å; Y828-V916 VanDerWaalsContact OH-CG1 3.23Å; Y828-V916 WeakPolarHBondContact OH-CG1 3.33Å
829	G	84.9	Confident	80.2	Confident	39 Å²	39	74.6 Å²	74.6	40%	0.402	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	56.2	-118.7	169.5	0	0	0	0	0	113.9	Q825 D831 F832	Q825-G829 WeakPolarHBondContact O-CA 3.45Å; Q825-G829 PolarHBondContact O-N 2.68Å; Q825-G829 VanDerWaalsContact O-N 3.09Å; G829-D831 PolarHBondContact O-N 3.03Å; G829-F832 WeakPolarHBondContact O-CB 3.23Å; G829-F832 PolarHBondContact O-N 2.79Å; G829-F832 VanDerWaalsContact O-N 3.16Å
830	D	85.2	Confident	80.3	Confident	163 Å²	163	73.7 Å²	73.7	87%	0.872	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-66.6	-20.4	-178.5	-68.1	-31.4	0	0	0	113.8	Y828 F832	Y828-D830 PolarHBondContact O-N 3.04Å; D830-F832 VanDerWaalsContact C-N 3.32Å
831	D	89.1	Confident	80.5	Confident	57 Å²	57	72.9 Å²	72.9	31%	0.305	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-85.2	-4.8	176.2	-74.3	-48	0	0	0	112.9	Y828 G829 A846 R848	Y828-D831 PolarHBondContact O-N 2.85Å; Y828-D831 VanDerWaalsContact O-N 3.08Å; G829-D831 PolarHBondContact O-N 3.03Å; D831-A846 HydrophobicContact CB-CB 4.18Å; D831-A846 PolarHBondContact O-N 3.12Å; D831-R848 IonicContact OD1-CZ 3.02Å; D831-R848 IonicContact OD1-NH1 3.13Å; D831-R848 PolarHBondContact OD1-NH1 3.42Å; D831-R848 IonicContact OD1-NH2 2.85Å; D831-R848 IonicContact OD2-NH1 3.17Å
832	F	90.1	Very high	80.9	Confident	15 Å²	15	76.3 Å²	76.3	7%	0.066	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.7	173.7	-172.8	-90.2	0	0	0	111.7	V821 L824 Q825 G829 D830 M834 F843 I845	V821-F832 HydrophobicContact CG1-CZ 4.18Å; L824-F832 HydrophobicContact CB-CD2 4.07Å; L824-F832 HydrophobicContact CB-CE2 3.64Å; L824-F832 HydrophobicContact CB-CZ 4.43Å; L824-F832 HydrophobicContact CD1-CE2 4.46Å; Q825-F832 HydrophobicContact CB-CD1 3.78Å; Q825-F832 HydrophobicContact CB-CE1 3.87Å; Q825-F832 HydrophobicContact CB-CG 4.25Å; Q825-F832 HydrophobicContact CB-CZ 4.43Å; Q825-F832 HydrophobicContact CG-CD1 3.79Å; Q825-F832 HydrophobicContact CG-CE1 4.18Å; Q825-F832 HydrophobicContact CG-CG 4.47Å; G829-F832 WeakPolarHBondContact O-CB 3.23Å; G829-F832 PolarHBondContact O-N 2.79Å; G829-F832 VanDerWaalsContact O-N 3.16Å; D830-F832 VanDerWaalsContact C-N 3.32Å; F832-M834 HydrophobicContact CE1-CG 3.9Å; F832-M834 HydrophobicContact CE1-SD 3.61Å; F832-M834 HydrophobicContact CZ-SD 3.9Å; F832-F843 HydrophobicContact CD2-CD2 4.43Å; F832-F843 HydrophobicContact CE1-CB 4.16Å; F832-F843 HydrophobicContact CE2-CB 3.99Å; F832-F843 AromaticContact CE2-CD2 3.47Å; F832-F843 HydrophobicContact CE2-CD2 3.47Å; F832-F843 VanDerWaalsContact CE2-CD2 3.47Å; F832-F843 HydrophobicContact CE2-CE2 4.11Å; F832-F843 AromaticContact CE2-CG 3.79Å; F832-F843 HydrophobicContact CE2-CG 3.79Å; F832-F843 HydrophobicContact CZ-CB 3.56Å; F832-F843 HydrophobicContact CZ-CD1 4.3Å; F832-F843 AromaticContact CZ-CD2 3.84Å; F832-F843 HydrophobicContact CZ-CD2 3.84Å; F832-F843 AromaticContact CZ-CG 3.64Å; F832-F843 HydrophobicContact CZ-CG 3.64Å; F832-I845 HydrophobicContact CD2-CD1 4.37Å; F832-I845 HydrophobicContact CD2-CG1 3.96Å; F832-I845 HydrophobicContact CE2-CG1 4.32Å
833	R	89	Confident	81.5	Confident	169 Å²	169	72.1 Å²	72.1	64%	0.638	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.7	178.4	-62.5	-175.9	-176.3	171.9	4.8	111.7	F843 C844	R833-F843 CarbonylContact O-C 3.49Å; R833-F843 WeakPolarHBondContact O-CA 3.44Å; R833-F843 WeakPolarHBondContact O-CB 2.88Å; R833-C844 PolarHBondContact N-O 3.42Å; R833-C844 PolarHBondContact O-N 2.85Å
834	M	84.8	Confident	82.1	Confident	61 Å²	61	70.8 Å²	70.8	30%	0.3	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	129.9	166.6	-68.1	-63.3	-64.4	0	0	110.2	V821 F832 S836 A841 F843	V821-M834 HydrophobicContact CG1-CE 4.45Å; V821-M834 HydrophobicContact CG1-SD 3.86Å; F832-M834 HydrophobicContact CE1-CG 3.9Å; F832-M834 HydrophobicContact CE1-SD 3.61Å; F832-M834 HydrophobicContact CZ-SD 3.9Å; M834-S836 VanDerWaalsContact CE-O 3.28Å; M834-S836 WeakPolarHBondContact CE-O 3.08Å; M834-A841 HydrophobicContact CE-CB 4.44Å; M834-F843 HydrophobicContact SD-CB 3.9Å
835	E	84.3	Confident	82.6	Confident	133 Å²	133	70.8 Å²	70.8	62%	0.621	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	-35.5	165.6	-65.7	-159.6	134.5	0	0	111.6	K842	E835-K842 HydrophobicContact CB-CB 3.91Å; E835-K842 PolarHBondContact N-O 3.43Å
836	S	75.8	Confident	82.9	Confident	28 Å²	28	66.3 Å²	66.3	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	119.2	175.6	69.8	0	0	0	0	112.7	M834 S838 K842	M834-S836 VanDerWaalsContact CE-O 3.28Å; M834-S836 WeakPolarHBondContact CE-O 3.08Å; S836-S838 PolarHBondContact O-N 3.06Å; S836-K842 PolarHBondContact N-O 3.32Å; S836-K842 WeakPolarHBondContact OG-CB 3.44Å; S836-K842 WeakPolarHBondContact OG-CG 3.35Å
837	E	64.7	Low	83.5	Confident	172 Å²	172	62.5 Å²	62.5	80%	0.804	32%	0.318	S	S	*	.	S	Bend	trans	-69.1	-11.3	172.3	-60.3	179.7	169	0	0	113.2
838	S	65.1	Low	83.7	Confident	78 Å²	78	62.2 Å²	62.2	55%	0.545	31%	0.31	S	S	.	.	S	Bend	trans	-75.7	135.2	171.1	54.5	0	0	0	0	111.4	S836 P840	S836-S838 PolarHBondContact O-N 3.06Å; S838-P840 CarbonylContact O-C 3.5Å; S838-P840 VanDerWaalsContact O-O 3.14Å
839	Y	67.4	Low	83.7	Confident	88 Å²	88	61.9 Å²	61.9	35%	0.345	31%	0.31	S	S	.	.	S	Bend	trans	-78.9	145	172.3	-69.3	-92.8	0	0	0	111.4	Y812 Q817 A818 A841	Y812-Y839 HydrophobicContact CE1-CG 4.28Å; Q817-Y839 HydrophobicContact CB-CD1 4.43Å; Q817-Y839 HydrophobicContact CB-CE1 4.13Å; A818-Y839 WeakPolarHBondContact CA-OH 3.35Å; A818-Y839 HydrophobicContact CB-CE1 4.44Å; A818-Y839 VanDerWaalsContact CB-OH 3.26Å; A818-Y839 WeakPolarHBondContact CB-OH 3.33Å; Y839-A841 HydrophobicContact CD1-CB 4.24Å; Y839-A841 HydrophobicContact CE1-CB 4.15Å
840	P	70.7	Confident	83.1	Confident	46 Å²	46	66.3 Å²	66.3	30%	0.299	32%	0.32	S	S	.	.	S	Bend	cis	-68.6	135.8	-2.3	31	-36.1	0	0	0	111.9	S838 F868 E870	S838-P840 CarbonylContact O-C 3.5Å; S838-P840 VanDerWaalsContact O-O 3.14Å; P840-F868 HydrophobicContact CB-CB 4.08Å; P840-F868 WeakPolarHBondContact CB-O 3.45Å; P840-E870 HydrophobicContact CG-CG 4.37Å
841	A	78.4	Confident	82.2	Confident	1 Å²	1	60 Å²	60	1%	0.008	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-67.5	149.8	-165.6	0	0	0	0	0	112.8	V821 M834 Y839 F868	V821-A841 HydrophobicContact CG2-CB 4.18Å; M834-A841 HydrophobicContact CE-CB 4.44Å; Y839-A841 HydrophobicContact CD1-CB 4.24Å; Y839-A841 HydrophobicContact CE1-CB 4.15Å; A841-F868 HydrophobicContact CB-CD2 4.01Å; A841-F868 HydrophobicContact CB-CE2 4.44Å; A841-F868 PolarHBondContact O-N 3.43Å
842	K	89.2	Confident	80.7	Confident	80 Å²	80	59.6 Å²	59.6	35%	0.348	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.9	171.9	-61.3	-168.2	169.3	-143.5	0	111.1	E835 S836 V866 T867	E835-K842 HydrophobicContact CB-CB 3.91Å; E835-K842 PolarHBondContact N-O 3.43Å; S836-K842 PolarHBondContact N-O 3.32Å; S836-K842 WeakPolarHBondContact OG-CB 3.44Å; S836-K842 WeakPolarHBondContact OG-CG 3.35Å; K842-V866 WeakPolarHBondContact CA-O 3.4Å; K842-T867 HydrophobicContact CD-CG2 4.38Å; K842-T867 WeakPolarHBondContact CD-OG1 3.14Å; K842-T867 VanDerWaalsContact CE-OG1 3.3Å; K842-T867 WeakPolarHBondContact CE-OG1 3.48Å; K842-T867 HydrophobicContact CG-CG2 4.06Å; K842-T867 WeakPolarHBondContact CG-OG1 3.14Å; K842-T867 PolarHBondContact NZ-OG1 2.95Å
843	F	91.7	Very high	78.9	Confident	1 Å²	1	61 Å²	61	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	160.5	-179.9	57.9	-91.1	0	0	0	111.5	V821 L824 F832 R833 M834 I845 V866 F868 I912	V821-F843 HydrophobicContact CG2-CD1 4.07Å; V821-F843 HydrophobicContact CG2-CE1 3.83Å; L824-F843 HydrophobicContact CD1-CE2 3.8Å; L824-F843 HydrophobicContact CD1-CZ 3.73Å; F832-F843 HydrophobicContact CD2-CD2 4.43Å; F832-F843 HydrophobicContact CE1-CB 4.16Å; F832-F843 HydrophobicContact CE2-CB 3.99Å; F832-F843 AromaticContact CE2-CD2 3.47Å; F832-F843 HydrophobicContact CE2-CD2 3.47Å; F832-F843 VanDerWaalsContact CE2-CD2 3.47Å; F832-F843 HydrophobicContact CE2-CE2 4.11Å; F832-F843 AromaticContact CE2-CG 3.79Å; F832-F843 HydrophobicContact CE2-CG 3.79Å; F832-F843 HydrophobicContact CZ-CB 3.56Å; F832-F843 HydrophobicContact CZ-CD1 4.3Å; F832-F843 AromaticContact CZ-CD2 3.84Å; F832-F843 HydrophobicContact CZ-CD2 3.84Å; F832-F843 AromaticContact CZ-CG 3.64Å; F832-F843 HydrophobicContact CZ-CG 3.64Å; R833-F843 CarbonylContact O-C 3.49Å; R833-F843 WeakPolarHBondContact O-CA 3.44Å; R833-F843 WeakPolarHBondContact O-CB 2.88Å; M834-F843 HydrophobicContact SD-CB 3.9Å; F843-I845 HydrophobicContact CD2-CG1 4.22Å; F843-I845 HydrophobicContact CE2-CD1 4.25Å; F843-I845 HydrophobicContact CE2-CG1 4.43Å; F843-V866 HydrophobicContact CD2-CB 4.27Å; F843-V866 HydrophobicContact CE1-CB 4.29Å; F843-V866 HydrophobicContact CE1-CG1 4.3Å; F843-V866 HydrophobicContact CE2-CB 3.75Å; F843-V866 HydrophobicContact CE2-CG1 4.32Å; F843-V866 HydrophobicContact CE2-CG2 3.9Å; F843-V866 HydrophobicContact CZ-CB 3.76Å; F843-V866 HydrophobicContact CZ-CG1 3.85Å; F843-V866 HydrophobicContact CZ-CG2 4.25Å; F843-V866 PolarHBondContact N-O 2.71Å; F843-V866 PolarHBondContact O-N 3.44Å; F843-F868 HydrophobicContact CE1-CD1 4.31Å; F843-F868 AromaticContact CE1-CE1 3.79Å; F843-F868 HydrophobicContact CE1-CE1 3.79Å; F843-F868 HydrophobicContact CE1-CE2 4.11Å; F843-F868 AromaticContact CE1-CZ 3.68Å; F843-F868 HydrophobicContact CE1-CZ 3.68Å; F843-F868 AromaticContact CZ-CE1 3.85Å; F843-F868 HydrophobicContact CZ-CE1 3.85Å; F843-F868 AromaticContact CZ-CZ 3.94Å; F843-F868 HydrophobicContact CZ-CZ 3.94Å; F843-I912 HydrophobicContact CE2-CG2 4.08Å; F843-I912 HydrophobicContact CZ-CG1 4.3Å; F843-I912 HydrophobicContact CZ-CG2 4.31Å
844	C	94	Very high	77.1	Confident	11 Å²	11	59.1 Å²	59.1	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.1	175.1	-60.7	0	0	0	0	110.4	R833 T863 L864 C865	R833-C844 PolarHBondContact N-O 3.42Å; R833-C844 PolarHBondContact O-N 2.85Å; C844-T863 HydrophobicContact CB-CG2 3.69Å; C844-L864 CarbonylContact C-O 3.56Å; C844-L864 VanDerWaalsContact CA-O 3.28Å; C844-L864 WeakPolarHBondContact CA-O 3.4Å; C844-C865 HydrophobicContact CB-CB 4.13Å; C844-C865 WeakPolarHBondContact CB-SG 3.23Å; C844-C865 WeakPolarHBondContact SG-CB 3.29Å; C844-C865 CovalentContact SG-SG 2.05Å; C844-C865 PolarHBondContact SG-SG 3Å
845	I	94	Very high	75.7	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.3	177.7	-49.1	-178.2	0	0	0	107.9	L824 Y828 F832 F843 L847 T863 L864 I912 V916	L824-I845 HydrophobicContact CD2-CD1 4.15Å; Y828-I845 HydrophobicContact CD1-CG2 3.95Å; Y828-I845 HydrophobicContact CD2-CD1 4.05Å; Y828-I845 HydrophobicContact CD2-CG2 4.07Å; Y828-I845 HydrophobicContact CE1-CG2 4.43Å; Y828-I845 HydrophobicContact CE2-CD1 4.15Å; Y828-I845 HydrophobicContact CG-CG2 3.77Å; F832-I845 HydrophobicContact CD2-CD1 4.37Å; F832-I845 HydrophobicContact CD2-CG1 3.96Å; F832-I845 HydrophobicContact CE2-CG1 4.32Å; F843-I845 HydrophobicContact CD2-CG1 4.22Å; F843-I845 HydrophobicContact CE2-CD1 4.25Å; F843-I845 HydrophobicContact CE2-CG1 4.43Å; I845-L847 HydrophobicContact CG2-CD2 3.78Å; I845-L847 HydrophobicContact CG2-CG 4.39Å; I845-T863 CarbonylContact O-C 3.47Å; I845-T863 WeakPolarHBondContact O-CA 3.36Å; I845-L864 PolarHBondContact N-O 2.97Å; I845-L864 PolarHBondContact O-N 3.32Å; I845-I912 HydrophobicContact CD1-CG2 4.1Å; I845-V916 HydrophobicContact CD1-CG2 3.83Å
846	A	93.1	Very high	74.8	Confident	10 Å²	10	61.3 Å²	61.3	8%	0.083	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	123.1	175	0	0	0	0	0	110.4	D831	D831-A846 HydrophobicContact CB-CB 4.18Å; D831-A846 PolarHBondContact O-N 3.12Å
847	L	92	Very high	74.4	Confident	6 Å²	6	64.1 Å²	64.1	3%	0.031	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.7	-178	-56.7	175.8	0	0	0	108.7	I845 E861 C862 L864 V916 V919 Q920 L923	I845-L847 HydrophobicContact CG2-CD2 3.78Å; I845-L847 HydrophobicContact CG2-CG 4.39Å; L847-E861 WeakPolarHBondContact O-CA 3.46Å; L847-C862 WeakPolarHBondContact CB-O 3.39Å; L847-C862 PolarHBondContact N-O 2.92Å; L847-C862 PolarHBondContact O-N 3.39Å; L847-L864 HydrophobicContact CD1-CB 4.31Å; L847-V916 HydrophobicContact CD1-CB 4.42Å; L847-V916 HydrophobicContact CD1-CG1 3.96Å; L847-V916 HydrophobicContact CD1-CG2 4.4Å; L847-V916 HydrophobicContact CD2-CG1 3.54Å; L847-V916 HydrophobicContact CG-CG1 4.42Å; L847-V919 HydrophobicContact CD1-CB 3.84Å; L847-V919 HydrophobicContact CD1-CG1 3.66Å; L847-Q920 HydrophobicContact CB-CG 4.41Å; L847-Q920 HydrophobicContact CD1-CG 4.26Å; L847-Q920 HydrophobicContact CD2-CG 4.13Å; L847-Q920 HydrophobicContact CG-CG 4.5Å; L847-L923 HydrophobicContact CB-CD1 3.65Å
848	R	88.4	Confident	74.7	Confident	102 Å²	102	56.4 Å²	56.4	39%	0.385	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.6	-174.3	-61.2	-170.6	-172.4	89.5	23.3	111.5	D831 V860 E861	D831-R848 IonicContact OD1-CZ 3.02Å; D831-R848 IonicContact OD1-NH1 3.13Å; D831-R848 PolarHBondContact OD1-NH1 3.42Å; D831-R848 IonicContact OD1-NH2 2.85Å; D831-R848 IonicContact OD2-NH1 3.17Å; R848-V860 WeakPolarHBondContact CA-O 3.33Å; R848-E861 HydrophobicContact CG-CB 4.09Å; R848-E861 HydrophobicContact CG-CG 3.84Å; R848-E861 IonicContact CZ-OE1 3.03Å; R848-E861 VanDerWaalsContact CZ-OE1 3.25Å; R848-E861 IonicContact CZ-OE2 2.66Å; R848-E861 IonicContact NE-OE1 3.23Å; R848-E861 PolarHBondContact NE-OE1 3Å; R848-E861 IonicContact NE-OE2 3.36Å; R848-E861 PolarHBondContact NE-OE2 3.06Å; R848-E861 IonicContact NH2-OE1 2.74Å; R848-E861 PolarHBondContact NH2-OE1 2.92Å; R848-E861 IonicContact NH2-OE2 3.77Å
849	E	85.2	Confident	75.3	Confident	40 Å²	40	56.2 Å²	56.2	19%	0.187	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.3	166.8	-70	-59	147.8	0	0	110	N859 V860 L923 L924 A927	E849-N859 WeakPolarHBondContact O-CA 3.33Å; E849-V860 PolarHBondContact N-O 3.48Å; E849-V860 PolarHBondContact O-N 3.01Å; E849-L923 HydrophobicContact CB-CB 4.47Å; E849-L923 HydrophobicContact CG-CB 3.87Å; E849-L924 HydrophobicContact CG-CB 4.19Å; E849-A927 HydrophobicContact CB-CB 4.42Å
850	E	73	Confident	76.2	Confident	131 Å²	131	52 Å²	52	61%	0.612	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	106.4	178.3	-66.9	-161.3	144.1	0	0	110.5	G852 N859	E850-G852 PolarHBondContact O-N 3.47Å; E850-N859 PolarHBondContact OE1-ND2 3.06Å
851	L	66.6	Low	77.1	Confident	31 Å²	31	52.9 Å²	52.9	16%	0.162	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	70	-175	-100.6	156.7	0	0	0	111.8	I858 A927 E928	L851-I858 PolarHBondContact N-O 3.35Å; L851-A927 HydrophobicContact CD1-CB 3.44Å; L851-A927 VanDerWaalsContact CD1-CB 3.44Å; L851-E928 HydrophobicContact CD1-CG 4.38Å
852	G	56.4	Low	77.7	Confident	49 Å²	49	52.9 Å²	52.9	51%	0.505	29%	0.287	S	S	.	.			trans	-83.2	133.9	177.5	0	0	0	0	0	114.7	E850	E850-G852 PolarHBondContact O-N 3.47Å
853	D	54	Low	78	Confident	45 Å²	45	50.8 Å²	50.8	24%	0.241	28%	0.281	C	S	.	.	S	Bend	trans	-158.8	73.9	173.7	-164.6	1.8	0	0	0	107.2	G855 R931 I1170	D853-G855 PolarHBondContact O-N 3.06Å; D853-R931 IonicContact OD2-CZ 3.89Å; D853-R931 IonicContact OD2-NE 3.04Å; D853-R931 IonicContact OD2-NH2 3.54Å; D853-R931 PolarHBondContact OD2-NH2 2.79Å; D853-I1170 VanDerWaalsContact OD1-CG1 3.25Å; D853-I1170 WeakPolarHBondContact OD1-CG1 3.38Å
854	D	50.3	Low	78.1	Confident	129 Å²	129	50.7 Å²	50.7	69%	0.69	28%	0.281	S	S	*	.	S	Bend	trans	54.5	30.2	172.1	-59.7	-22	0	0	0	119.7
855	G	55.7	Low	78.1	Confident	58 Å²	58	51 Å²	51	60%	0.598	28%	0.282	S	S	*	.	S	Bend	trans	-177	107.8	165.1	0	0	0	0	0	115.1	D853	D853-G855 PolarHBondContact O-N 3.06Å
856	K	64.4	Low	78	Confident	181 Å²	181	51 Å²	51	79%	0.787	28%	0.283	S	S	*	.	S	Bend	trans	48.1	98.4	-173.3	-77.9	-172.2	176.3	-177.9	0	113.4	I858	K856-I858 PolarHBondContact O-N 2.91Å
857	P	66.9	Low	77.8	Confident	88 Å²	88	52 Å²	52	57%	0.571	29%	0.288	S	S	*	.			trans	-59.9	137	179.1	28.9	-35.5	0	0	0	110.6	N859	P857-N859 PolarHBondContact O-N 3.26Å
858	I	72.9	Confident	77.6	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.051	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	108.6	168.9	-63.7	158.9	0	0	0	106.4	L851 K856 V860 K930 R931 Q934	L851-I858 PolarHBondContact N-O 3.35Å; K856-I858 PolarHBondContact O-N 2.91Å; I858-V860 HydrophobicContact CG2-CG2 3.97Å; I858-K930 HydrophobicContact CD1-CB 3.91Å; I858-K930 HydrophobicContact CG1-CB 4.5Å; I858-K930 HydrophobicContact CG2-CB 3.93Å; I858-K930 HydrophobicContact CG2-CD 3.93Å; I858-R931 VanDerWaalsContact CD1-CA 3.42Å; I858-R931 HydrophobicContact CD1-CB 3.68Å; I858-R931 HydrophobicContact CD1-CG 4.25Å; I858-R931 VanDerWaalsContact CD1-N 3.31Å; I858-Q934 HydrophobicContact CD1-CG 4.37Å
859	N	77.1	Confident	77.3	Confident	73 Å²	73	47.5 Å²	47.5	39%	0.39	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.6	171.8	-69.8	28.3	0	0	0	108	E849 E850 P857	E849-N859 WeakPolarHBondContact O-CA 3.33Å; E850-N859 PolarHBondContact OE1-ND2 3.06Å; P857-N859 PolarHBondContact O-N 3.26Å
860	V	85.9	Confident	76.6	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.5	170	-163.2	0	0	0	0	107.8	R848 E849 I858 V887 L923 I926 A927 K930	R848-V860 WeakPolarHBondContact CA-O 3.33Å; E849-V860 PolarHBondContact N-O 3.48Å; E849-V860 PolarHBondContact O-N 3.01Å; I858-V860 HydrophobicContact CG2-CG2 3.97Å; V860-V887 HydrophobicContact CG1-CG2 3.59Å; V860-L923 HydrophobicContact CB-CD2 4.01Å; V860-L923 HydrophobicContact CG1-CD2 3.54Å; V860-I926 HydrophobicContact CG1-CG2 4.18Å; V860-I926 HydrophobicContact CG2-CG2 4.39Å; V860-A927 HydrophobicContact CG2-CB 3.76Å; V860-K930 HydrophobicContact CG2-CD 4.43Å
861	E	89	Confident	76.3	Confident	64 Å²	64	53 Å²	53	30%	0.299	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.5	-177.8	179.6	161.8	-169.9	0	0	111.2	L847 R848 S884	L847-E861 WeakPolarHBondContact O-CA 3.46Å; R848-E861 HydrophobicContact CG-CB 4.09Å; R848-E861 HydrophobicContact CG-CG 3.84Å; R848-E861 IonicContact CZ-OE1 3.03Å; R848-E861 VanDerWaalsContact CZ-OE1 3.25Å; R848-E861 IonicContact CZ-OE2 2.66Å; R848-E861 IonicContact NE-OE1 3.23Å; R848-E861 PolarHBondContact NE-OE1 3Å; R848-E861 IonicContact NE-OE2 3.36Å; R848-E861 PolarHBondContact NE-OE2 3.06Å; R848-E861 IonicContact NH2-OE1 2.74Å; R848-E861 PolarHBondContact NH2-OE1 2.92Å; R848-E861 IonicContact NH2-OE2 3.77Å; E861-S884 PolarHBondContact N-OG 2.88Å; E861-S884 WeakPolarHBondContact O-CB 3.23Å; E861-S884 PolarHBondContact O-N 3.21Å; E861-S884 PolarHBondContact O-OG 3.05Å
862	C	92.7	Very high	76.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	137.1	167.5	-177.7	0	0	0	0	108.8	L847 H882 W883 V919 L923	L847-C862 WeakPolarHBondContact CB-O 3.39Å; L847-C862 PolarHBondContact N-O 2.92Å; L847-C862 PolarHBondContact O-N 3.39Å; C862-H882 CarbonylContact C-O 3.59Å; C862-H882 WeakPolarHBondContact CA-O 3.11Å; C862-W883 HydrophobicContact CB-CD2 4.02Å; C862-W883 HydrophobicContact CB-CE3 3.62Å; C862-W883 HydrophobicContact CB-CH2 4.21Å; C862-W883 HydrophobicContact CB-CZ3 3.74Å; C862-V919 HydrophobicContact CB-CG1 4.08Å; C862-L923 HydrophobicContact CB-CD1 4.1Å; C862-L923 HydrophobicContact CB-CD2 4.03Å; C862-L923 HydrophobicContact CB-CG 4.33Å
863	T	93.7	Very high	77.4	Confident	36 Å²	36	50 Å²	50	22%	0.221	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	115.7	170	-57.7	0	0	0	0	109.7	C844 I845 H882	C844-T863 HydrophobicContact CB-CG2 3.69Å; I845-T863 CarbonylContact O-C 3.47Å; I845-T863 WeakPolarHBondContact O-CA 3.36Å; T863-H882 PolarHBondContact N-O 3.38Å; T863-H882 PolarHBondContact O-N 2.98Å
864	L	94.3	Very high	78.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	105.7	173.9	173	67.7	0	0	0	108.7	C844 I845 L847 V866 V879 L881 L915 V916	C844-L864 CarbonylContact C-O 3.56Å; C844-L864 VanDerWaalsContact CA-O 3.28Å; C844-L864 WeakPolarHBondContact CA-O 3.4Å; I845-L864 PolarHBondContact N-O 2.97Å; I845-L864 PolarHBondContact O-N 3.32Å; L847-L864 HydrophobicContact CD1-CB 4.31Å; L864-V866 HydrophobicContact CD1-CG2 4.44Å; L864-V866 HydrophobicContact CG-CG2 4.11Å; L864-V879 HydrophobicContact CD1-CG1 3.44Å; L864-V879 VanDerWaalsContact CD1-CG1 3.44Å; L864-L881 HydrophobicContact CB-CD2 4.4Å; L864-L881 HydrophobicContact CD1-CD2 3.53Å; L864-L915 HydrophobicContact CD2-CB 4.12Å; L864-V916 HydrophobicContact CD2-CG2 3.64Å
865	C	94.4	Very high	79.5	Confident	16 Å²	16	50.9 Å²	50.9	11%	0.108	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.7	176.5	-72.3	0	0	0	0	110.9	C844 V879 S880	C844-C865 HydrophobicContact CB-CB 4.13Å; C844-C865 WeakPolarHBondContact CB-SG 3.23Å; C844-C865 WeakPolarHBondContact SG-CB 3.29Å; C844-C865 CovalentContact SG-SG 2.05Å; C844-C865 PolarHBondContact SG-SG 3Å; C865-V879 CarbonylContact O-C 3.59Å; C865-V879 WeakPolarHBondContact O-CA 3.16Å; C865-S880 WeakPolarHBondContact CB-OG 3.36Å; C865-S880 PolarHBondContact N-O 2.86Å; C865-S880 PolarHBondContact O-N 3.05Å
866	V	91.9	Very high	80.8	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.2	-172.4	-175.4	0	0	0	0	109.5	K842 F843 L864 F868 A877 V879 I912	K842-V866 WeakPolarHBondContact CA-O 3.4Å; F843-V866 HydrophobicContact CD2-CB 4.27Å; F843-V866 HydrophobicContact CE1-CB 4.29Å; F843-V866 HydrophobicContact CE1-CG1 4.3Å; F843-V866 HydrophobicContact CE2-CB 3.75Å; F843-V866 HydrophobicContact CE2-CG1 4.32Å; F843-V866 HydrophobicContact CE2-CG2 3.9Å; F843-V866 HydrophobicContact CZ-CB 3.76Å; F843-V866 HydrophobicContact CZ-CG1 3.85Å; F843-V866 HydrophobicContact CZ-CG2 4.25Å; F843-V866 PolarHBondContact N-O 2.71Å; F843-V866 PolarHBondContact O-N 3.44Å; L864-V866 HydrophobicContact CD1-CG2 4.44Å; L864-V866 HydrophobicContact CG-CG2 4.11Å; V866-F868 HydrophobicContact CG1-CD1 3.95Å; V866-F868 HydrophobicContact CG1-CE1 4.05Å; V866-A877 HydrophobicContact CG1-CB 4.02Å; V866-V879 HydrophobicContact CG1-CG2 4.38Å; V866-V879 HydrophobicContact CG2-CG2 4.33Å; V866-I912 HydrophobicContact CG1-CD1 3.78Å; V866-I912 HydrophobicContact CG2-CD1 4.24Å
867	T	90.2	Very high	81.9	Confident	32 Å²	32	43 Å²	43	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	114.8	165.4	-70	0	0	0	0	107.9	K842 K878	K842-T867 HydrophobicContact CD-CG2 4.38Å; K842-T867 WeakPolarHBondContact CD-OG1 3.14Å; K842-T867 VanDerWaalsContact CE-OG1 3.3Å; K842-T867 WeakPolarHBondContact CE-OG1 3.48Å; K842-T867 HydrophobicContact CG-CG2 4.06Å; K842-T867 WeakPolarHBondContact CG-OG1 3.14Å; K842-T867 PolarHBondContact NZ-OG1 2.95Å; T867-K878 PolarHBondContact N-O 3.2Å; T867-K878 PolarHBondContact O-N 3.06Å
868	F	86.7	Confident	83	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.013	22%	0.218	C	C	.	.			trans	-63.4	153.7	171.8	-70.4	-18	0	0	0	111.2	Q817 V821 P840 A841 F843 V866 Y872 A877 I912	Q817-F868 HydrophobicContact CB-CD2 4.09Å; Q817-F868 HydrophobicContact CB-CE2 3.92Å; Q817-F868 HydrophobicContact CG-CD2 4.05Å; Q817-F868 HydrophobicContact CG-CE2 4.18Å; V821-F868 HydrophobicContact CG2-CE2 3.78Å; V821-F868 HydrophobicContact CG2-CZ 4.19Å; P840-F868 HydrophobicContact CB-CB 4.08Å; P840-F868 WeakPolarHBondContact CB-O 3.45Å; A841-F868 HydrophobicContact CB-CD2 4.01Å; A841-F868 HydrophobicContact CB-CE2 4.44Å; A841-F868 PolarHBondContact O-N 3.43Å; F843-F868 HydrophobicContact CE1-CD1 4.31Å; F843-F868 AromaticContact CE1-CE1 3.79Å; F843-F868 HydrophobicContact CE1-CE1 3.79Å; F843-F868 HydrophobicContact CE1-CE2 4.11Å; F843-F868 AromaticContact CE1-CZ 3.68Å; F843-F868 HydrophobicContact CE1-CZ 3.68Å; F843-F868 AromaticContact CZ-CE1 3.85Å; F843-F868 HydrophobicContact CZ-CE1 3.85Å; F843-F868 AromaticContact CZ-CZ 3.94Å; F843-F868 HydrophobicContact CZ-CZ 3.94Å; V866-F868 HydrophobicContact CG1-CD1 3.95Å; V866-F868 HydrophobicContact CG1-CE1 4.05Å; F868-Y872 HydrophobicContact CB-CD1 4.45Å; F868-Y872 HydrophobicContact CB-CG 4.43Å; F868-Y872 AromaticContact CD1-CD1 3.59Å; F868-Y872 HydrophobicContact CD1-CD1 3.59Å; F868-Y872 HydrophobicContact CD1-CD2 4.28Å; F868-Y872 AromaticContact CD1-CE1 3.8Å; F868-Y872 HydrophobicContact CD1-CE1 3.8Å; F868-Y872 HydrophobicContact CD1-CE2 4.45Å; F868-Y872 AromaticContact CD1-CG 3.86Å; F868-Y872 HydrophobicContact CD1-CG 3.86Å; F868-Y872 HydrophobicContact CD2-CD1 4.04Å; F868-Y872 HydrophobicContact CD2-CE1 4.47Å; F868-Y872 AromaticContact CE1-CD1 3.66Å; F868-Y872 HydrophobicContact CE1-CD1 3.66Å; F868-Y872 AromaticContact CE1-CE1 3.35Å; F868-Y872 HydrophobicContact CE1-CE1 3.35Å; F868-Y872 HydrophobicContact CE1-CE2 4.31Å; F868-Y872 HydrophobicContact CE1-CG 4.27Å; F868-Y872 AromaticContact CE1-CZ 3.71Å; F868-Y872 HydrophobicContact CE2-CD1 4.11Å; F868-Y872 HydrophobicContact CE2-CE1 4.09Å; F868-Y872 AromaticContact CG-CD1 3.79Å; F868-Y872 HydrophobicContact CG-CD1 3.79Å; F868-Y872 HydrophobicContact CG-CE1 4.34Å; F868-Y872 HydrophobicContact CG-CG 4.15Å; F868-Y872 AromaticContact CZ-CD1 3.92Å; F868-Y872 HydrophobicContact CZ-CD1 3.92Å; F868-Y872 AromaticContact CZ-CE1 3.52Å; F868-Y872 HydrophobicContact CZ-CE1 3.52Å; F868-A877 HydrophobicContact CD1-CB 4.24Å; F868-I912 HydrophobicContact CE1-CD1 4.17Å; F868-I912 HydrophobicContact CE1-CG1 4.04Å
869	T	81.5	Confident	83.9	Confident	10 Å²	10	47.3 Å²	47.3	6%	0.061	23%	0.228	C	C	.	.			trans	-91.6	164.2	164.9	48.8	0	0	0	0	109.8	Q817 R871 Y872 E875 L876	Q817-T869 PolarHBondContact NE2-O 3.42Å; T869-R871 PolarHBondContact O-N 3.08Å; T869-R871 VanDerWaalsContact O-N 3.13Å; T869-Y872 PolarHBondContact O-N 2.9Å; T869-Y872 WeakPolarHBondContact OG1-CB 3.48Å; T869-Y872 PolarHBondContact OG1-N 2.92Å; T869-E875 HydrophobicContact CG2-CG 4.13Å; T869-E875 WeakPolarHBondContact CG2-OE1 3.31Å; T869-E875 PolarHBondContact OG1-O 2.83Å; T869-L876 WeakPolarHBondContact CG2-O 3.29Å; T869-L876 PolarHBondContact OG1-O 3.12Å
870	E	71.6	Confident	84.6	Confident	119 Å²	119	46.3 Å²	46.3	56%	0.556	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.3	178.2	-63.8	-169.9	-169.6	0	0	113.2	Q808 P840	Q808-E870 PolarHBondContact NE2-OE2 2.92Å; P840-E870 HydrophobicContact CG-CG 4.37Å
871	R	66.8	Low	84.9	Confident	166 Å²	166	47.8 Å²	47.8	63%	0.626	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.8	12.3	178.3	-51.7	179.4	-179.7	-152.7	2.6	113.5	T869 Q874 E875	T869-R871 PolarHBondContact O-N 3.08Å; T869-R871 VanDerWaalsContact O-N 3.13Å; R871-Q874 CarbonylContact O-C 3.55Å; R871-Q874 VanDerWaalsContact O-CA 3.3Å; R871-Q874 WeakPolarHBondContact O-CA 3.4Å; R871-Q874 WeakPolarHBondContact O-CB 3.3Å; R871-Q874 PolarHBondContact O-N 3.17Å; R871-Q874 PolarHBondContact O-OE1 3.32Å; R871-E875 HydrophobicContact CB-CB 3.72Å; R871-E875 WeakPolarHBondContact CD-OE2 3.41Å; R871-E875 PolarHBondContact O-N 3.23Å
872	Y	72.5	Confident	85.1	Confident	5 Å²	5	50 Å²	50	2%	0.02	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	130.9	174.2	172	-89.4	0	0	0	109.7	Q817 E820 F868 T869 E875 A877 V911	Q817-Y872 HydrophobicContact CG-CD1 4.26Å; Q817-Y872 PolarHBondContact NE2-O 2.99Å; E820-Y872 PolarHBondContact OE1-OH 3.4Å; E820-Y872 WeakPolarHBondContact OE2-CE1 3.45Å; E820-Y872 PolarHBondContact OE2-OH 2.96Å; F868-Y872 HydrophobicContact CB-CD1 4.45Å; F868-Y872 HydrophobicContact CB-CG 4.43Å; F868-Y872 AromaticContact CD1-CD1 3.59Å; F868-Y872 HydrophobicContact CD1-CD1 3.59Å; F868-Y872 HydrophobicContact CD1-CD2 4.28Å; F868-Y872 AromaticContact CD1-CE1 3.8Å; F868-Y872 HydrophobicContact CD1-CE1 3.8Å; F868-Y872 HydrophobicContact CD1-CE2 4.45Å; F868-Y872 AromaticContact CD1-CG 3.86Å; F868-Y872 HydrophobicContact CD1-CG 3.86Å; F868-Y872 HydrophobicContact CD2-CD1 4.04Å; F868-Y872 HydrophobicContact CD2-CE1 4.47Å; F868-Y872 AromaticContact CE1-CD1 3.66Å; F868-Y872 HydrophobicContact CE1-CD1 3.66Å; F868-Y872 AromaticContact CE1-CE1 3.35Å; F868-Y872 HydrophobicContact CE1-CE1 3.35Å; F868-Y872 HydrophobicContact CE1-CE2 4.31Å; F868-Y872 HydrophobicContact CE1-CG 4.27Å; F868-Y872 AromaticContact CE1-CZ 3.71Å; F868-Y872 HydrophobicContact CE2-CD1 4.11Å; F868-Y872 HydrophobicContact CE2-CE1 4.09Å; F868-Y872 AromaticContact CG-CD1 3.79Å; F868-Y872 HydrophobicContact CG-CD1 3.79Å; F868-Y872 HydrophobicContact CG-CE1 4.34Å; F868-Y872 HydrophobicContact CG-CG 4.15Å; F868-Y872 AromaticContact CZ-CD1 3.92Å; F868-Y872 HydrophobicContact CZ-CD1 3.92Å; F868-Y872 AromaticContact CZ-CE1 3.52Å; F868-Y872 HydrophobicContact CZ-CE1 3.52Å; T869-Y872 PolarHBondContact O-N 2.9Å; T869-Y872 WeakPolarHBondContact OG1-CB 3.48Å; T869-Y872 PolarHBondContact OG1-N 2.92Å; Y872-E875 WeakPolarHBondContact CA-O 3.31Å; Y872-A877 HydrophobicContact CD2-CB 3.83Å; Y872-A877 HydrophobicContact CE2-CB 4.16Å; Y872-V911 HydrophobicContact CE2-CG2 4.15Å; Y872-V911 PolarHBondContact OH-N 2.95Å
873	P	73.2	Confident	84.9	Confident	12 Å²	12	51.8 Å²	51.8	8%	0.078	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	cis	-91.9	0	14.9	35.1	-37.4	0	0	0	117.3	E875 G908 S909	P873-E875 VanDerWaalsContact C-N 3.25Å; P873-E875 PolarHBondContact O-N 3.33Å; P873-G908 WeakPolarHBondContact O-CA 3.21Å; P873-G908 PolarHBondContact O-N 3.11Å; P873-S909 VanDerWaalsContact CB-O 3.22Å; P873-S909 WeakPolarHBondContact CB-O 3.14Å
874	Q	70.4	Confident	84.4	Confident	114 Å²	114	51.7 Å²	51.7	53%	0.533	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.2	178.4	-55.2	84.6	30.4	0	0	114.1	R871	R871-Q874 CarbonylContact O-C 3.55Å; R871-Q874 VanDerWaalsContact O-CA 3.3Å; R871-Q874 WeakPolarHBondContact O-CA 3.4Å; R871-Q874 WeakPolarHBondContact O-CB 3.3Å; R871-Q874 PolarHBondContact O-N 3.17Å; R871-Q874 PolarHBondContact O-OE1 3.32Å
875	E	77.7	Confident	83.6	Confident	80 Å²	80	60.5 Å²	60.5	37%	0.374	29%	0.293	S	S	.	.	S	Bend	trans	-128.8	139.4	171	-178.2	-173.8	156.3	0	0	108.2	T869 R871 Y872 P873 A877	T869-E875 HydrophobicContact CG2-CG 4.13Å; T869-E875 WeakPolarHBondContact CG2-OE1 3.31Å; T869-E875 PolarHBondContact OG1-O 2.83Å; R871-E875 HydrophobicContact CB-CB 3.72Å; R871-E875 WeakPolarHBondContact CD-OE2 3.41Å; R871-E875 PolarHBondContact O-N 3.23Å; Y872-E875 WeakPolarHBondContact CA-O 3.31Å; P873-E875 VanDerWaalsContact C-N 3.25Å; P873-E875 PolarHBondContact O-N 3.33Å; E875-A877 PolarHBondContact O-N 3.36Å
876	L	83.8	Confident	82.6	Confident	65 Å²	65	65.8 Å²	65.8	34%	0.34	32%	0.321	S	S	.	.			trans	-54.3	134.7	-179	-62.6	168.9	0	0	0	111.2	T869 M903 E904 L907	T869-L876 WeakPolarHBondContact CG2-O 3.29Å; T869-L876 PolarHBondContact OG1-O 3.12Å; L876-M903 HydrophobicContact CB-CE 4.36Å; L876-M903 HydrophobicContact CD2-CB 3.77Å; L876-M903 HydrophobicContact CD2-CE 4.48Å; L876-E904 HydrophobicContact CD1-CG 3.91Å; L876-E904 HydrophobicContact CD2-CG 4Å; L876-L907 HydrophobicContact CD2-CD1 3.86Å; L876-L907 HydrophobicContact CG-CD1 4.06Å
877	A	87.6	Confident	82.1	Confident	8 Å²	8	66 Å²	66	7%	0.066	32%	0.322	C	S	.	.			trans	-68.4	157.4	168.2	0	0	0	0	0	110.5	V866 F868 Y872 E875 V879 M903	V866-A877 HydrophobicContact CG1-CB 4.02Å; F868-A877 HydrophobicContact CD1-CB 4.24Å; Y872-A877 HydrophobicContact CD2-CB 3.83Å; Y872-A877 HydrophobicContact CE2-CB 4.16Å; E875-A877 PolarHBondContact O-N 3.36Å; A877-V879 HydrophobicContact CB-CG2 4.42Å; A877-M903 HydrophobicContact CB-CE 3.84Å; A877-M903 WeakPolarHBondContact O-CE 3.49Å
878	K	90.1	Very high	81.9	Confident	146 Å²	146	67.2 Å²	67.2	64%	0.635	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	111.6	174.2	-64.1	-179.3	-177.5	-178.9	0	108.4	T867	T867-K878 PolarHBondContact N-O 3.2Å; T867-K878 PolarHBondContact O-N 3.06Å
879	V	91.8	Very high	81.9	Confident	42 Å²	42	74.2 Å²	74.2	26%	0.255	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	144.7	-172.7	177.7	0	0	0	0	110.8	L864 C865 V866 A877 V899 M903 L915	L864-V879 HydrophobicContact CD1-CG1 3.44Å; L864-V879 VanDerWaalsContact CD1-CG1 3.44Å; C865-V879 CarbonylContact O-C 3.59Å; C865-V879 WeakPolarHBondContact O-CA 3.16Å; V866-V879 HydrophobicContact CG1-CG2 4.38Å; V866-V879 HydrophobicContact CG2-CG2 4.33Å; A877-V879 HydrophobicContact CB-CG2 4.42Å; V879-V899 HydrophobicContact CG1-CG1 3.95Å; V879-M903 HydrophobicContact CB-SD 4.18Å; V879-M903 HydrophobicContact CG2-CE 3.82Å; V879-M903 HydrophobicContact CG2-SD 3.56Å; V879-M903 VanDerWaalsContact CG2-SD 3.56Å; V879-L915 HydrophobicContact CG2-CD1 4.12Å
880	S	91.4	Very high	82.1	Confident	52 Å²	52	79.9 Å²	79.9	36%	0.364	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	143.2	174.2	58.2	0	0	0	0	111.2	C865 H882	C865-S880 WeakPolarHBondContact CB-OG 3.36Å; C865-S880 PolarHBondContact N-O 2.86Å; C865-S880 PolarHBondContact O-N 3.05Å; S880-H882 PolarHBondContact OG-NE2 3.08Å
881	L	92.4	Very high	82.9	Confident	33 Å²	33	74.5 Å²	74.5	17%	0.173	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.6	-176	-60	175.8	0	0	0	110.2	L864 W883 A895 A896 V899 V919	L864-L881 HydrophobicContact CB-CD2 4.4Å; L864-L881 HydrophobicContact CD1-CD2 3.53Å; L881-W883 HydrophobicContact CB-CZ2 4.43Å; L881-W883 HydrophobicContact CD1-CZ2 4.07Å; L881-A895 HydrophobicContact CD1-CB 4.45Å; L881-A896 HydrophobicContact CD1-CB 4.23Å; L881-V899 HydrophobicContact CD1-CG2 4.27Å; L881-V919 HydrophobicContact CD2-CG2 3.89Å
882	H	92	Very high	84	Confident	111 Å²	111	70.7 Å²	70.7	51%	0.514	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	103.5	-180	-64.6	-82.6	0	0	0	110.7	C862 T863 S880	C862-H882 CarbonylContact C-O 3.59Å; C862-H882 WeakPolarHBondContact CA-O 3.11Å; T863-H882 PolarHBondContact N-O 3.38Å; T863-H882 PolarHBondContact O-N 2.98Å; S880-H882 PolarHBondContact OG-NE2 3.08Å
883	W	90.1	Very high	84.8	Confident	37 Å²	37	76.4 Å²	76.4	14%	0.14	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	147.8	-174	-59.7	87.6	0	0	0	113.3	C862 L881 V887 R892 A895 V919 L923 I926	C862-W883 HydrophobicContact CB-CD2 4.02Å; C862-W883 HydrophobicContact CB-CE3 3.62Å; C862-W883 HydrophobicContact CB-CH2 4.21Å; C862-W883 HydrophobicContact CB-CZ3 3.74Å; L881-W883 HydrophobicContact CB-CZ2 4.43Å; L881-W883 HydrophobicContact CD1-CZ2 4.07Å; W883-V887 HydrophobicContact CB-CB 4.45Å; W883-V887 HydrophobicContact CD2-CG1 4.38Å; W883-V887 HydrophobicContact CE3-CB 4.38Å; W883-V887 HydrophobicContact CE3-CG1 3.97Å; W883-V887 HydrophobicContact CE3-CG2 4.12Å; W883-V887 HydrophobicContact CZ3-CG1 4.48Å; W883-R892 HydrophobicContact CB-CG 4.31Å; W883-R892 HydrophobicContact CD2-CG 4.09Å; W883-R892 HydrophobicContact CG-CB 4.43Å; W883-R892 HydrophobicContact CG-CG 3.74Å; W883-A895 HydrophobicContact CH2-CB 3.74Å; W883-A895 HydrophobicContact CZ2-CB 3.44Å; W883-A895 VanDerWaalsContact CZ2-CB 3.44Å; W883-V919 HydrophobicContact CH2-CG1 4.45Å; W883-L923 HydrophobicContact CE3-CD2 4.3Å; W883-L923 HydrophobicContact CZ3-CD2 3.72Å; W883-L923 HydrophobicContact CZ3-CG 4.17Å; W883-I926 HydrophobicContact CZ3-CD1 4.02Å
884	S	81.4	Confident	85.5	Confident	34 Å²	34	79.4 Å²	79.4	24%	0.238	39%	0.389	C	S	.	.			trans	-60	148	163.5	45	0	0	0	0	112	E861 D886 V887	E861-S884 PolarHBondContact N-OG 2.88Å; E861-S884 WeakPolarHBondContact O-CB 3.23Å; E861-S884 PolarHBondContact O-N 3.21Å; E861-S884 PolarHBondContact O-OG 3.05Å; S884-D886 PolarHBondContact O-N 2.68Å; S884-D886 VanDerWaalsContact O-N 3.11Å; S884-V887 PolarHBondContact O-N 2.92Å
885	E	77.6	Confident	86.4	Confident	185 Å²	185	74 Å²	74	86%	0.864	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.3	-168.3	-64.5	-173.9	160.4	0	0	113.7	V887 R892	E885-V887 PolarHBondContact O-N 3.48Å; E885-V887 VanDerWaalsContact O-N 3.16Å; E885-R892 PolarHBondContact O-NH2 2.97Å
886	D	73.6	Confident	87	Confident	127 Å²	127	72.4 Å²	72.4	68%	0.679	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	1.9	-175.6	-64.5	-48.1	0	0	0	115.4	S884 K930	S884-D886 PolarHBondContact O-N 2.68Å; S884-D886 VanDerWaalsContact O-N 3.11Å; D886-K930 VanDerWaalsContact CB-NZ 3.34Å; D886-K930 WeakPolarHBondContact O-CE 3.33Å; D886-K930 PolarHBondContact O-NZ 3.31Å
887	V	82	Confident	87.3	Confident	5 Å²	5	75.5 Å²	75.5	3%	0.03	38%	0.377	C	S	.	.	S	Bend	trans	-95.4	133	-177.3	-180	0	0	0	0	111.1	V860 W883 S884 E885 D891 R892 I926	V860-V887 HydrophobicContact CG1-CG2 3.59Å; W883-V887 HydrophobicContact CB-CB 4.45Å; W883-V887 HydrophobicContact CD2-CG1 4.38Å; W883-V887 HydrophobicContact CE3-CB 4.38Å; W883-V887 HydrophobicContact CE3-CG1 3.97Å; W883-V887 HydrophobicContact CE3-CG2 4.12Å; W883-V887 HydrophobicContact CZ3-CG1 4.48Å; S884-V887 PolarHBondContact O-N 2.92Å; E885-V887 PolarHBondContact O-N 3.48Å; E885-V887 VanDerWaalsContact O-N 3.16Å; V887-D891 HydrophobicContact CG1-CB 3.98Å; V887-R892 HydrophobicContact CG1-CG 3.95Å; V887-R892 VanDerWaalsContact O-CZ 3.27Å; V887-R892 PolarHBondContact O-NE 3.16Å; V887-R892 PolarHBondContact O-NH2 3.19Å; V887-I926 HydrophobicContact CG1-CD1 3.93Å
888	S	85.2	Confident	87.3	Confident	58 Å²	58	79.6 Å²	79.6	41%	0.406	39%	0.394	S	S	.	.			trans	-72	147.8	-177.7	88.4	0	0	0	0	112.2	K890 D891 R892	S888-K890 VanDerWaalsContact C-N 3.34Å; S888-K890 PolarHBondContact O-N 3.07Å; S888-D891 WeakPolarHBondContact CB-OD2 3.32Å; S888-D891 WeakPolarHBondContact O-CB 2.73Å; S888-D891 PolarHBondContact O-N 2.97Å; S888-D891 PolarHBondContact OG-OD2 3.03Å; S888-R892 WeakPolarHBondContact O-CG 3.5Å; S888-R892 PolarHBondContact O-N 2.83Å
889	E	86.8	Confident	87.4	Confident	149 Å²	149	73 Å²	73	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-55.4	-46.1	-175.1	-169.4	157.6	-133.2	0	0	112.6	D891 R892 E893	E889-D891 VanDerWaalsContact C-N 3.3Å; E889-D891 PolarHBondContact O-N 2.74Å; E889-R892 WeakPolarHBondContact O-CA 3.16Å; E889-R892 VanDerWaalsContact O-CB 3.3Å; E889-R892 WeakPolarHBondContact O-CB 3.16Å; E889-R892 PolarHBondContact O-N 3.21Å; E889-E893 PolarHBondContact O-N 3.34Å
890	K	87.3	Confident	87.3	Confident	129 Å²	129	75.5 Å²	75.5	56%	0.561	38%	0.378	S	S	*	.	H	α-helix	trans	-56.5	-39.1	174.6	177.6	170.6	-178.1	171	0	113.7	S888 R892 E893 Q894	S888-K890 VanDerWaalsContact C-N 3.34Å; S888-K890 PolarHBondContact O-N 3.07Å; K890-R892 VanDerWaalsContact C-N 3.26Å; K890-R892 PolarHBondContact O-N 2.96Å; K890-E893 PolarHBondContact O-N 3.09Å; K890-Q894 HydrophobicContact CG-CG 4.44Å; K890-Q894 WeakPolarHBondContact O-CG 3.48Å; K890-Q894 PolarHBondContact O-N 2.88Å
891	D	87	Confident	87.1	Confident	7 Å²	7	77 Å²	77	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-67.4	-31.5	177.6	-56.2	-48.8	0	0	0	110.9	V887 S888 E889 A895 H922 I926 R929	V887-D891 HydrophobicContact CG1-CB 3.98Å; S888-D891 WeakPolarHBondContact CB-OD2 3.32Å; S888-D891 WeakPolarHBondContact O-CB 2.73Å; S888-D891 PolarHBondContact O-N 2.97Å; S888-D891 PolarHBondContact OG-OD2 3.03Å; E889-D891 VanDerWaalsContact C-N 3.3Å; E889-D891 PolarHBondContact O-N 2.74Å; D891-A895 WeakPolarHBondContact O-CB 3.5Å; D891-A895 PolarHBondContact O-N 2.93Å; D891-H922 PolarHBondContact O-NE2 2.85Å; D891-I926 HydrophobicContact CB-CD1 4Å; D891-I926 HydrophobicContact CB-CG1 4.21Å; D891-R929 VanDerWaalsContact CG-NH2 3.34Å; D891-R929 IonicContact OD1-CZ 2.95Å; D891-R929 VanDerWaalsContact OD1-CZ 3.23Å; D891-R929 IonicContact OD1-NH1 3Å; D891-R929 PolarHBondContact OD1-NH1 2.92Å; D891-R929 IonicContact OD1-NH2 2.73Å; D891-R929 PolarHBondContact OD1-NH2 3.24Å; D891-R929 IonicContact OD2-CZ 3.92Å; D891-R929 IonicContact OD2-NH2 3.25Å; D891-R929 PolarHBondContact OD2-NH2 3.35Å
892	R	90	Very high	86.8	Confident	86 Å²	86	76.5 Å²	76.5	33%	0.325	38%	0.38	S	S	.	.	H	α-helix	trans	-72	-41	176.5	-52.1	174.2	-166.5	-167.4	-1	111.6	W883 E885 V887 S888 E889 K890 A896	W883-R892 HydrophobicContact CB-CG 4.31Å; W883-R892 HydrophobicContact CD2-CG 4.09Å; W883-R892 HydrophobicContact CG-CB 4.43Å; W883-R892 HydrophobicContact CG-CG 3.74Å; E885-R892 PolarHBondContact O-NH2 2.97Å; V887-R892 HydrophobicContact CG1-CG 3.95Å; V887-R892 VanDerWaalsContact O-CZ 3.27Å; V887-R892 PolarHBondContact O-NE 3.16Å; V887-R892 PolarHBondContact O-NH2 3.19Å; S888-R892 WeakPolarHBondContact O-CG 3.5Å; S888-R892 PolarHBondContact O-N 2.83Å; E889-R892 WeakPolarHBondContact O-CA 3.16Å; E889-R892 VanDerWaalsContact O-CB 3.3Å; E889-R892 WeakPolarHBondContact O-CB 3.16Å; E889-R892 PolarHBondContact O-N 3.21Å; K890-R892 VanDerWaalsContact C-N 3.26Å; K890-R892 PolarHBondContact O-N 2.96Å; R892-A896 WeakPolarHBondContact O-CB 3.49Å; R892-A896 PolarHBondContact O-N 3.09Å
893	E	89.3	Confident	86.5	Confident	125 Å²	125	71.8 Å²	71.8	58%	0.584	36%	0.358	S	S	*	.	H	α-helix	trans	-63.2	-51.3	177	-68.1	174.9	141.9	0	0	111.1	E889 K890 A895 A896 E897	E889-E893 PolarHBondContact O-N 3.34Å; K890-E893 PolarHBondContact O-N 3.09Å; E893-A895 VanDerWaalsContact C-N 3.28Å; E893-A895 PolarHBondContact O-N 2.89Å; E893-A896 WeakPolarHBondContact O-CB 3.47Å; E893-A896 PolarHBondContact O-N 3.19Å; E893-E897 PolarHBondContact O-N 2.99Å
894	Q	88.3	Confident	86.3	Confident	75 Å²	75	72.6 Å²	72.6	35%	0.35	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-36.1	179.4	-69.2	-170.3	-53.7	0	0	112.5	K890 Q898	K890-Q894 HydrophobicContact CG-CG 4.44Å; K890-Q894 WeakPolarHBondContact O-CG 3.48Å; K890-Q894 PolarHBondContact O-N 2.88Å; Q894-Q898 WeakPolarHBondContact O-CB 3.21Å; Q894-Q898 VanDerWaalsContact O-CG 3.23Å; Q894-Q898 WeakPolarHBondContact O-CG 3.23Å; Q894-Q898 PolarHBondContact O-N 3.33Å
895	A	88.9	Confident	86.2	Confident	0 Å²	0	74 Å²	74	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-70.4	-32.9	174.1	0	0	0	0	0	113.1	L881 W883 D891 E893 V899 H922	L881-A895 HydrophobicContact CD1-CB 4.45Å; W883-A895 HydrophobicContact CH2-CB 3.74Å; W883-A895 HydrophobicContact CZ2-CB 3.44Å; W883-A895 VanDerWaalsContact CZ2-CB 3.44Å; D891-A895 WeakPolarHBondContact O-CB 3.5Å; D891-A895 PolarHBondContact O-N 2.93Å; E893-A895 VanDerWaalsContact C-N 3.28Å; E893-A895 PolarHBondContact O-N 2.89Å; A895-V899 WeakPolarHBondContact O-CB 3.25Å; A895-V899 VanDerWaalsContact O-CG2 3.28Å; A895-V899 WeakPolarHBondContact O-CG2 2.91Å; A895-V899 PolarHBondContact O-N 3.27Å; A895-H922 HydrophobicContact CB-CB 4.42Å
896	A	90.6	Very high	86.2	Confident	46 Å²	46	66.8 Å²	66.8	38%	0.38	33%	0.333	S	S	.	.	H	α-helix	trans	-71.3	-42	175.8	0	0	0	0	0	112.1	L881 R892 E893 V899 L900	L881-A896 HydrophobicContact CD1-CB 4.23Å; R892-A896 WeakPolarHBondContact O-CB 3.49Å; R892-A896 PolarHBondContact O-N 3.09Å; E893-A896 WeakPolarHBondContact O-CB 3.47Å; E893-A896 PolarHBondContact O-N 3.19Å; A896-V899 PolarHBondContact O-N 2.94Å; A896-L900 PolarHBondContact O-N 3.48Å
897	E	90.3	Very high	86.3	Confident	131 Å²	131	62.3 Å²	62.3	61%	0.612	31%	0.309	S	S	*	.	H	α-helix	trans	-58.3	-49.6	172.9	-177.3	-179.4	-154.4	0	0	111.2	E893 V899 L900 L901	E893-E897 PolarHBondContact O-N 2.99Å; E897-V899 VanDerWaalsContact C-N 3.35Å; E897-V899 PolarHBondContact O-N 3.08Å; E897-L900 PolarHBondContact O-N 2.64Å; E897-L901 WeakPolarHBondContact O-CB 3.49Å; E897-L901 PolarHBondContact O-N 3.14Å
898	Q	87.6	Confident	85.3	Confident	93 Å²	93	64.1 Å²	64.1	44%	0.435	33%	0.329	S	S	.	.	H	α-helix	trans	-61.3	-38.7	176	-75.1	176.4	-19.7	0	0	113.1	Q894 V902 V918 H922	Q894-Q898 WeakPolarHBondContact O-CB 3.21Å; Q894-Q898 VanDerWaalsContact O-CG 3.23Å; Q894-Q898 WeakPolarHBondContact O-CG 3.23Å; Q894-Q898 PolarHBondContact O-N 3.33Å; Q898-V902 WeakPolarHBondContact O-CB 3.41Å; Q898-V902 VanDerWaalsContact O-CG2 3.3Å; Q898-V902 WeakPolarHBondContact O-CG2 3.5Å; Q898-V902 PolarHBondContact O-N 2.75Å; Q898-V902 VanDerWaalsContact O-N 3.15Å; Q898-V918 HydrophobicContact CB-CG1 3.99Å; Q898-H922 PolarHBondContact OE1-ND1 3.02Å
899	V	91.1	Very high	84.5	Confident	7 Å²	7	62.2 Å²	62.2	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-45.9	176	160.7	0	0	0	0	111.3	V879 L881 A895 A896 E897 V902 M903 L915 V918 V919	V879-V899 HydrophobicContact CG1-CG1 3.95Å; L881-V899 HydrophobicContact CD1-CG2 4.27Å; A895-V899 WeakPolarHBondContact O-CB 3.25Å; A895-V899 VanDerWaalsContact O-CG2 3.28Å; A895-V899 WeakPolarHBondContact O-CG2 2.91Å; A895-V899 PolarHBondContact O-N 3.27Å; A896-V899 PolarHBondContact O-N 2.94Å; E897-V899 VanDerWaalsContact C-N 3.35Å; E897-V899 PolarHBondContact O-N 3.08Å; V899-V902 PolarHBondContact O-N 2.95Å; V899-M903 HydrophobicContact CG1-SD 4.29Å; V899-M903 VanDerWaalsContact O-CG 3.31Å; V899-M903 WeakPolarHBondContact O-CG 3.47Å; V899-M903 PolarHBondContact O-N 3.11Å; V899-M903 VanDerWaalsContact O-N 3.12Å; V899-L915 HydrophobicContact CG1-CD1 4.48Å; V899-L915 HydrophobicContact CG1-CD2 4.38Å; V899-V918 HydrophobicContact CG2-CG1 4.12Å; V899-V919 HydrophobicContact CG2-CG2 3.64Å
900	L	90.4	Very high	84	Confident	95 Å²	95	58.6 Å²	58.6	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-49.1	-179.6	-177.5	138.9	0	0	0	111.6	A896 E897 V902 M903 E904	A896-L900 PolarHBondContact O-N 3.48Å; E897-L900 PolarHBondContact O-N 2.64Å; L900-V902 VanDerWaalsContact C-N 3.32Å; L900-V902 PolarHBondContact O-N 3.02Å; L900-M903 WeakPolarHBondContact O-CB 3.22Å; L900-M903 PolarHBondContact O-N 3.5Å; L900-E904 VanDerWaalsContact CD2-OE2 3.3Å; L900-E904 WeakPolarHBondContact CD2-OE2 2.98Å; L900-E904 PolarHBondContact O-N 3.21Å
901	L	87.8	Confident	83.9	Confident	83 Å²	83	52.7 Å²	52.7	44%	0.435	28%	0.28	S	S	.	.	H	α-helix	trans	-57.5	-41.7	177.6	178.2	150.1	0	0	0	112.3	E897 M903 E904 Q905	E897-L901 WeakPolarHBondContact O-CB 3.49Å; E897-L901 PolarHBondContact O-N 3.14Å; L901-M903 VanDerWaalsContact C-N 3.34Å; L901-M903 PolarHBondContact O-N 3.02Å; L901-E904 PolarHBondContact O-N 3.49Å; L901-Q905 HydrophobicContact CD2-CG 4.42Å; L901-Q905 WeakPolarHBondContact O-CB 3.36Å; L901-Q905 VanDerWaalsContact O-CG 3.31Å; L901-Q905 WeakPolarHBondContact O-CG 3.12Å; L901-Q905 PolarHBondContact O-N 2.9Å
902	V	86.3	Confident	83.9	Confident	24 Å²	24	52.4 Å²	52.4	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-70.6	-28.5	177.8	168.7	0	0	0	0	112.5	Q898 V899 L900 N906 L915 V918	Q898-V902 WeakPolarHBondContact O-CB 3.41Å; Q898-V902 VanDerWaalsContact O-CG2 3.3Å; Q898-V902 WeakPolarHBondContact O-CG2 3.5Å; Q898-V902 PolarHBondContact O-N 2.75Å; Q898-V902 VanDerWaalsContact O-N 3.15Å; V899-V902 PolarHBondContact O-N 2.95Å; L900-V902 VanDerWaalsContact C-N 3.32Å; L900-V902 PolarHBondContact O-N 3.02Å; V902-N906 WeakPolarHBondContact O-CB 3.36Å; V902-N906 PolarHBondContact O-ND2 3.24Å; V902-L915 HydrophobicContact CB-CD2 4.36Å; V902-L915 HydrophobicContact CG1-CD2 3.96Å; V902-V918 HydrophobicContact CB-CG2 4.46Å; V902-V918 HydrophobicContact CG1-CG2 4.29Å; V902-V918 HydrophobicContact CG2-CG2 4.01Å
903	M	85.4	Confident	83.8	Confident	12 Å²	12	51.9 Å²	51.9	6%	0.059	28%	0.279	C	S	.	.	H	α-helix	trans	-70	-43.2	172.4	-67.5	-179.9	65.8	0	0	112.2	L876 A877 V879 V899 L900 L901 N906 L907 V911 L915	L876-M903 HydrophobicContact CB-CE 4.36Å; L876-M903 HydrophobicContact CD2-CB 3.77Å; L876-M903 HydrophobicContact CD2-CE 4.48Å; A877-M903 HydrophobicContact CB-CE 3.84Å; A877-M903 WeakPolarHBondContact O-CE 3.49Å; V879-M903 HydrophobicContact CB-SD 4.18Å; V879-M903 HydrophobicContact CG2-CE 3.82Å; V879-M903 HydrophobicContact CG2-SD 3.56Å; V879-M903 VanDerWaalsContact CG2-SD 3.56Å; V899-M903 HydrophobicContact CG1-SD 4.29Å; V899-M903 VanDerWaalsContact O-CG 3.31Å; V899-M903 WeakPolarHBondContact O-CG 3.47Å; V899-M903 PolarHBondContact O-N 3.11Å; V899-M903 VanDerWaalsContact O-N 3.12Å; L900-M903 WeakPolarHBondContact O-CB 3.22Å; L900-M903 PolarHBondContact O-N 3.5Å; L901-M903 VanDerWaalsContact C-N 3.34Å; L901-M903 PolarHBondContact O-N 3.02Å; M903-N906 PolarHBondContact O-N 3.46Å; M903-L907 PolarHBondContact O-N 3.21Å; M903-V911 HydrophobicContact CG-CG2 4.36Å; M903-L915 HydrophobicContact CE-CD1 4.43Å; M903-L915 HydrophobicContact CG-CD1 3.65Å; M903-L915 HydrophobicContact CG-CD2 3.46Å; M903-L915 VanDerWaalsContact CG-CD2 3.46Å; M903-L915 HydrophobicContact CG-CG 4.16Å; M903-L915 HydrophobicContact SD-CD1 3.68Å; M903-L915 HydrophobicContact SD-CD2 4.44Å
904	E	86.1	Confident	83.7	Confident	53 Å²	53	48.3 Å²	48.3	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-42.3	-179.3	-72.4	172.6	161.5	0	0	111.9	V237 L876 L900 L901 N906	V237-E904 HydrophobicContact CG1-CB 4.23Å; V237-E904 HydrophobicContact CG1-CG 4.31Å; L876-E904 HydrophobicContact CD1-CG 3.91Å; L876-E904 HydrophobicContact CD2-CG 4Å; L900-E904 VanDerWaalsContact CD2-OE2 3.3Å; L900-E904 WeakPolarHBondContact CD2-OE2 2.98Å; L900-E904 PolarHBondContact O-N 3.21Å; L901-E904 PolarHBondContact O-N 3.49Å; E904-N906 PolarHBondContact O-N 2.83Å; E904-N906 VanDerWaalsContact O-N 3.17Å
905	Q	79.3	Confident	83.8	Confident	65 Å²	65	44.7 Å²	44.7	30%	0.304	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	174.1	-77.1	-179	-15.3	0	0	114.5	F241 L901	F241-Q905 HydrophobicContact CE2-CB 3.73Å; F241-Q905 HydrophobicContact CE2-CG 4.47Å; F241-Q905 WeakPolarHBondContact CE2-O 3.41Å; F241-Q905 HydrophobicContact CZ-CB 3.93Å; F241-Q905 HydrophobicContact CZ-CG 4.4Å; L901-Q905 HydrophobicContact CD2-CG 4.42Å; L901-Q905 WeakPolarHBondContact O-CB 3.36Å; L901-Q905 VanDerWaalsContact O-CG 3.31Å; L901-Q905 WeakPolarHBondContact O-CG 3.12Å; L901-Q905 PolarHBondContact O-N 2.9Å
906	N	76.7	Confident	83.9	Confident	33 Å²	33	44.7 Å²	44.7	18%	0.176	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	19.6	-172.9	-68.6	-90.3	0	0	0	113.7	V902 M903 E904 G908 S909 V911	V902-N906 WeakPolarHBondContact O-CB 3.36Å; V902-N906 PolarHBondContact O-ND2 3.24Å; M903-N906 PolarHBondContact O-N 3.46Å; E904-N906 PolarHBondContact O-N 2.83Å; E904-N906 VanDerWaalsContact O-N 3.17Å; N906-G908 PolarHBondContact O-N 2.83Å; N906-S909 WeakPolarHBondContact O-CB 3.26Å; N906-S909 PolarHBondContact O-N 2.96Å; N906-V911 HydrophobicContact CB-CG1 3.5Å
907	L	75.7	Confident	83.8	Confident	32 Å²	32	47.9 Å²	47.9	17%	0.168	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	136	179.7	-166.3	74	0	0	0	111.7	F238 F239 L876 M903 S909	F238-L907 HydrophobicContact CD1-CD2 4.49Å; F238-L907 HydrophobicContact CE1-CD2 3.46Å; F238-L907 VanDerWaalsContact CE1-CD2 3.46Å; F238-L907 HydrophobicContact CZ-CD2 3.62Å; F239-L907 HydrophobicContact CE1-CB 4.46Å; F239-L907 WeakPolarHBondContact CE1-O 3.41Å; F239-L907 HydrophobicContact CZ-CB 4.06Å; F239-L907 WeakPolarHBondContact CZ-O 2.96Å; L876-L907 HydrophobicContact CD2-CD1 3.86Å; L876-L907 HydrophobicContact CG-CD1 4.06Å; M903-L907 PolarHBondContact O-N 3.21Å; L907-S909 VanDerWaalsContact C-N 3.3Å; L907-S909 PolarHBondContact O-N 3.27Å
908	G	61.9	Low	83.8	Confident	43 Å²	43	43 Å²	43	44%	0.443	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-11.2	-174.5	0	0	0	0	0	115.2	P873 N906	P873-G908 WeakPolarHBondContact O-CA 3.21Å; P873-G908 PolarHBondContact O-N 3.11Å; N906-G908 PolarHBondContact O-N 2.83Å
909	S	67.3	Low	84.1	Confident	18 Å²	18	38.6 Å²	38.6	13%	0.126	22%	0.22	C	C	.	.	S	Bend	trans	-95.6	151.2	164.8	-173.9	0	0	0	0	110.2	R417 P873 N906 L907 V911	R417-S909 PolarHBondContact NH1-OG 3.13Å; R417-S909 PolarHBondContact NH2-OG 3.37Å; P873-S909 VanDerWaalsContact CB-O 3.22Å; P873-S909 WeakPolarHBondContact CB-O 3.14Å; N906-S909 WeakPolarHBondContact O-CB 3.26Å; N906-S909 PolarHBondContact O-N 2.96Å; L907-S909 VanDerWaalsContact C-N 3.3Å; L907-S909 PolarHBondContact O-N 3.27Å; S909-V911 WeakPolarHBondContact O-CG1 3.39Å; S909-V911 PolarHBondContact O-N 3.39Å
910	P	76.7	Confident	84	Confident	73 Å²	73	41.3 Å²	41.3	47%	0.474	23%	0.232	S	C	.	.			trans	-53.5	131.9	153	-23.5	35.1	0	0	0	109.4
911	V	85.2	Confident	84	Confident	6 Å²	6	39.8 Å²	39.8	4%	0.036	23%	0.229	C	C	.	.			trans	-122.6	-11.6	-173.6	-58.5	0	0	0	0	114.7	Y872 M903 N906 S909 F913 S914 L915	Y872-V911 HydrophobicContact CE2-CG2 4.15Å; Y872-V911 PolarHBondContact OH-N 2.95Å; M903-V911 HydrophobicContact CG-CG2 4.36Å; N906-V911 HydrophobicContact CB-CG1 3.5Å; S909-V911 WeakPolarHBondContact O-CG1 3.39Å; S909-V911 PolarHBondContact O-N 3.39Å; V911-F913 VanDerWaalsContact C-N 3.29Å; V911-F913 PolarHBondContact O-N 3.46Å; V911-S914 WeakPolarHBondContact O-CA 3.03Å; V911-S914 VanDerWaalsContact O-CB 3.31Å; V911-S914 WeakPolarHBondContact O-CB 3.42Å; V911-S914 PolarHBondContact O-N 2.68Å; V911-L915 HydrophobicContact CG2-CD1 4.1Å; V911-L915 HydrophobicContact CG2-CG 4.24Å; V911-L915 PolarHBondContact O-N 3.44Å; V911-L915 VanDerWaalsContact O-N 3.12Å
912	I	88	Confident	84.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-32.8	-162.6	-55	-54.7	0	0	0	112.8	E820 L824 F843 I845 V866 F868 L915 V916	E820-I912 WeakPolarHBondContact OE1-CB 3.05Å; E820-I912 WeakPolarHBondContact OE1-CG1 3.46Å; E820-I912 PolarHBondContact OE1-N 3.05Å; L824-I912 HydrophobicContact CD1-CB 4Å; L824-I912 HydrophobicContact CD1-CG1 4.38Å; L824-I912 HydrophobicContact CD1-CG2 3.73Å; L824-I912 HydrophobicContact CD2-CB 4.2Å; L824-I912 HydrophobicContact CD2-CG2 3.81Å; L824-I912 HydrophobicContact CG-CG2 4.46Å; F843-I912 HydrophobicContact CE2-CG2 4.08Å; F843-I912 HydrophobicContact CZ-CG1 4.3Å; F843-I912 HydrophobicContact CZ-CG2 4.31Å; I845-I912 HydrophobicContact CD1-CG2 4.1Å; V866-I912 HydrophobicContact CG1-CD1 3.78Å; V866-I912 HydrophobicContact CG2-CD1 4.24Å; F868-I912 HydrophobicContact CE1-CD1 4.17Å; F868-I912 HydrophobicContact CE1-CG1 4.04Å; I912-L915 HydrophobicContact CD1-CD1 4.06Å; I912-L915 PolarHBondContact O-N 2.98Å; I912-V916 WeakPolarHBondContact O-CG2 3.4Å; I912-V916 PolarHBondContact O-N 2.96Å
913	F	86.5	Confident	84.2	Confident	76 Å²	76	35.6 Å²	35.6	33%	0.333	21%	0.206	S	C	.	.	H	α-helix	trans	-62.6	-39.8	172.1	-70.5	-75.3	0	0	0	112.9	A823 L824 I827 Y828 V911 L915 V916 D917	A823-F913 HydrophobicContact CB-CZ 4.38Å; L824-F913 HydrophobicContact CD2-CD1 4.15Å; L824-F913 HydrophobicContact CD2-CD2 4.23Å; L824-F913 HydrophobicContact CD2-CE1 3.71Å; L824-F913 HydrophobicContact CD2-CE2 3.79Å; L824-F913 HydrophobicContact CD2-CG 4.39Å; L824-F913 HydrophobicContact CD2-CZ 3.51Å; L824-F913 HydrophobicContact CG-CE2 4.24Å; L824-F913 HydrophobicContact CG-CZ 4.04Å; I827-F913 HydrophobicContact CB-CE1 4.45Å; I827-F913 HydrophobicContact CD1-CE1 3.57Å; I827-F913 HydrophobicContact CD1-CZ 3.68Å; I827-F913 HydrophobicContact CG2-CE1 4.3Å; Y828-F913 HydrophobicContact CE2-CD1 4.3Å; Y828-F913 AromaticContact CE2-CE1 3.94Å; Y828-F913 HydrophobicContact CE2-CE1 3.94Å; V911-F913 VanDerWaalsContact C-N 3.29Å; V911-F913 PolarHBondContact O-N 3.46Å; F913-L915 VanDerWaalsContact C-N 3.33Å; F913-L915 PolarHBondContact O-N 2.64Å; F913-V916 PolarHBondContact O-N 3.41Å; F913-D917 PolarHBondContact O-N 3.27Å
914	S	86.9	Confident	84.3	Confident	49 Å²	49	38.6 Å²	38.6	34%	0.343	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-38.6	174.9	-48	0	0	0	0	111.4	V911 D917 V918	V911-S914 WeakPolarHBondContact O-CA 3.03Å; V911-S914 VanDerWaalsContact O-CB 3.31Å; V911-S914 WeakPolarHBondContact O-CB 3.42Å; V911-S914 PolarHBondContact O-N 2.68Å; S914-D917 PolarHBondContact O-N 2.95Å; S914-V918 WeakPolarHBondContact O-CB 3.2Å; S914-V918 VanDerWaalsContact O-CG2 3.23Å; S914-V918 WeakPolarHBondContact O-CG2 3.33Å; S914-V918 PolarHBondContact O-N 3.44Å
915	L	91.5	Very high	84.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.7	-36.6	177.2	-50.7	-172.4	0	0	0	112	L864 V879 V899 V902 M903 V911 I912 F913 V919	L864-L915 HydrophobicContact CD2-CB 4.12Å; V879-L915 HydrophobicContact CG2-CD1 4.12Å; V899-L915 HydrophobicContact CG1-CD1 4.48Å; V899-L915 HydrophobicContact CG1-CD2 4.38Å; V902-L915 HydrophobicContact CB-CD2 4.36Å; V902-L915 HydrophobicContact CG1-CD2 3.96Å; M903-L915 HydrophobicContact CE-CD1 4.43Å; M903-L915 HydrophobicContact CG-CD1 3.65Å; M903-L915 HydrophobicContact CG-CD2 3.46Å; M903-L915 VanDerWaalsContact CG-CD2 3.46Å; M903-L915 HydrophobicContact CG-CG 4.16Å; M903-L915 HydrophobicContact SD-CD1 3.68Å; M903-L915 HydrophobicContact SD-CD2 4.44Å; V911-L915 HydrophobicContact CG2-CD1 4.1Å; V911-L915 HydrophobicContact CG2-CG 4.24Å; V911-L915 PolarHBondContact O-N 3.44Å; V911-L915 VanDerWaalsContact O-N 3.12Å; I912-L915 HydrophobicContact CD1-CD1 4.06Å; I912-L915 PolarHBondContact O-N 2.98Å; F913-L915 VanDerWaalsContact C-N 3.33Å; F913-L915 PolarHBondContact O-N 2.64Å; L915-V919 VanDerWaalsContact O-CG2 3.29Å; L915-V919 WeakPolarHBondContact O-CG2 3.47Å; L915-V919 PolarHBondContact O-N 2.88Å; L915-V919 VanDerWaalsContact O-N 3.07Å
916	V	91.5	Very high	84.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-46.9	172.6	172.6	0	0	0	0	111	Y828 I845 L847 L864 I912 F913 V918 V919 Q920	Y828-V916 HydrophobicContact CE1-CG1 3.87Å; Y828-V916 HydrophobicContact CE2-CG2 4.38Å; Y828-V916 VanDerWaalsContact OH-CG1 3.23Å; Y828-V916 WeakPolarHBondContact OH-CG1 3.33Å; I845-V916 HydrophobicContact CD1-CG2 3.83Å; L847-V916 HydrophobicContact CD1-CB 4.42Å; L847-V916 HydrophobicContact CD1-CG1 3.96Å; L847-V916 HydrophobicContact CD1-CG2 4.4Å; L847-V916 HydrophobicContact CD2-CG1 3.54Å; L847-V916 HydrophobicContact CG-CG1 4.42Å; L864-V916 HydrophobicContact CD2-CG2 3.64Å; I912-V916 WeakPolarHBondContact O-CG2 3.4Å; I912-V916 PolarHBondContact O-N 2.96Å; F913-V916 PolarHBondContact O-N 3.41Å; V916-V918 PolarHBondContact O-N 2.76Å; V916-V919 PolarHBondContact O-N 2.99Å; V916-Q920 HydrophobicContact CG1-CG 4.07Å; V916-Q920 VanDerWaalsContact CG1-OE1 3.31Å; V916-Q920 WeakPolarHBondContact O-CB 3.49Å; V916-Q920 WeakPolarHBondContact O-CG 3.39Å; V916-Q920 PolarHBondContact O-N 2.59Å
917	D	88.2	Confident	85.3	Confident	113 Å²	113	36 Å²	36	60%	0.604	21%	0.211	S	C	*	.	H	α-helix	trans	-61.1	-42.7	179.7	-169.2	47.1	0	0	0	112.1	F913 S914 Q920 S921	F913-D917 PolarHBondContact O-N 3.27Å; S914-D917 PolarHBondContact O-N 2.95Å; D917-Q920 PolarHBondContact O-N 3.34Å; D917-S921 VanDerWaalsContact O-CB 3.24Å; D917-S921 WeakPolarHBondContact O-CB 3.25Å; D917-S921 PolarHBondContact O-N 3.39Å
918	V	90.6	Very high	85.8	Confident	29 Å²	29	38.3 Å²	38.3	18%	0.176	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-49.8	172.7	169.2	0	0	0	0	111.5	Q898 V899 V902 S914 V916 S921 H922	Q898-V918 HydrophobicContact CB-CG1 3.99Å; V899-V918 HydrophobicContact CG2-CG1 4.12Å; V902-V918 HydrophobicContact CB-CG2 4.46Å; V902-V918 HydrophobicContact CG1-CG2 4.29Å; V902-V918 HydrophobicContact CG2-CG2 4.01Å; S914-V918 WeakPolarHBondContact O-CB 3.2Å; S914-V918 VanDerWaalsContact O-CG2 3.23Å; S914-V918 WeakPolarHBondContact O-CG2 3.33Å; S914-V918 PolarHBondContact O-N 3.44Å; V916-V918 PolarHBondContact O-N 2.76Å; V918-S921 PolarHBondContact O-N 3.16Å; V918-H922 WeakPolarHBondContact O-CB 3.26Å; V918-H922 PolarHBondContact O-N 3.37Å
919	V	92.5	Very high	87	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.6	-36	-178.8	175.7	0	0	0	0	111.8	L847 C862 L881 W883 V899 L915 V916 H922 L923	L847-V919 HydrophobicContact CD1-CB 3.84Å; L847-V919 HydrophobicContact CD1-CG1 3.66Å; C862-V919 HydrophobicContact CB-CG1 4.08Å; L881-V919 HydrophobicContact CD2-CG2 3.89Å; W883-V919 HydrophobicContact CH2-CG1 4.45Å; V899-V919 HydrophobicContact CG2-CG2 3.64Å; L915-V919 VanDerWaalsContact O-CG2 3.29Å; L915-V919 WeakPolarHBondContact O-CG2 3.47Å; L915-V919 PolarHBondContact O-N 2.88Å; L915-V919 VanDerWaalsContact O-N 3.07Å; V916-V919 PolarHBondContact O-N 2.99Å; V919-H922 PolarHBondContact O-N 3.04Å; V919-L923 HydrophobicContact CG1-CD1 4.18Å; V919-L923 HydrophobicContact CG1-CG 4.44Å; V919-L923 WeakPolarHBondContact O-CB 3.35Å; V919-L923 VanDerWaalsContact O-CG 3.29Å; V919-L923 WeakPolarHBondContact O-CG 3.38Å; V919-L923 PolarHBondContact O-N 2.69Å
920	Q	90.4	Very high	87.8	Confident	63 Å²	63	42.8 Å²	42.8	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-66.2	-45.2	173.7	-74	-165.7	-97.4	0	0	111.8	L847 V916 D917 H922 L923 L924	L847-Q920 HydrophobicContact CB-CG 4.41Å; L847-Q920 HydrophobicContact CD1-CG 4.26Å; L847-Q920 HydrophobicContact CD2-CG 4.13Å; L847-Q920 HydrophobicContact CG-CG 4.5Å; V916-Q920 HydrophobicContact CG1-CG 4.07Å; V916-Q920 VanDerWaalsContact CG1-OE1 3.31Å; V916-Q920 WeakPolarHBondContact O-CB 3.49Å; V916-Q920 WeakPolarHBondContact O-CG 3.39Å; V916-Q920 PolarHBondContact O-N 2.59Å; D917-Q920 PolarHBondContact O-N 3.34Å; Q920-H922 VanDerWaalsContact C-N 3.3Å; Q920-H922 PolarHBondContact O-N 3.05Å; Q920-L923 PolarHBondContact O-N 3.42Å; Q920-L924 VanDerWaalsContact O-CB 3.31Å; Q920-L924 WeakPolarHBondContact O-CB 3.25Å; Q920-L924 PolarHBondContact O-N 3.43Å
921	S	89.6	Confident	88.1	Confident	64 Å²	64	40.5 Å²	40.5	45%	0.448	21%	0.205	S	C	.	.	H	α-helix	trans	-57.6	-43.4	173.7	-176.8	0	0	0	0	111.3	D917 V918 L924 N925	D917-S921 VanDerWaalsContact O-CB 3.24Å; D917-S921 WeakPolarHBondContact O-CB 3.25Å; D917-S921 PolarHBondContact O-N 3.39Å; V918-S921 PolarHBondContact O-N 3.16Å; S921-L924 PolarHBondContact O-N 3.22Å; S921-N925 PolarHBondContact O-N 3.41Å; S921-N925 PolarHBondContact O-ND2 3.29Å
922	H	89.1	Confident	88	Confident	19 Å²	19	43.1 Å²	43.1	9%	0.088	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-43.2	177.5	-152	115.2	0	0	0	112.3	D891 A895 Q898 V918 V919 Q920 L924 N925 I926	D891-H922 PolarHBondContact O-NE2 2.85Å; A895-H922 HydrophobicContact CB-CB 4.42Å; Q898-H922 PolarHBondContact OE1-ND1 3.02Å; V918-H922 WeakPolarHBondContact O-CB 3.26Å; V918-H922 PolarHBondContact O-N 3.37Å; V919-H922 PolarHBondContact O-N 3.04Å; Q920-H922 VanDerWaalsContact C-N 3.3Å; Q920-H922 PolarHBondContact O-N 3.05Å; H922-L924 VanDerWaalsContact C-N 3.34Å; H922-L924 PolarHBondContact O-N 3.06Å; H922-N925 PolarHBondContact O-N 3.32Å; H922-I926 WeakPolarHBondContact O-CG1 3.28Å; H922-I926 PolarHBondContact O-N 2.99Å
923	L	89.7	Confident	87.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.2	-45.8	172.7	-80.7	168.2	0	0	0	112.1	L847 E849 V860 C862 W883 V919 Q920 I926 A927	L847-L923 HydrophobicContact CB-CD1 3.65Å; E849-L923 HydrophobicContact CB-CB 4.47Å; E849-L923 HydrophobicContact CG-CB 3.87Å; V860-L923 HydrophobicContact CB-CD2 4.01Å; V860-L923 HydrophobicContact CG1-CD2 3.54Å; C862-L923 HydrophobicContact CB-CD1 4.1Å; C862-L923 HydrophobicContact CB-CD2 4.03Å; C862-L923 HydrophobicContact CB-CG 4.33Å; W883-L923 HydrophobicContact CE3-CD2 4.3Å; W883-L923 HydrophobicContact CZ3-CD2 3.72Å; W883-L923 HydrophobicContact CZ3-CG 4.17Å; V919-L923 HydrophobicContact CG1-CD1 4.18Å; V919-L923 HydrophobicContact CG1-CG 4.44Å; V919-L923 WeakPolarHBondContact O-CB 3.35Å; V919-L923 VanDerWaalsContact O-CG 3.29Å; V919-L923 WeakPolarHBondContact O-CG 3.38Å; V919-L923 PolarHBondContact O-N 2.69Å; Q920-L923 PolarHBondContact O-N 3.42Å; L923-I926 PolarHBondContact O-N 2.87Å; L923-A927 WeakPolarHBondContact O-CB 3.17Å; L923-A927 PolarHBondContact O-N 3.42Å
924	L	87.5	Confident	87.7	Confident	75 Å²	75	48.4 Å²	48.4	39%	0.393	25%	0.249	S	C	.	.	H	α-helix	trans	-65.9	-39.4	-178.3	-164.5	151.5	0	0	0	110.9	E849 Q920 S921 H922 A927 E928	E849-L924 HydrophobicContact CG-CB 4.19Å; Q920-L924 VanDerWaalsContact O-CB 3.31Å; Q920-L924 WeakPolarHBondContact O-CB 3.25Å; Q920-L924 PolarHBondContact O-N 3.43Å; S921-L924 PolarHBondContact O-N 3.22Å; H922-L924 VanDerWaalsContact C-N 3.34Å; H922-L924 PolarHBondContact O-N 3.06Å; L924-A927 PolarHBondContact O-N 2.84Å; L924-E928 HydrophobicContact CD2-CG 4.07Å; L924-E928 WeakPolarHBondContact O-CB 3.01Å; L924-E928 WeakPolarHBondContact O-CG 3.16Å; L924-E928 PolarHBondContact O-N 3.41Å
925	N	88.8	Confident	87.5	Confident	93 Å²	93	48.4 Å²	48.4	50%	0.497	24%	0.243	S	C	.	.	H	α-helix	trans	-62.9	-42.1	172.2	-80.6	-67.2	0	0	0	113.1	S921 H922 R929	S921-N925 PolarHBondContact O-N 3.41Å; S921-N925 PolarHBondContact O-ND2 3.29Å; H922-N925 PolarHBondContact O-N 3.32Å; N925-R929 WeakPolarHBondContact O-CB 3.38Å; N925-R929 PolarHBondContact O-N 2.85Å
926	I	87.7	Confident	87.2	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-44.7	174	-65.9	160.8	0	0	0	110.6	V860 W883 V887 D891 H922 L923 R929 K930	V860-I926 HydrophobicContact CG1-CG2 4.18Å; V860-I926 HydrophobicContact CG2-CG2 4.39Å; W883-I926 HydrophobicContact CZ3-CD1 4.02Å; V887-I926 HydrophobicContact CG1-CD1 3.93Å; D891-I926 HydrophobicContact CB-CD1 4Å; D891-I926 HydrophobicContact CB-CG1 4.21Å; H922-I926 WeakPolarHBondContact O-CG1 3.28Å; H922-I926 PolarHBondContact O-N 2.99Å; L923-I926 PolarHBondContact O-N 2.87Å; I926-R929 WeakPolarHBondContact O-CB 3.33Å; I926-R929 PolarHBondContact O-N 3.12Å; I926-K930 HydrophobicContact CG2-CD 4.4Å; I926-K930 PolarHBondContact O-N 3.15Å
927	A	85.8	Confident	86.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70	-38	-177.5	0	0	0	0	0	112.3	E849 L851 V860 L923 L924 K930 R931	E849-A927 HydrophobicContact CB-CB 4.42Å; L851-A927 HydrophobicContact CD1-CB 3.44Å; L851-A927 VanDerWaalsContact CD1-CB 3.44Å; V860-A927 HydrophobicContact CG2-CB 3.76Å; L923-A927 WeakPolarHBondContact O-CB 3.17Å; L923-A927 PolarHBondContact O-N 3.42Å; L924-A927 PolarHBondContact O-N 2.84Å; A927-K930 PolarHBondContact O-N 3.48Å; A927-R931 WeakPolarHBondContact O-CB 3.47Å; A927-R931 PolarHBondContact O-N 2.85Å
928	E	86.4	Confident	86.7	Confident	82 Å²	82	57 Å²	57	38%	0.383	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-44.4	170.3	-84	-101.7	113.5	0	0	111.9	L851 L924 R931 S932	L851-E928 HydrophobicContact CD1-CG 4.38Å; L924-E928 HydrophobicContact CD2-CG 4.07Å; L924-E928 WeakPolarHBondContact O-CB 3.01Å; L924-E928 WeakPolarHBondContact O-CG 3.16Å; L924-E928 PolarHBondContact O-N 3.41Å; E928-R931 CarbonylContact O-C 3.36Å; E928-R931 PolarHBondContact O-N 3.43Å; E928-S932 PolarHBondContact O-N 2.76Å
929	R	86.5	Confident	86.3	Confident	111 Å²	111	59.2 Å²	59.2	42%	0.419	30%	0.301	S	S	.	.	H	α-helix	trans	-55.1	-55.6	172.9	-88.8	165.2	51	-166.1	-11.6	111	D891 N925 I926 R931 S932 E933	D891-R929 VanDerWaalsContact CG-NH2 3.34Å; D891-R929 IonicContact OD1-CZ 2.95Å; D891-R929 VanDerWaalsContact OD1-CZ 3.23Å; D891-R929 IonicContact OD1-NH1 3Å; D891-R929 PolarHBondContact OD1-NH1 2.92Å; D891-R929 IonicContact OD1-NH2 2.73Å; D891-R929 PolarHBondContact OD1-NH2 3.24Å; D891-R929 IonicContact OD2-CZ 3.92Å; D891-R929 IonicContact OD2-NH2 3.25Å; D891-R929 PolarHBondContact OD2-NH2 3.35Å; N925-R929 WeakPolarHBondContact O-CB 3.38Å; N925-R929 PolarHBondContact O-N 2.85Å; I926-R929 WeakPolarHBondContact O-CB 3.33Å; I926-R929 PolarHBondContact O-N 3.12Å; R929-R931 VanDerWaalsContact C-N 3.32Å; R929-R931 PolarHBondContact O-N 2.94Å; R929-S932 WeakPolarHBondContact O-CA 3.23Å; R929-S932 WeakPolarHBondContact O-CB 3.2Å; R929-S932 PolarHBondContact O-N 3.3Å; R929-S932 PolarHBondContact O-OG 3.36Å; R929-E933 PolarHBondContact O-N 3.07Å
930	K	84.7	Confident	86	Confident	43 Å²	43	62.1 Å²	62.1	19%	0.187	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-40.3	176.5	-72.9	179.8	176.3	-179	0	112.8	I858 V860 D886 I926 A927 S932 E933 Q934	I858-K930 HydrophobicContact CD1-CB 3.91Å; I858-K930 HydrophobicContact CG1-CB 4.5Å; I858-K930 HydrophobicContact CG2-CB 3.93Å; I858-K930 HydrophobicContact CG2-CD 3.93Å; V860-K930 HydrophobicContact CG2-CD 4.43Å; D886-K930 VanDerWaalsContact CB-NZ 3.34Å; D886-K930 WeakPolarHBondContact O-CE 3.33Å; D886-K930 PolarHBondContact O-NZ 3.31Å; I926-K930 HydrophobicContact CG2-CD 4.4Å; I926-K930 PolarHBondContact O-N 3.15Å; A927-K930 PolarHBondContact O-N 3.48Å; K930-S932 PolarHBondContact O-N 3.29Å; K930-E933 PolarHBondContact O-N 3.17Å; K930-Q934 PolarHBondContact O-N 3.33Å
931	R	83.2	Confident	85.8	Confident	25 Å²	25	65.2 Å²	65.2	9%	0.094	34%	0.339	C	S	.	.	H	α-helix	trans	-72.9	-13.8	176.5	-162.9	-171.6	168.8	-159.8	5.8	112.6	D853 I858 A927 E928 R929 K935 R1167 N1168	D853-R931 IonicContact OD2-CZ 3.89Å; D853-R931 IonicContact OD2-NE 3.04Å; D853-R931 IonicContact OD2-NH2 3.54Å; D853-R931 PolarHBondContact OD2-NH2 2.79Å; I858-R931 VanDerWaalsContact CD1-CA 3.42Å; I858-R931 HydrophobicContact CD1-CB 3.68Å; I858-R931 HydrophobicContact CD1-CG 4.25Å; I858-R931 VanDerWaalsContact CD1-N 3.31Å; A927-R931 WeakPolarHBondContact O-CB 3.47Å; A927-R931 PolarHBondContact O-N 2.85Å; E928-R931 CarbonylContact O-C 3.36Å; E928-R931 PolarHBondContact O-N 3.43Å; R929-R931 VanDerWaalsContact C-N 3.32Å; R929-R931 PolarHBondContact O-N 2.94Å; R931-K935 WeakPolarHBondContact O-CB 3.22Å; R931-R1167 VanDerWaalsContact NE-NH2 3.19Å; R931-N1168 PolarHBondContact NH2-OD1 2.83Å
932	S	84	Confident	85.5	Confident	61 Å²	61	66.3 Å²	66.3	43%	0.427	34%	0.339	S	S	.	.	H	α-helix	trans	-83.8	-43.4	168.5	84.9	0	0	0	0	111.1	E928 R929 K930 K935 A936	E928-S932 PolarHBondContact O-N 2.76Å; R929-S932 WeakPolarHBondContact O-CA 3.23Å; R929-S932 WeakPolarHBondContact O-CB 3.2Å; R929-S932 PolarHBondContact O-N 3.3Å; R929-S932 PolarHBondContact O-OG 3.36Å; K930-S932 PolarHBondContact O-N 3.29Å; S932-K935 PolarHBondContact O-N 3.18Å; S932-A936 WeakPolarHBondContact O-CB 3.3Å; S932-A936 PolarHBondContact O-N 3.24Å
933	E	85.3	Confident	85.3	Confident	95 Å²	95	70.2 Å²	70.2	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-68	-49.6	-179.3	-68.7	167.3	-144.6	0	0	113	R929 K930 K935 A936 K937	R929-E933 PolarHBondContact O-N 3.07Å; K930-E933 PolarHBondContact O-N 3.17Å; E933-K935 PolarHBondContact O-N 2.66Å; E933-A936 PolarHBondContact O-N 2.73Å; E933-A936 VanDerWaalsContact O-N 3.16Å; E933-K937 WeakPolarHBondContact O-CG 2.99Å; E933-K937 PolarHBondContact O-N 2.9Å
934	Q	81.6	Confident	85.1	Confident	92 Å²	92	74.3 Å²	74.3	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-58.1	-38.9	175.3	-74.9	-171.7	-4.9	0	0	111.4	I858 K930 K937 L938	I858-Q934 HydrophobicContact CD1-CG 4.37Å; K930-Q934 PolarHBondContact O-N 3.33Å; Q934-K937 PolarHBondContact O-N 3.48Å; Q934-L938 WeakPolarHBondContact O-CB 3.45Å; Q934-L938 PolarHBondContact O-N 2.82Å
935	K	83.7	Confident	84.9	Confident	49 Å²	49	73.3 Å²	73.3	21%	0.213	38%	0.382	C	S	.	.	H	α-helix	trans	-71.3	-32.9	178.9	-178.7	175.2	176.1	178.4	0	112.6	R931 S932 E933 L939	R931-K935 WeakPolarHBondContact O-CB 3.22Å; S932-K935 PolarHBondContact O-N 3.18Å; E933-K935 PolarHBondContact O-N 2.66Å; K935-L939 HydrophobicContact CG-CD1 4.28Å; K935-L939 WeakPolarHBondContact O-CB 3.04Å; K935-L939 WeakPolarHBondContact O-CD1 3.43Å; K935-L939 WeakPolarHBondContact O-CG 3.49Å; K935-L939 PolarHBondContact O-N 2.79Å
936	A	84.4	Confident	84.6	Confident	59 Å²	59	75 Å²	75	49%	0.488	38%	0.381	S	S	.	.	H	α-helix	trans	-67.1	-43.5	171	0	0	0	0	0	111.2	S932 E933 L939 A940	S932-A936 WeakPolarHBondContact O-CB 3.3Å; S932-A936 PolarHBondContact O-N 3.24Å; E933-A936 PolarHBondContact O-N 2.73Å; E933-A936 VanDerWaalsContact O-N 3.16Å; A936-L939 PolarHBondContact O-N 3.12Å; A936-A940 PolarHBondContact O-N 2.92Å
937	K	85.8	Confident	84.3	Confident	138 Å²	138	78.8 Å²	78.8	60%	0.6	40%	0.399	S	S	*	.	H	α-helix	trans	-60.4	-49.2	174.9	-69.8	173.4	-179	174.6	0	111.9	E933 Q934 L939 A940 E941	E933-K937 WeakPolarHBondContact O-CG 2.99Å; E933-K937 PolarHBondContact O-N 2.9Å; Q934-K937 PolarHBondContact O-N 3.48Å; K937-L939 VanDerWaalsContact C-N 3.31Å; K937-L939 PolarHBondContact O-N 2.03Å; K937-A940 PolarHBondContact O-N 2.72Å; K937-A940 VanDerWaalsContact O-N 3.16Å; K937-E941 PolarHBondContact O-N 2.94Å
938	L	82.7	Confident	84.2	Confident	97 Å²	97	84.2 Å²	84.2	51%	0.508	42%	0.422	S	S	.	.	H	α-helix	trans	-62.6	-36	176.7	-178.3	63.6	0	0	0	112.6	Q934 I942	Q934-L938 WeakPolarHBondContact O-CB 3.45Å; Q934-L938 PolarHBondContact O-N 2.82Å; L938-I942 HydrophobicContact CD1-CD1 4.4Å; L938-I942 HydrophobicContact CG-CD1 4.12Å; L938-I942 WeakPolarHBondContact O-CD1 3.28Å; L938-I942 VanDerWaalsContact O-CG1 3.25Å; L938-I942 WeakPolarHBondContact O-CG1 3.01Å; L938-I942 PolarHBondContact O-N 3.49Å
939	L	83.9	Confident	83.8	Confident	76 Å²	76	86.3 Å²	86.3	40%	0.398	43%	0.432	S	S	.	.	H	α-helix	trans	-66	-42.6	173.6	-76.8	167.3	0	0	0	111.5	K935 A936 K937 E941 I942 E943	K935-L939 HydrophobicContact CG-CD1 4.28Å; K935-L939 WeakPolarHBondContact O-CB 3.04Å; K935-L939 WeakPolarHBondContact O-CD1 3.43Å; K935-L939 WeakPolarHBondContact O-CG 3.49Å; K935-L939 PolarHBondContact O-N 2.79Å; A936-L939 PolarHBondContact O-N 3.12Å; K937-L939 VanDerWaalsContact C-N 3.31Å; K937-L939 PolarHBondContact O-N 2.03Å; L939-E941 PolarHBondContact O-N 2.88Å; L939-I942 PolarHBondContact O-N 3.37Å; L939-E943 PolarHBondContact O-N 2.98Å
940	A	85.6	Confident	83.5	Confident	60 Å²	60	84.4 Å²	84.4	50%	0.496	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-38.5	175.5	0	0	0	0	0	112.8	A936 K937 I942 E943 L944	A936-A940 PolarHBondContact O-N 2.92Å; K937-A940 PolarHBondContact O-N 2.72Å; K937-A940 VanDerWaalsContact O-N 3.16Å; A940-I942 VanDerWaalsContact C-N 3.33Å; A940-I942 PolarHBondContact O-N 3.36Å; A940-E943 PolarHBondContact O-N 3.06Å; A940-L944 WeakPolarHBondContact O-CB 3.09Å; A940-L944 PolarHBondContact O-N 2.81Å
941	E	86.1	Confident	83.2	Confident	129 Å²	129	88.7 Å²	88.7	60%	0.603	45%	0.447	S	S	*	.	H	α-helix	trans	-61.9	-39.4	172.3	-72.8	176.5	177.3	0	0	112.1	K937 L939 A945	K937-E941 PolarHBondContact O-N 2.94Å; L939-E941 PolarHBondContact O-N 2.88Å; E941-A945 WeakPolarHBondContact O-CB 3.42Å; E941-A945 PolarHBondContact O-N 2.76Å
942	I	82.5	Confident	82.7	Confident	87 Å²	87	93.3 Å²	93.3	45%	0.446	47%	0.472	S	S	.	.	H	α-helix	trans	-69.1	-41.2	175.4	-69.8	165.1	0	0	0	111.4	L938 L939 A940 A945 R946	L938-I942 HydrophobicContact CD1-CD1 4.4Å; L938-I942 HydrophobicContact CG-CD1 4.12Å; L938-I942 WeakPolarHBondContact O-CD1 3.28Å; L938-I942 VanDerWaalsContact O-CG1 3.25Å; L938-I942 WeakPolarHBondContact O-CG1 3.01Å; L938-I942 PolarHBondContact O-N 3.49Å; L939-I942 PolarHBondContact O-N 3.37Å; A940-I942 VanDerWaalsContact C-N 3.33Å; A940-I942 PolarHBondContact O-N 3.36Å; I942-A945 PolarHBondContact O-N 2.88Å; I942-R946 WeakPolarHBondContact O-CB 3.36Å; I942-R946 PolarHBondContact O-N 3.42Å
943	E	85.1	Confident	82	Confident	100 Å²	100	96.4 Å²	96.4	47%	0.467	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-47.6	176.5	-135.8	73.9	-107.2	0	0	110.6	L939 A940 A945 R946 Q947	L939-E943 PolarHBondContact O-N 2.98Å; A940-E943 PolarHBondContact O-N 3.06Å; E943-A945 VanDerWaalsContact C-N 3.33Å; E943-A945 PolarHBondContact O-N 3.49Å; E943-R946 WeakPolarHBondContact O-CB 3.28Å; E943-R946 PolarHBondContact O-N 3.11Å; E943-R946 VanDerWaalsContact O-N 3.11Å; E943-Q947 PolarHBondContact O-N 3.16Å
944	L	85.6	Confident	81.2	Confident	87 Å²	87	99.4 Å²	99.4	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-63.5	-34.8	176.9	-178	65.1	0	0	0	112.7	A940 K948	A940-L944 WeakPolarHBondContact O-CB 3.09Å; A940-L944 PolarHBondContact O-N 2.81Å; L944-K948 WeakPolarHBondContact O-CG 3.36Å; L944-K948 PolarHBondContact O-N 2.88Å
945	A	83.4	Confident	80.5	Confident	54 Å²	54	100.7 Å²	100.7	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-41.4	172.4	0	0	0	0	0	111.5	E941 I942 E943 K948 E949	E941-A945 WeakPolarHBondContact O-CB 3.42Å; E941-A945 PolarHBondContact O-N 2.76Å; I942-A945 PolarHBondContact O-N 2.88Å; E943-A945 VanDerWaalsContact C-N 3.33Å; E943-A945 PolarHBondContact O-N 3.49Å; A945-K948 PolarHBondContact O-N 2.79Å; A945-E949 PolarHBondContact O-N 3.44Å
946	R	82.1	Confident	79.4	Confident	128 Å²	128	106.7 Å²	106.7	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-39.6	177.9	-112.5	176.2	157.4	-151.5	-13.9	113.4	I942 E943 K948 E949 K950	I942-R946 WeakPolarHBondContact O-CB 3.36Å; I942-R946 PolarHBondContact O-N 3.42Å; E943-R946 WeakPolarHBondContact O-CB 3.28Å; E943-R946 PolarHBondContact O-N 3.11Å; E943-R946 VanDerWaalsContact O-N 3.11Å; R946-K948 VanDerWaalsContact C-N 3.29Å; R946-K948 PolarHBondContact O-N 3.37Å; R946-E949 PolarHBondContact O-N 2.88Å; R946-K950 PolarHBondContact O-N 2.92Å
947	Q	82.2	Confident	78	Confident	82 Å²	82	112 Å²	112	38%	0.383	54%	0.536	S	S	.	.	H	α-helix	trans	-59.5	-41.5	173.6	-74.2	177.1	-23.3	0	0	111.2	E943 K950 E951	E943-Q947 PolarHBondContact O-N 3.16Å; Q947-K950 PolarHBondContact O-N 3.3Å; Q947-E951 PolarHBondContact O-N 2.91Å
948	K	84.1	Confident	76.6	Confident	114 Å²	114	110.4 Å²	110.4	50%	0.496	54%	0.543	S	S	.	.	H	α-helix	trans	-67	-36.1	175.6	-69.6	167.9	-176.3	170.3	0	112.8	L944 A945 R946 M952	L944-K948 WeakPolarHBondContact O-CG 3.36Å; L944-K948 PolarHBondContact O-N 2.88Å; A945-K948 PolarHBondContact O-N 2.79Å; R946-K948 VanDerWaalsContact C-N 3.29Å; R946-K948 PolarHBondContact O-N 3.37Å; K948-M952 WeakPolarHBondContact O-CG 3.48Å; K948-M952 PolarHBondContact O-N 3.17Å; K948-M952 VanDerWaalsContact O-N 3.1Å
949	E	77.4	Confident	75.1	Confident	125 Å²	125	107.9 Å²	107.9	58%	0.584	54%	0.536	S	S	*	.	H	α-helix	trans	-64.8	-43.1	170.5	-72.9	-167.4	133.4	0	0	112	A945 R946 E951 M952 E953	A945-E949 PolarHBondContact O-N 3.44Å; R946-E949 PolarHBondContact O-N 2.88Å; E949-E951 PolarHBondContact O-N 2.96Å; E949-M952 HydrophobicContact CG-CE 4.27Å; E949-M952 PolarHBondContact O-N 3.22Å; E949-M952 VanDerWaalsContact O-N 3.13Å; E949-E953 WeakPolarHBondContact O-CB 3.36Å; E949-E953 PolarHBondContact O-N 3.29Å
950	K	80.1	Confident	73	Confident	71 Å²	71	111 Å²	111	31%	0.309	56%	0.558	S	S	.	*	H	α-helix	trans	-60.4	-40	175.7	-75.8	-179	172.7	-177.8	0	112.7	R946 Q947 E953 K954 E1345	R946-K950 PolarHBondContact O-N 2.92Å; Q947-K950 PolarHBondContact O-N 3.3Å; K950-E953 PolarHBondContact O-N 3.12Å; K950-K954 VanDerWaalsContact O-CB 3.3Å; K950-K954 WeakPolarHBondContact O-CB 3.47Å; K950-K954 PolarHBondContact O-N 3.42Å; K950-E1345 WeakPolarHBondContact CD-OE2 3.31Å; K950-E1345 IonicContact NZ-OE1 3.84Å; K950-E1345 PolarHBondContact NZ-OE1 2.83Å; K950-E1345 IonicContact NZ-OE2 2.79Å; K950-E1345 PolarHBondContact NZ-OE2 2.58Å
951	E	78.5	Confident	71	Confident	134 Å²	134	115.1 Å²	115.1	63%	0.626	57%	0.567	S	S	*	*	H	α-helix	trans	-62.6	-44	171.6	-79.1	-159.3	114.3	0	0	112.5	Q947 E949 N955	Q947-E951 PolarHBondContact O-N 2.91Å; E949-E951 PolarHBondContact O-N 2.96Å; E951-N955 PolarHBondContact O-N 2.86Å; E951-N955 VanDerWaalsContact O-N 3.14Å; E951-N955 PolarHBondContact O-ND2 3.29Å
952	M	73.1	Confident	69.6	Low	122 Å²	122	117.4 Å²	117.4	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-66.3	-36.8	177.7	-72.7	-171.7	-67.3	0	0	112.5	K948 E949 N955 R956	K948-M952 WeakPolarHBondContact O-CG 3.48Å; K948-M952 PolarHBondContact O-N 3.17Å; K948-M952 VanDerWaalsContact O-N 3.1Å; E949-M952 HydrophobicContact CG-CE 4.27Å; E949-M952 PolarHBondContact O-N 3.22Å; E949-M952 VanDerWaalsContact O-N 3.13Å; M952-N955 PolarHBondContact O-N 3.17Å; M952-R956 WeakPolarHBondContact O-CB 3.35Å; M952-R956 PolarHBondContact O-N 3.32Å; M952-R956 VanDerWaalsContact O-N 3.08Å
953	E	68.2	Low	68.2	Low	125 Å²	125	119 Å²	119	58%	0.584	59%	0.594	S	S	*	*	H	α-helix	trans	-72.3	-40.1	178.8	-170.5	146.5	-118.7	0	0	112.1	E949 K950 N955 R956 E957	E949-E953 WeakPolarHBondContact O-CB 3.36Å; E949-E953 PolarHBondContact O-N 3.29Å; K950-E953 PolarHBondContact O-N 3.12Å; E953-N955 VanDerWaalsContact C-N 3.28Å; E953-N955 PolarHBondContact O-N 3.21Å; E953-R956 CarbonylContact O-C 3.56Å; E953-R956 WeakPolarHBondContact O-CA 3.3Å; E953-R956 WeakPolarHBondContact O-CB 3.28Å; E953-R956 PolarHBondContact O-N 3.01Å; E953-E957 PolarHBondContact O-N 3.31Å
954	K	69.1	Low	67.1	Low	158 Å²	158	120.1 Å²	120.1	69%	0.687	60%	0.6	S	S	*	*	H	α-helix	trans	-61.2	-35.4	172.8	-169.1	177.2	-176.4	-178.9	0	112.7	K950 R956	K950-K954 VanDerWaalsContact O-CB 3.3Å; K950-K954 WeakPolarHBondContact O-CB 3.47Å; K950-K954 PolarHBondContact O-N 3.42Å; K954-R956 VanDerWaalsContact C-N 3.3Å
955	N	67.2	Low	66.5	Low	120 Å²	120	119.6 Å²	119.6	64%	0.642	60%	0.601	S	S	*	*	H	α-helix	trans	-70.2	-26	170.2	-76.9	-54.4	0	0	0	112.8	E951 M952 E953	E951-N955 PolarHBondContact O-N 2.86Å; E951-N955 VanDerWaalsContact O-N 3.14Å; E951-N955 PolarHBondContact O-ND2 3.29Å; M952-N955 PolarHBondContact O-N 3.17Å; E953-N955 VanDerWaalsContact C-N 3.28Å; E953-N955 PolarHBondContact O-N 3.21Å
956	R	59.9	Low	66	Low	174 Å²	174	125.6 Å²	125.6	66%	0.657	61%	0.613	S	S	*	*	H	α-helix	trans	-85.3	-34.3	-178.7	-170.7	175.4	-179.8	168.1	-1.9	113.7	M952 E953 K954 S958 A959	M952-R956 WeakPolarHBondContact O-CB 3.35Å; M952-R956 PolarHBondContact O-N 3.32Å; M952-R956 VanDerWaalsContact O-N 3.08Å; E953-R956 CarbonylContact O-C 3.56Å; E953-R956 WeakPolarHBondContact O-CA 3.3Å; E953-R956 WeakPolarHBondContact O-CB 3.28Å; E953-R956 PolarHBondContact O-N 3.01Å; K954-R956 VanDerWaalsContact C-N 3.3Å; R956-S958 PolarHBondContact O-N 2.93Å; R956-A959 WeakPolarHBondContact O-CB 3.43Å; R956-A959 PolarHBondContact O-N 3.03Å
957	E	56	Low	65.8	Low	170 Å²	170	126.8 Å²	126.8	79%	0.794	62%	0.624	S	S	*	*	H	α-helix	trans	-63.3	-23.8	174	-69.8	-164	128.8	0	0	112.7	E953 A959	E953-E957 PolarHBondContact O-N 3.31Å; E957-A959 PolarHBondContact O-N 3.43Å
958	S	55.6	Low	65.6	Low	106 Å²	106	127.5 Å²	127.5	74%	0.741	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-7.9	171.9	-62.5	0	0	0	0	113.7	R956	R956-S958 PolarHBondContact O-N 2.93Å
959	A	51.9	Low	65.1	Low	44 Å²	44	127 Å²	127	36%	0.364	63%	0.626	S	S	.	*	S	Bend	trans	-104.1	102.1	-179.8	0	0	0	0	0	111.6	R956 E957 H961	R956-A959 WeakPolarHBondContact O-CB 3.43Å; R956-A959 PolarHBondContact O-N 3.03Å; E957-A959 PolarHBondContact O-N 3.43Å; A959-H961 PolarHBondContact O-N 3.06Å; A959-H961 VanDerWaalsContact O-N 3.11Å
960	V	38.6	Very low	65.1	Low	142 Å²	142	124.5 Å²	124.5	86%	0.861	62%	0.616	S	S	*	*			trans	-58.3	115	175.6	179	0	0	0	0	110.5
961	H	44.1	Very low	65.1	Low	145 Å²	145	124 Å²	124	67%	0.671	62%	0.621	S	S	*	*			trans	-120.5	140.4	177.1	-76	-33.2	0	0	0	112.9	A959	A959-H961 PolarHBondContact O-N 3.06Å; A959-H961 VanDerWaalsContact O-N 3.11Å
962	Q	56.4	Low	65	Low	177 Å²	177	123.9 Å²	123.9	83%	0.827	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-77.1	154.5	-169.3	-67.3	156.1	-51.2	0	0	111.5	M964	Q962-M964 PolarHBondContact O-N 3.07Å
963	P	54.6	Low	65.4	Low	122 Å²	122	120.9 Å²	120.9	79%	0.792	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-59.7	128.5	171.7	25.9	-34.4	0	0	0	110.5
964	M	60.9	Low	66.1	Low	122 Å²	122	120.7 Å²	120.7	60%	0.601	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-62.2	135.7	177.3	-113.4	-167.8	-74.9	0	0	110.8	Q962 Q968	Q962-M964 PolarHBondContact O-N 3.07Å; M964-Q968 HydrophobicContact CB-CB 4.45Å; M964-Q968 HydrophobicContact CG-CB 3.8Å; M964-Q968 HydrophobicContact SD-CB 4.02Å
965	T	73.6	Confident	66.8	Low	76 Å²	76	122.2 Å²	122.2	47%	0.466	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-75.6	158.4	172.2	62.9	0	0	0	0	111.2	E967 Q968 F969	T965-E967 VanDerWaalsContact C-N 3.26Å; T965-E967 PolarHBondContact O-N 2.99Å; T965-Q968 WeakPolarHBondContact O-CB 3.12Å; T965-Q968 PolarHBondContact O-N 3.09Å; T965-Q968 WeakPolarHBondContact OG1-CG 2.98Å; T965-Q968 PolarHBondContact OG1-OE1 3.06Å; T965-F969 PolarHBondContact O-N 3.02Å; T965-F969 VanDerWaalsContact O-N 3.09Å
966	Y	72.7	Confident	67.3	Low	180 Å²	180	121.3 Å²	121.3	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-54.3	-39.7	-179.6	177.6	-106.9	0	0	0	113.2	F969 L970	Y966-F969 PolarHBondContact O-N 3.33Å; Y966-L970 HydrophobicContact CD1-CD1 4.05Å; Y966-L970 HydrophobicContact CE1-CD1 3.46Å; Y966-L970 VanDerWaalsContact CE1-CD1 3.46Å; Y966-L970 HydrophobicContact CE2-CD1 4.38Å; Y966-L970 PolarHBondContact O-N 3.06Å
967	E	77.5	Confident	68	Low	154 Å²	154	117.2 Å²	117.2	72%	0.72	59%	0.587	S	S	*	*	H	α-helix	trans	-66	-38.3	175.2	-64.4	-172.6	132.1	0	0	112.8	T965 L970 S971	T965-E967 VanDerWaalsContact C-N 3.26Å; T965-E967 PolarHBondContact O-N 2.99Å; E967-L970 PolarHBondContact O-N 3.02Å; E967-S971 WeakPolarHBondContact O-CB 3.47Å; E967-S971 PolarHBondContact O-N 3.4Å
968	Q	77.2	Confident	69.1	Low	96 Å²	96	114.2 Å²	114.2	45%	0.449	57%	0.573	S	S	.	*	H	α-helix	trans	-63.5	-45.4	177	-71.2	170	-23.9	0	0	110.5	M964 T965 L970 S971 W972	M964-Q968 HydrophobicContact CB-CB 4.45Å; M964-Q968 HydrophobicContact CG-CB 3.8Å; M964-Q968 HydrophobicContact SD-CB 4.02Å; T965-Q968 WeakPolarHBondContact O-CB 3.12Å; T965-Q968 PolarHBondContact O-N 3.09Å; T965-Q968 WeakPolarHBondContact OG1-CG 2.98Å; T965-Q968 PolarHBondContact OG1-OE1 3.06Å; Q968-L970 PolarHBondContact O-N 3.05Å; Q968-S971 PolarHBondContact O-N 3.02Å; Q968-S971 PolarHBondContact O-OG 3.05Å; Q968-W972 PolarHBondContact O-N 3.05Å
969	F	74.5	Confident	70.1	Confident	105 Å²	105	111.6 Å²	111.6	46%	0.461	56%	0.557	S	S	.	*	H	α-helix	trans	-60.8	-44	175.4	-179	-101.2	0	0	0	112.7	T965 Y966 S971 W972 N973	T965-F969 PolarHBondContact O-N 3.02Å; T965-F969 VanDerWaalsContact O-N 3.09Å; Y966-F969 PolarHBondContact O-N 3.33Å; F969-S971 PolarHBondContact O-N 3.39Å; F969-W972 HydrophobicContact CD2-CE3 4.24Å; F969-W972 HydrophobicContact CE2-CE3 4.08Å; F969-W972 AromaticContact CE2-CZ3 4Å; F969-W972 HydrophobicContact CE2-CZ3 4Å; F969-W972 PolarHBondContact O-N 3.07Å; F969-N973 WeakPolarHBondContact O-CB 3.36Å; F969-N973 PolarHBondContact O-N 2.86Å
970	L	77.3	Confident	71.1	Confident	72 Å²	72	112.9 Å²	112.9	38%	0.377	56%	0.558	S	S	.	*	H	α-helix	trans	-59.7	-43.7	173.9	-100.6	164.4	0	0	0	112.4	Y966 E967 Q968 W972 N973 L974	Y966-L970 HydrophobicContact CD1-CD1 4.05Å; Y966-L970 HydrophobicContact CE1-CD1 3.46Å; Y966-L970 VanDerWaalsContact CE1-CD1 3.46Å; Y966-L970 HydrophobicContact CE2-CD1 4.38Å; Y966-L970 PolarHBondContact O-N 3.06Å; E967-L970 PolarHBondContact O-N 3.02Å; Q968-L970 PolarHBondContact O-N 3.05Å; L970-W972 VanDerWaalsContact C-N 3.32Å; L970-W972 PolarHBondContact O-N 2.9Å; L970-N973 PolarHBondContact O-N 3.49Å; L970-L974 PolarHBondContact O-N 2.9Å
971	S	79.6	Confident	72.7	Confident	59 Å²	59	108.8 Å²	108.8	41%	0.413	54%	0.539	S	S	.	.	H	α-helix	trans	-65.6	-34.6	178.9	81.7	0	0	0	0	112.9	E967 Q968 F969 R975	E967-S971 WeakPolarHBondContact O-CB 3.47Å; E967-S971 PolarHBondContact O-N 3.4Å; Q968-S971 PolarHBondContact O-N 3.02Å; Q968-S971 PolarHBondContact O-OG 3.05Å; F969-S971 PolarHBondContact O-N 3.39Å; S971-R975 WeakPolarHBondContact O-CG 3.36Å; S971-R975 PolarHBondContact O-N 3.46Å
972	W	77.1	Confident	74.1	Confident	132 Å²	132	109.6 Å²	109.6	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-71.6	-47.7	175.1	173.1	84.6	0	0	0	111.4	Q968 F969 L970 L974 R975 F976	Q968-W972 PolarHBondContact O-N 3.05Å; F969-W972 HydrophobicContact CD2-CE3 4.24Å; F969-W972 HydrophobicContact CE2-CE3 4.08Å; F969-W972 AromaticContact CE2-CZ3 4Å; F969-W972 HydrophobicContact CE2-CZ3 4Å; F969-W972 PolarHBondContact O-N 3.07Å; L970-W972 VanDerWaalsContact C-N 3.32Å; L970-W972 PolarHBondContact O-N 2.9Å; W972-L974 VanDerWaalsContact C-N 3.32Å; W972-L974 PolarHBondContact O-N 3.16Å; W972-R975 PolarHBondContact O-N 3.02Å; W972-R975 VanDerWaalsContact O-N 3.13Å; W972-F976 PolarHBondContact O-N 3.28Å
973	N	81.3	Confident	74.5	Confident	60 Å²	60	105 Å²	105	32%	0.321	52%	0.523	S	S	.	.	H	α-helix	trans	-60.8	-39.4	-179.6	-170.5	17.8	0	0	0	111.8	F969 L970 F976 N977	F969-N973 WeakPolarHBondContact O-CB 3.36Å; F969-N973 PolarHBondContact O-N 2.86Å; L970-N973 PolarHBondContact O-N 3.49Å; N973-F976 PolarHBondContact O-N 3.47Å; N973-N977 PolarHBondContact O-N 2.83Å; N973-N977 VanDerWaalsContact O-N 3.11Å; N973-N977 PolarHBondContact O-ND2 2.81Å; N973-N977 PolarHBondContact OD1-ND2 3.28Å
974	L	82.4	Confident	74.6	Confident	121 Å²	121	108.3 Å²	108.3	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-58.3	-49.5	172.7	-85.2	164.5	0	0	0	112.3	L970 W972 F976 N977 E978	L970-L974 PolarHBondContact O-N 2.9Å; W972-L974 VanDerWaalsContact C-N 3.32Å; W972-L974 PolarHBondContact O-N 3.16Å; L974-F976 PolarHBondContact O-N 2.95Å; L974-N977 PolarHBondContact O-N 3.48Å; L974-E978 PolarHBondContact O-N 3.04Å
975	R	83.5	Confident	74.4	Confident	189 Å²	189	107 Å²	107	71%	0.713	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-38.6	179.3	-70.8	175.3	177.9	-179.9	0.9	112.7	S971 W972 E978 A979	S971-R975 WeakPolarHBondContact O-CG 3.36Å; S971-R975 PolarHBondContact O-N 3.46Å; W972-R975 PolarHBondContact O-N 3.02Å; W972-R975 VanDerWaalsContact O-N 3.13Å; R975-E978 PolarHBondContact O-N 3.08Å; R975-A979 PolarHBondContact O-N 3.21Å
976	F	77.8	Confident	73.6	Confident	101 Å²	101	110.9 Å²	110.9	44%	0.443	53%	0.529	S	S	.	.	H	α-helix	trans	-62.9	-45.4	177.5	-178.5	-105	0	0	0	111.9	W972 N973 L974 A979 N980	W972-F976 PolarHBondContact O-N 3.28Å; N973-F976 PolarHBondContact O-N 3.47Å; L974-F976 PolarHBondContact O-N 2.95Å; F976-A979 PolarHBondContact O-N 2.7Å; F976-N980 WeakPolarHBondContact CE1-ND2 3.19Å; F976-N980 WeakPolarHBondContact CZ-ND2 3.5Å; F976-N980 PolarHBondContact O-N 3.1Å; F976-N980 VanDerWaalsContact O-N 3.13Å; F976-N980 PolarHBondContact O-ND2 3.19Å
977	N	75.9	Confident	72.6	Confident	88 Å²	88	108.5 Å²	108.5	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-67	-36.9	176.7	-71.9	-64.2	0	0	0	112.5	N973 L974 N980 A981	N973-N977 PolarHBondContact O-N 2.83Å; N973-N977 VanDerWaalsContact O-N 3.11Å; N973-N977 PolarHBondContact O-ND2 2.81Å; N973-N977 PolarHBondContact OD1-ND2 3.28Å; L974-N977 PolarHBondContact O-N 3.48Å; N977-N980 PolarHBondContact O-N 2.97Å; N977-A981 PolarHBondContact O-N 3.12Å
978	E	79.3	Confident	71.4	Confident	108 Å²	108	106.3 Å²	106.3	51%	0.505	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-37.1	176.2	-148.9	-161	145	0	0	112.3	L974 R975 R982	L974-E978 PolarHBondContact O-N 3.04Å; R975-E978 PolarHBondContact O-N 3.08Å; E978-R982 WeakPolarHBondContact O-CG 3.14Å; E978-R982 PolarHBondContact O-N 2.85Å; E978-R982 IonicContact OE1-CZ 3.56Å; E978-R982 IonicContact OE1-NE 3.85Å; E978-R982 IonicContact OE1-NH2 2.73Å; E978-R982 PolarHBondContact OE1-NH2 3.4Å
979	A	76.7	Confident	70.2	Confident	50 Å²	50	106.7 Å²	106.7	41%	0.413	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-48.1	174	0	0	0	0	0	111.9	R975 F976 A981 R982 C983	R975-A979 PolarHBondContact O-N 3.21Å; F976-A979 PolarHBondContact O-N 2.7Å; A979-A981 VanDerWaalsContact C-N 3.27Å; A979-A981 PolarHBondContact O-N 3.34Å; A979-R982 PolarHBondContact O-N 2.76Å; A979-C983 PolarHBondContact O-N 3.17Å
980	N	71.2	Confident	69.2	Low	72 Å²	72	110.2 Å²	110.2	39%	0.385	55%	0.548	S	S	.	.	H	α-helix	trans	-61	-34.4	178.4	-71.1	-27.2	0	0	0	112.8	F976 N977 R982 C983 R984	F976-N980 WeakPolarHBondContact CE1-ND2 3.19Å; F976-N980 WeakPolarHBondContact CZ-ND2 3.5Å; F976-N980 PolarHBondContact O-N 3.1Å; F976-N980 VanDerWaalsContact O-N 3.13Å; F976-N980 PolarHBondContact O-ND2 3.19Å; N977-N980 PolarHBondContact O-N 2.97Å; N980-R982 VanDerWaalsContact C-N 3.33Å; N980-R982 PolarHBondContact O-N 3.35Å; N980-C983 PolarHBondContact O-N 3.44Å; N980-R984 PolarHBondContact O-N 3.01Å
981	A	72.3	Confident	67.7	Low	56 Å²	56	113.6 Å²	113.6	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-65.5	-33.1	174.8	0	0	0	0	0	113.2	N977 A979 T985	N977-A981 PolarHBondContact O-N 3.12Å; A979-A981 VanDerWaalsContact C-N 3.27Å; A979-A981 PolarHBondContact O-N 3.34Å; A981-T985 PolarHBondContact O-N 3.34Å; A981-T985 PolarHBondContact O-OG1 3.14Å
982	R	74	Confident	65.8	Low	162 Å²	162	120 Å²	120	61%	0.611	58%	0.583	S	S	*	*	H	α-helix	trans	-75.7	-28.8	178	-67.6	-179	-168.8	-157.2	5.9	113.4	E978 A979 N980 T985	E978-R982 WeakPolarHBondContact O-CG 3.14Å; E978-R982 PolarHBondContact O-N 2.85Å; E978-R982 IonicContact OE1-CZ 3.56Å; E978-R982 IonicContact OE1-NE 3.85Å; E978-R982 IonicContact OE1-NH2 2.73Å; E978-R982 PolarHBondContact OE1-NH2 3.4Å; A979-R982 PolarHBondContact O-N 2.76Å; N980-R982 VanDerWaalsContact C-N 3.33Å; N980-R982 PolarHBondContact O-N 3.35Å; R982-T985 WeakPolarHBondContact CA-OG1 3.37Å; R982-T985 PolarHBondContact O-OG1 2.69Å
983	C	64.4	Low	64.6	Low	79 Å²	79	117.4 Å²	117.4	53%	0.534	60%	0.597	S	S	.	*	H	α-helix	trans	-68.4	-52.1	172.6	-65.9	0	0	0	0	110.9	A979 N980 T985 K986	A979-C983 PolarHBondContact O-N 3.17Å; N980-C983 PolarHBondContact O-N 3.44Å; C983-T985 PolarHBondContact O-N 2.95Å; C983-T985 VanDerWaalsContact O-N 3.07Å; C983-K986 PolarHBondContact O-N 2.99Å
984	R	57.3	Low	63	Low	192 Å²	192	123.5 Å²	123.5	73%	0.725	62%	0.615	S	S	*	*	H	α-helix	trans	-57.6	-24.6	178.7	-76.9	-176.7	170	178.7	-2.9	114.7	N980 V988	N980-R984 PolarHBondContact O-N 3.01Å; R984-V988 WeakPolarHBondContact O-CG2 3.46Å
985	T	56.7	Low	61.4	Low	95 Å²	95	129.5 Å²	129.5	58%	0.583	63%	0.629	S	S	*	*	H	α-helix	trans	-84.4	-16.8	177.5	31.4	0	0	0	0	114	A981 R982 C983 T989	A981-T985 PolarHBondContact O-N 3.34Å; A981-T985 PolarHBondContact O-OG1 3.14Å; R982-T985 WeakPolarHBondContact CA-OG1 3.37Å; R982-T985 PolarHBondContact O-OG1 2.69Å; C983-T985 PolarHBondContact O-N 2.95Å; C983-T985 VanDerWaalsContact O-N 3.07Å; T985-T989 PolarHBondContact O-OG1 3.18Å
986	K	57.2	Low	59.9	Low	157 Å²	157	123.9 Å²	123.9	68%	0.683	61%	0.613	S	S	*	*	H	α-helix	trans	-80.6	-44.3	173.9	-76.5	-171.6	170.4	-168.2	0	112.7	C983 V988 T989	C983-K986 PolarHBondContact O-N 2.99Å; K986-V988 PolarHBondContact O-N 3.01Å; K986-T989 PolarHBondContact O-N 3.04Å; K986-T989 PolarHBondContact O-OG1 3.34Å
987	E	51	Low	58.8	Low	130 Å²	130	123 Å²	123	61%	0.607	62%	0.616	S	S	*	*	H	α-helix	trans	-55	-37.6	-178.2	-64.6	170.1	136.9	0	0	111.9	T989	E987-T989 VanDerWaalsContact C-N 3.29Å; E987-T989 PolarHBondContact O-N 3.33Å
988	V	52.3	Low	57.8	Low	109 Å²	109	121.5 Å²	121.5	66%	0.661	62%	0.622	S	S	*	*	H	α-helix	trans	-73.7	-14.7	-177.7	179.9	0	0	0	0	113.6	R984 K986	R984-V988 WeakPolarHBondContact O-CG2 3.46Å; K986-V988 PolarHBondContact O-N 3.01Å
989	T	53.2	Low	56.9	Low	103 Å²	103	126.2 Å²	126.2	63%	0.632	64%	0.635	S	S	*	*	H	α-helix	trans	-93.1	-24.5	-173	31.3	0	0	0	0	116.4	T985 K986 E987	T985-T989 PolarHBondContact O-OG1 3.18Å; K986-T989 PolarHBondContact O-N 3.04Å; K986-T989 PolarHBondContact O-OG1 3.34Å; E987-T989 VanDerWaalsContact C-N 3.29Å; E987-T989 PolarHBondContact O-N 3.33Å
990	E	52	Low	56.3	Low	179 Å²	179	126.4 Å²	126.4	84%	0.836	63%	0.627	S	S	*	*	H	α-helix	trans	-92.5	-22.9	-169.8	-65.4	-170.6	142.1	0	0	114.9	K992	E990-K992 VanDerWaalsContact C-N 3.34Å; E990-K992 PolarHBondContact O-N 2.88Å
991	E	46.9	Very low	55.7	Low	143 Å²	143	128.7 Å²	128.7	67%	0.668	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-71.1	-14.9	-171.5	-78.9	-150.1	104.8	0	0	116.6	G993 K1004	E991-G993 PolarHBondContact O-N 2.87Å; E991-K1004 IonicContact OE1-NZ 3.89Å; E991-K1004 PolarHBondContact OE1-NZ 2.76Å
992	K	40	Very low	54.7	Low	195 Å²	195	133.4 Å²	133.4	85%	0.848	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-77.3	15.2	-165.6	-77.5	-177.5	174	173.6	0	116.6	E990	E990-K992 VanDerWaalsContact C-N 3.34Å; E990-K992 PolarHBondContact O-N 2.88Å
993	G	51.4	Low	53.9	Low	77 Å²	77	131.5 Å²	131.5	79%	0.794	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-100.6	-28.3	-166.4	0	0	0	0	0	118.5	E991	E991-G993 PolarHBondContact O-N 2.87Å
994	R	48	Very low	53.6	Low	188 Å²	188	133 Å²	133	71%	0.709	65%	0.645	S	S	*	*			trans	-125.9	129	-162	179.2	167.7	162	172.4	-10	112.8	E1000	R994-E1000 IonicContact CZ-OE1 2.75Å; R994-E1000 IonicContact NE-OE1 3.68Å; R994-E1000 IonicContact NH2-OE1 3.16Å; R994-E1000 PolarHBondContact NH2-OE1 3.14Å
995	R	48.2	Very low	53	Low	246 Å²	246	127.6 Å²	127.6	93%	0.928	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-70.5	137	164.9	-84.5	-176.3	169.5	179.3	-4.3	109.2
996	L	52.6	Low	52.8	Low	72 Å²	72	129.5 Å²	129.5	38%	0.377	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-101.9	146.9	179.4	-62	155.5	0	0	0	109.2	E1000 K1004	L996-E1000 HydrophobicContact CB-CB 3.92Å; L996-E1000 HydrophobicContact CD2-CB 3.85Å; L996-E1000 HydrophobicContact CD2-CG 4.42Å; L996-E1000 HydrophobicContact CG-CB 4.47Å; L996-K1004 HydrophobicContact CD1-CD 3.97Å
997	T	54	Low	52.6	Low	81 Å²	81	124.8 Å²	124.8	50%	0.497	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-71.3	166.2	167.8	58.2	0	0	0	0	111.3	R999 E1000 Q1001	T997-R999 VanDerWaalsContact C-N 3.27Å; T997-R999 PolarHBondContact O-N 3.02Å; T997-E1000 WeakPolarHBondContact CB-OE2 3.26Å; T997-E1000 WeakPolarHBondContact CG2-OE2 3.38Å; T997-E1000 PolarHBondContact N-OE2 3.4Å; T997-E1000 PolarHBondContact O-N 3.12Å; T997-E1000 WeakPolarHBondContact OG1-CB 3.39Å; T997-E1000 WeakPolarHBondContact OG1-CG 3.46Å; T997-E1000 PolarHBondContact OG1-N 3.36Å; T997-E1000 PolarHBondContact OG1-OE2 2.89Å; T997-Q1001 VanDerWaalsContact O-CB 3.32Å; T997-Q1001 WeakPolarHBondContact O-CB 3.22Å; T997-Q1001 PolarHBondContact O-N 3.05Å
998	G	55.6	Low	52.5	Low	58 Å²	58	122.6 Å²	122.6	60%	0.598	62%	0.615	S	S	*	*	H	α-helix	trans	-58.6	-35.5	178.4	0	0	0	0	0	113.9	F1002	G998-F1002 WeakPolarHBondContact O-CB 3.46Å; G998-F1002 PolarHBondContact O-N 2.95Å
999	R	59.4	Low	52.4	Low	206 Å²	206	123.7 Å²	123.7	78%	0.777	62%	0.622	S	S	*	*	H	α-helix	trans	-71.1	-45.7	175.2	-174.5	176.2	175.8	-178.3	-2.3	111.7	T997 Q1001 F1002 L1003	T997-R999 VanDerWaalsContact C-N 3.27Å; T997-R999 PolarHBondContact O-N 3.02Å; R999-Q1001 VanDerWaalsContact C-N 3.27Å; R999-Q1001 PolarHBondContact O-N 3.35Å; R999-F1002 PolarHBondContact O-N 3.46Å; R999-L1003 HydrophobicContact CG-CD1 3.99Å; R999-L1003 WeakPolarHBondContact O-CB 3.04Å; R999-L1003 VanDerWaalsContact O-CG 3.29Å; R999-L1003 WeakPolarHBondContact O-CG 3.37Å; R999-L1003 PolarHBondContact O-N 3.31Å
1000	E	65.5	Low	52.1	Low	55 Å²	55	121.1 Å²	121.1	26%	0.257	61%	0.606	S	S	.	*	H	α-helix	trans	-61.6	-35.3	173.1	-75	167.3	119.9	0	0	112	R994 L996 T997 K1004	R994-E1000 IonicContact CZ-OE1 2.75Å; R994-E1000 IonicContact NE-OE1 3.68Å; R994-E1000 IonicContact NH2-OE1 3.16Å; R994-E1000 PolarHBondContact NH2-OE1 3.14Å; L996-E1000 HydrophobicContact CB-CB 3.92Å; L996-E1000 HydrophobicContact CD2-CB 3.85Å; L996-E1000 HydrophobicContact CD2-CG 4.42Å; L996-E1000 HydrophobicContact CG-CB 4.47Å; T997-E1000 WeakPolarHBondContact CB-OE2 3.26Å; T997-E1000 WeakPolarHBondContact CG2-OE2 3.38Å; T997-E1000 PolarHBondContact N-OE2 3.4Å; T997-E1000 PolarHBondContact O-N 3.12Å; T997-E1000 WeakPolarHBondContact OG1-CB 3.39Å; T997-E1000 WeakPolarHBondContact OG1-CG 3.46Å; T997-E1000 PolarHBondContact OG1-N 3.36Å; T997-E1000 PolarHBondContact OG1-OE2 2.89Å; E1000-K1004 WeakPolarHBondContact O-CB 2.99Å; E1000-K1004 PolarHBondContact O-N 3.21Å
1001	Q	57.9	Low	52.1	Low	120 Å²	120	114.1 Å²	114.1	56%	0.561	58%	0.577	S	S	*	*	H	α-helix	trans	-69.2	-46.4	178.1	-173.6	171.9	-3.9	0	0	111.3	T997 R999 L1003 K1004 D1005	T997-Q1001 VanDerWaalsContact O-CB 3.32Å; T997-Q1001 WeakPolarHBondContact O-CB 3.22Å; T997-Q1001 PolarHBondContact O-N 3.05Å; R999-Q1001 VanDerWaalsContact C-N 3.27Å; R999-Q1001 PolarHBondContact O-N 3.35Å; Q1001-L1003 PolarHBondContact O-N 2.81Å; Q1001-K1004 PolarHBondContact O-N 3.38Å; Q1001-D1005 PolarHBondContact O-N 2.98Å
1002	F	51.9	Low	52.1	Low	155 Å²	155	112.1 Å²	112.1	68%	0.68	57%	0.571	S	S	*	*	H	α-helix	trans	-61.3	-42	174.3	-173.4	-99.1	0	0	0	112.1	G998 R999 K1004 D1005 L1008	G998-F1002 WeakPolarHBondContact O-CB 3.46Å; G998-F1002 PolarHBondContact O-N 2.95Å; R999-F1002 PolarHBondContact O-N 3.46Å; F1002-K1004 PolarHBondContact O-N 3.03Å; F1002-D1005 PolarHBondContact O-N 2.72Å; F1002-L1008 HydrophobicContact CE2-CD1 4.26Å
1003	L	57.4	Low	52.6	Low	121 Å²	121	107.8 Å²	107.8	63%	0.634	56%	0.561	S	S	*	*	H	α-helix	trans	-73	-22.1	178.8	-69.6	172.6	0	0	0	114.1	R999 Q1001	R999-L1003 HydrophobicContact CG-CD1 3.99Å; R999-L1003 WeakPolarHBondContact O-CB 3.04Å; R999-L1003 VanDerWaalsContact O-CG 3.29Å; R999-L1003 WeakPolarHBondContact O-CG 3.37Å; R999-L1003 PolarHBondContact O-N 3.31Å; Q1001-L1003 PolarHBondContact O-N 2.81Å
1004	K	56.4	Low	52.6	Low	112 Å²	112	110.9 Å²	110.9	49%	0.487	55%	0.548	S	S	.	.	H	α-helix	trans	-81.5	-17.5	171.1	-96.1	-155.5	171.2	-169.9	0	113.7	E991 L996 E1000 Q1001 F1002 N1006	E991-K1004 IonicContact OE1-NZ 3.89Å; E991-K1004 PolarHBondContact OE1-NZ 2.76Å; L996-K1004 HydrophobicContact CD1-CD 3.97Å; E1000-K1004 WeakPolarHBondContact O-CB 2.99Å; E1000-K1004 PolarHBondContact O-N 3.21Å; Q1001-K1004 PolarHBondContact O-N 3.38Å; F1002-K1004 PolarHBondContact O-N 3.03Å; K1004-N1006 PolarHBondContact O-N 2.74Å
1005	D	45	Very low	52.5	Low	77 Å²	77	109.6 Å²	109.6	41%	0.412	55%	0.552	S	S	.	*			trans	-82.7	64.4	-169.9	-137	-26.6	0	0	0	113.1	Q1001 F1002 S1007 L1008	Q1001-D1005 PolarHBondContact O-N 2.98Å; F1002-D1005 PolarHBondContact O-N 2.72Å; D1005-S1007 PolarHBondContact O-N 3.2Å; D1005-S1007 VanDerWaalsContact OD1-CB 3.27Å; D1005-S1007 WeakPolarHBondContact OD1-CB 3.33Å; D1005-S1007 PolarHBondContact OD1-OG 2.91Å; D1005-L1008 PolarHBondContact O-N 2.69Å; D1005-L1008 VanDerWaalsContact O-N 3.14Å
1006	N	53.1	Low	52.5	Low	135 Å²	135	105 Å²	105	72%	0.722	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-6	170	-77.8	-48.7	0	0	0	113.6	K1004 L1008	K1004-N1006 PolarHBondContact O-N 2.74Å; N1006-L1008 VanDerWaalsContact C-N 3.27Å; N1006-L1008 PolarHBondContact O-N 2.86Å
1007	S	53.5	Low	52.2	Low	59 Å²	59	105.4 Å²	105.4	41%	0.413	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.9	-34.1	171.7	73.7	0	0	0	0	112	D1005 V1009 T1010 S1011	D1005-S1007 PolarHBondContact O-N 3.2Å; D1005-S1007 VanDerWaalsContact OD1-CB 3.27Å; D1005-S1007 WeakPolarHBondContact OD1-CB 3.33Å; D1005-S1007 PolarHBondContact OD1-OG 2.91Å; S1007-V1009 PolarHBondContact O-N 2.7Å; S1007-T1010 CarbonylContact O-C 3.45Å; S1007-T1010 VanDerWaalsContact O-C 3.32Å; S1007-T1010 WeakPolarHBondContact O-CA 3.47Å; S1007-T1010 PolarHBondContact O-N 2.7Å; S1007-T1010 PolarHBondContact O-OG1 3.22Å; S1007-T1010 VanDerWaalsContact O-OG1 3.08Å; S1007-S1011 PolarHBondContact O-N 2.97Å
1008	L	47.7	Very low	51.8	Low	83 Å²	83	108.1 Å²	108.1	44%	0.435	56%	0.561	S	S	.	*	H	α-helix	trans	-59.4	-38.4	-171.8	-109.2	145	0	0	0	114.4	F1002 D1005 N1006 T1010 S1011	F1002-L1008 HydrophobicContact CE2-CD1 4.26Å; D1005-L1008 PolarHBondContact O-N 2.69Å; D1005-L1008 VanDerWaalsContact O-N 3.14Å; N1006-L1008 VanDerWaalsContact C-N 3.27Å; N1006-L1008 PolarHBondContact O-N 2.86Å; L1008-T1010 PolarHBondContact O-N 3.05Å; L1008-S1011 WeakPolarHBondContact CA-OG 3.42Å; L1008-S1011 PolarHBondContact O-N 2.84Å; L1008-S1011 PolarHBondContact O-OG 2.95Å
1009	V	50.2	Low	50.9	Low	132 Å²	132	113.2 Å²	113.2	80%	0.8	57%	0.574	S	S	*	*	H	α-helix	trans	-68.5	-7.5	175.8	-177.7	0	0	0	0	112.4	S1007	S1007-V1009 PolarHBondContact O-N 2.7Å
1010	T	48.3	Very low	49.6	Very low	49 Å²	49	106.3 Å²	106.3	30%	0.301	57%	0.567	S	S	.	*	H	α-helix	trans	-127.2	-4.2	172.4	65.4	0	0	0	0	114.7	S1007 L1008 R1014	S1007-T1010 CarbonylContact O-C 3.45Å; S1007-T1010 VanDerWaalsContact O-C 3.32Å; S1007-T1010 WeakPolarHBondContact O-CA 3.47Å; S1007-T1010 PolarHBondContact O-N 2.7Å; S1007-T1010 PolarHBondContact O-OG1 3.22Å; S1007-T1010 VanDerWaalsContact O-OG1 3.08Å; L1008-T1010 PolarHBondContact O-N 3.05Å; T1010-R1014 WeakPolarHBondContact O-CB 3.39Å; T1010-R1014 VanDerWaalsContact O-CG 3.22Å; T1010-R1014 WeakPolarHBondContact O-CG 3.37Å; T1010-R1014 PolarHBondContact O-N 2.84Å; T1010-R1014 PolarHBondContact OG1-NH1 2.03Å
1011	S	51.9	Low	48.2	Very low	32 Å²	32	111.4 Å²	111.4	22%	0.224	60%	0.596	C	S	.	*	H	α-helix	trans	-62.4	-49.3	177.8	49.7	0	0	0	0	109.2	S1007 L1008 V1013 R1014 M1015	S1007-S1011 PolarHBondContact O-N 2.97Å; L1008-S1011 WeakPolarHBondContact CA-OG 3.42Å; L1008-S1011 PolarHBondContact O-N 2.84Å; L1008-S1011 PolarHBondContact O-OG 2.95Å; S1011-V1013 PolarHBondContact O-N 3.03Å; S1011-R1014 PolarHBondContact O-N 3.11Å; S1011-M1015 WeakPolarHBondContact O-CB 3.3Å; S1011-M1015 WeakPolarHBondContact O-CG 3.26Å; S1011-M1015 PolarHBondContact O-N 2.88Å
1012	D	47.2	Very low	47	Very low	102 Å²	102	114.2 Å²	114.2	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-68.6	-44.8	-168	-56	0.8	0	0	0	109.5	I1016	D1012-I1016 WeakPolarHBondContact O-CB 3.09Å; D1012-I1016 WeakPolarHBondContact O-CD1 3.45Å; D1012-I1016 WeakPolarHBondContact O-CG1 3.46Å; D1012-I1016 PolarHBondContact O-N 2.03Å; D1012-I1016 VanDerWaalsContact O-N 3.13Å
1013	V	50.4	Low	46.3	Very low	103 Å²	103	112.8 Å²	112.8	62%	0.624	61%	0.613	S	S	*	*	H	α-helix	trans	-68.9	-34.8	176	-175.7	0	0	0	0	112.4	S1011 S1017	S1011-V1013 PolarHBondContact O-N 3.03Å; V1013-S1017 VanDerWaalsContact O-CB 3.27Å; V1013-S1017 WeakPolarHBondContact O-CB 3.43Å; V1013-S1017 PolarHBondContact O-N 2.78Å; V1013-S1017 PolarHBondContact O-OG 2.81Å
1014	R	49.7	Very low	45.2	Very low	142 Å²	142	112.4 Å²	112.4	54%	0.536	62%	0.615	S	S	.	*	H	α-helix	trans	-79.5	-37.3	179.4	-71.9	174.3	171.8	153.4	-5.1	113.1	T1010 S1011 I1016 S1017 Q1018	T1010-R1014 WeakPolarHBondContact O-CB 3.39Å; T1010-R1014 VanDerWaalsContact O-CG 3.22Å; T1010-R1014 WeakPolarHBondContact O-CG 3.37Å; T1010-R1014 PolarHBondContact O-N 2.84Å; T1010-R1014 PolarHBondContact OG1-NH1 2.03Å; S1011-R1014 PolarHBondContact O-N 3.11Å; R1014-I1016 PolarHBondContact O-N 2.73Å; R1014-S1017 PolarHBondContact O-N 2.84Å; R1014-Q1018 PolarHBondContact O-N 3.29Å; R1014-Q1018 VanDerWaalsContact O-N 3.13Å
1015	M	46	Very low	44.3	Very low	161 Å²	161	112.7 Å²	112.7	79%	0.793	63%	0.626	S	S	*	*	H	α-helix	trans	-59.1	-37.7	170.4	-71.6	-79.2	-75.2	0	0	111	S1011	S1011-M1015 WeakPolarHBondContact O-CB 3.3Å; S1011-M1015 WeakPolarHBondContact O-CG 3.26Å; S1011-M1015 PolarHBondContact O-N 2.88Å
1016	I	49.2	Very low	43.6	Very low	150 Å²	150	113.6 Å²	113.6	77%	0.769	63%	0.631	S	S	*	*	H	α-helix	trans	-78.6	-17.6	178.2	-69.7	168.5	0	0	0	113.2	D1012 R1014	D1012-I1016 WeakPolarHBondContact O-CB 3.09Å; D1012-I1016 WeakPolarHBondContact O-CD1 3.45Å; D1012-I1016 WeakPolarHBondContact O-CG1 3.46Å; D1012-I1016 PolarHBondContact O-N 2.03Å; D1012-I1016 VanDerWaalsContact O-N 3.13Å; R1014-I1016 PolarHBondContact O-N 2.73Å
1017	S	46.9	Very low	42.8	Very low	80 Å²	80	116 Å²	116	56%	0.559	64%	0.638	S	S	*	*	H	α-helix	trans	-120.5	-8.9	-168.8	61.8	0	0	0	0	118.1	V1013 R1014	V1013-S1017 VanDerWaalsContact O-CB 3.27Å; V1013-S1017 WeakPolarHBondContact O-CB 3.43Å; V1013-S1017 PolarHBondContact O-N 2.78Å; V1013-S1017 PolarHBondContact O-OG 2.81Å; R1014-S1017 PolarHBondContact O-N 2.84Å
1018	Q	44.4	Very low	42.5	Very low	138 Å²	138	117.8 Å²	117.8	65%	0.645	65%	0.646	S	S	*	*	S	Bend	trans	-108	-9.1	-167.7	-77.6	-160.8	-34	0	0	119	R1014	R1014-Q1018 PolarHBondContact O-N 3.29Å; R1014-Q1018 VanDerWaalsContact O-N 3.13Å
1019	N	36.2	Very low	42.4	Very low	166 Å²	166	120.6 Å²	120.6	89%	0.888	66%	0.661	S	S	*	*	S	Bend	trans	174.3	129	159.4	-90	-38.1	0	0	0	108
1020	G	32.2	Very low	41.7	Very low	60 Å²	60	123.9 Å²	123.9	62%	0.619	67%	0.665	S	S	*	*			cis	-167.3	-126.6	0.7	0	0	0	0	0	109.9	E1022	G1020-E1022 PolarHBondContact O-N 2.99Å
1021	D	37.3	Very low	41.4	Very low	163 Å²	163	129.5 Å²	129.5	87%	0.872	69%	0.688	S	S	*	*	S	Bend	trans	-54.9	129.9	-179	-55.3	-66.9	0	0	0	114	V1023	D1021-V1023 PolarHBondContact O-N 2.85Å
1022	E	31.8	Very low	40.8	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	72%	0.718	S	S	*	*			trans	46.3	63	151.8	-157.9	165.3	-143.6	0	0	118	G1020 V1024	G1020-E1022 PolarHBondContact O-N 2.99Å; E1022-V1024 HydrophobicContact CG-CG2 4.38Å; E1022-V1024 PolarHBondContact O-N 3.48Å; E1022-V1024 VanDerWaalsContact O-N 3.17Å
1023	V	37.7	Very low	40.3	Very low	125 Å²	125	139 Å²	139	76%	0.758	74%	0.736	S	S	*	*			trans	-75.9	100.2	161.7	-179.2	0	0	0	0	109.6	D1021 V1025	D1021-V1023 PolarHBondContact O-N 2.85Å; V1023-V1025 PolarHBondContact O-N 3.49Å
1024	V	34.2	Very low	39.8	Very low	114 Å²	114	138.7 Å²	138.7	69%	0.691	73%	0.731	S	S	*	*			trans	-67.4	108.8	167.3	178.9	0	0	0	0	108.8	E1022 D1026	E1022-V1024 HydrophobicContact CG-CG2 4.38Å; E1022-V1024 PolarHBondContact O-N 3.48Å; E1022-V1024 VanDerWaalsContact O-N 3.17Å; V1024-D1026 PolarHBondContact O-N 3.19Å
1025	V	36.8	Very low	39.3	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.715	73%	0.726	S	S	*	*			trans	-76.1	104.1	165	179.7	0	0	0	0	107.3	V1023 E1027	V1023-V1025 PolarHBondContact O-N 3.49Å; V1025-E1027 PolarHBondContact O-N 3.29Å
1026	D	31.6	Very low	38.8	Very low	96 Å²	96	132.4 Å²	132.4	51%	0.513	72%	0.722	S	S	.	*			trans	-76.1	109.2	171.9	-160.7	-36	0	0	0	108.5	V1024 T1028 L1029	V1024-D1026 PolarHBondContact O-N 3.19Å; D1026-T1028 VanDerWaalsContact CG-OG1 3.28Å; D1026-T1028 PolarHBondContact O-N 3.19Å; D1026-T1028 WeakPolarHBondContact OD1-CB 3.33Å; D1026-T1028 WeakPolarHBondContact OD1-CG2 3.29Å; D1026-T1028 PolarHBondContact OD1-N 3.26Å; D1026-T1028 PolarHBondContact OD1-OG1 2.86Å; D1026-L1029 PolarHBondContact O-N 3Å
1027	E	36.6	Very low	38.1	Very low	186 Å²	186	129.8 Å²	129.8	87%	0.869	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	0.3	-176.4	-64.3	-176.1	147.2	0	0	113.3	V1025	V1025-E1027 PolarHBondContact O-N 3.29Å
1028	T	45.7	Very low	37.6	Very low	95 Å²	95	131.5 Å²	131.5	58%	0.583	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-0.3	176.9	62.7	0	0	0	0	114.9	D1026 F1030	D1026-T1028 VanDerWaalsContact CG-OG1 3.28Å; D1026-T1028 PolarHBondContact O-N 3.19Å; D1026-T1028 WeakPolarHBondContact OD1-CB 3.33Å; D1026-T1028 WeakPolarHBondContact OD1-CG2 3.29Å; D1026-T1028 PolarHBondContact OD1-N 3.26Å; D1026-T1028 PolarHBondContact OD1-OG1 2.86Å; T1028-F1030 PolarHBondContact O-N 2.94Å
1029	L	45.3	Very low	37.3	Very low	143 Å²	143	130.4 Å²	130.4	75%	0.749	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	11.4	-171.7	-145.9	78	0	0	0	116.2	D1026	D1026-L1029 PolarHBondContact O-N 3Å
1030	F	35.6	Very low	37.4	Very low	201 Å²	201	128.3 Å²	128.3	88%	0.882	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	21.6	179	-71.7	-74	0	0	0	114.2	T1028	T1028-F1030 PolarHBondContact O-N 2.94Å
1031	E	41.8	Very low	37.7	Very low	166 Å²	166	131.4 Å²	131.4	78%	0.776	75%	0.748	S	S	*	*	S	Bend	trans	-93.4	137.6	166.5	-64.7	-167	135	0	0	111.4
1032	D	39.1	Very low	37.7	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	74%	0.742	S	S	*	*			trans	44.5	104.5	163.9	-65.6	-9.2	0	0	0	120.1
1033	D	37.4	Very low	37.9	Very low	172 Å²	172	125.4 Å²	125.4	92%	0.92	74%	0.735	S	S	*	*			trans	-123.9	86.1	155.2	-155.7	-7.7	0	0	0	111.8
1034	D	40.4	Very low	37.8	Very low	97 Å²	97	127.4 Å²	127.4	52%	0.519	74%	0.742	S	S	.	*			trans	-109.9	100.2	-178.6	-169.8	45	0	0	0	111
1035	I	40.1	Very low	37.9	Very low	83 Å²	83	125.5 Å²	125.5	43%	0.426	74%	0.738	S	S	.	*			trans	80.6	104	154.2	-59.8	162.1	0	0	0	118.9	P331 W332	P331-I1035 HydrophobicContact CG-CG2 4.26Å; W332-I1035 VanDerWaalsContact CD1-CD1 3.49Å; W332-I1035 VanDerWaalsContact NE1-CD1 3.28Å
1036	A	34.6	Very low	37.7	Very low	88 Å²	88	127.5 Å²	127.5	73%	0.727	74%	0.744	S	S	*	*			trans	77.8	111.9	133.9	0	0	0	0	0	123.1
1037	A	33.9	Very low	37.7	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	75%	0.753	S	S	*	*				53.6	111.3	125.8	0	0	0	0	0	121.4
1038	S	37.2	Very low	37.6	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	74%	0.744	S	S	*	*				180	141.7	108.4	39.7	0	0	0	0	115.6
1039	S	37.4	Very low	37	Very low	114 Å²	114	123.3 Å²	123.3	80%	0.797	75%	0.747	S	S	*	*			trans	1.6	148.9	163.9	51.4	0	0	0	0	124.1
1040	P	39.8	Very low	36.5	Very low	122 Å²	122	123.3 Å²	123.3	79%	0.792	75%	0.746	S	S	*	*			trans	-94.4	173.6	-167.8	41.2	-40.5	0	0	0	116.5
1041	P	38.3	Very low	36.4	Very low	126 Å²	126	121.8 Å²	121.8	82%	0.818	74%	0.742	S	S	*	*				-143.4	172.8	108.8	38.7	-24.1	0	0	0	115.2
1042	P	37.3	Very low	36.1	Very low	116 Å²	116	117.3 Å²	117.3	75%	0.753	73%	0.733	S	S	*	*			trans	-109.3	156.4	-161.3	40.5	-35.8	0	0	0	118.8
1043	S	34.4	Very low	35.9	Very low	99 Å²	99	116.9 Å²	116.9	69%	0.692	73%	0.731	S	S	*	*			trans	42.1	114.5	146.2	65.2	0	0	0	0	122.6
1044	N	36.6	Very low	35.8	Very low	167 Å²	167	113.8 Å²	113.8	89%	0.893	72%	0.723	S	S	*	*			trans	167.4	148.9	141.2	-87.6	-32.8	0	0	0	108.8
1045	A	35.3	Very low	35.4	Very low	74 Å²	74	114.3 Å²	114.3	61%	0.612	74%	0.735	S	S	*	*			cis	-169.7	172.7	-21.2	0	0	0	0	0	108.5
1046	L	33.1	Very low	35.1	Very low	159 Å²	159	117 Å²	117	83%	0.832	75%	0.754	S	S	*	*			trans	70.2	134.6	178.6	-72.3	72.6	0	0	0	114.8
1047	S	32.9	Very low	34.9	Very low	100 Å²	100	124.7 Å²	124.7	70%	0.699	77%	0.765	S	S	*	*			cis	80.6	134.3	39.9	86.5	0	0	0	0	113.8
1048	S	33.5	Very low	34.7	Very low	97 Å²	97	124.7 Å²	124.7	68%	0.678	77%	0.765	S	S	*	*			cis	-169.8	150.1	10.8	47.9	0	0	0	0	114.5
1049	S	32.9	Very low	34.5	Very low	93 Å²	93	125.4 Å²	125.4	65%	0.65	76%	0.764	S	S	*	*			trans	63	159.4	138	67.5	0	0	0	0	123.8
1050	L	35.7	Very low	34.3	Very low	142 Å²	142	125.7 Å²	125.7	74%	0.743	76%	0.761	S	S	*	*			trans	80.8	139.7	161.6	-57.9	164.6	0	0	0	117.5
1051	E	32.9	Very low	33.9	Very low	169 Å²	169	128.7 Å²	128.7	79%	0.79	77%	0.77	S	S	*	*			cis	-167.9	161.4	-19.5	-139.6	174.7	-154	0	0	112.9
1052	A	35.5	Very low	33.6	Very low	72 Å²	72	125.8 Å²	125.8	60%	0.595	76%	0.763	S	S	*	*			trans	69.6	120.9	140.4	0	0	0	0	0	125.6
1053	N	35.2	Very low	33.3	Very low	153 Å²	153	128.8 Å²	128.8	82%	0.818	77%	0.767	S	S	*	*				98.4	131.6	123.5	-73.9	-17.5	0	0	0	125.8
1054	S	34.7	Very low	33.1	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	78%	0.777	S	S	*	*			trans	68.2	134.4	155.2	68.7	0	0	0	0	119.6
1055	S	31.5	Very low	32.8	Very low	108 Å²	108	129.3 Å²	129.3	76%	0.755	77%	0.769	S	S	*	*			cis	96.3	92.3	13.5	86.9	0	0	0	0	118.4
1056	V	34.1	Very low	32.4	Very low	139 Å²	139	131.2 Å²	131.2	84%	0.842	79%	0.785	S	S	*	*			trans	-160.1	111.9	147.9	164.5	0	0	0	0	106
1057	R	31.7	Very low	32.2	Very low	249 Å²	249	128.2 Å²	128.2	94%	0.94	78%	0.783	S	S	*	*				69.2	124.6	77.9	-126	178.6	-164.5	163.4	5.9	115.3
1058	A	29.1	Very low	32.3	Very low	96 Å²	96	128.1 Å²	128.1	79%	0.793	79%	0.788	S	S	*	*			trans	-93.9	163.1	-165.9	0	0	0	0	0	115.6
1059	T	33.2	Very low	32.3	Very low	132 Å²	132	130.5 Å²	130.5	81%	0.81	79%	0.793	S	S	*	*			trans	-155.3	118.7	151.1	7	0	0	0	0	114
1060	T	31.9	Very low	32.6	Very low	119 Å²	119	132.4 Å²	132.4	73%	0.73	79%	0.794	S	S	*	*			trans	30.8	124.3	139.5	56.8	0	0	0	0	122.6
1061	L	31.9	Very low	32.6	Very low	185 Å²	185	133.9 Å²	133.9	97%	0.969	80%	0.797	S	S	*	*			trans	147.6	139.8	144.4	-83.5	158.3	0	0	0	108.7
1062	G	32	Very low	32.7	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	78%	0.784	S	S	*	*			cis	173	133.5	-9.9	0	0	0	0	0	110.6
1063	H	31.5	Very low	32.7	Very low	179 Å²	179	135.7 Å²	135.7	83%	0.829	80%	0.796	S	S	*	*			trans	16.7	112.6	168.2	-87.4	73.1	0	0	0	119.8
1064	F	29.2	Very low	32.8	Very low	205 Å²	205	134.1 Å²	134.1	90%	0.899	80%	0.797	S	S	*	*				157.4	152	120.5	-101.4	-79.8	0	0	0	113.7
1065	G	30.2	Very low	33.1	Very low	72 Å²	72	136.9 Å²	136.9	74%	0.742	80%	0.795	S	S	*	*			trans	98.8	110	147.2	0	0	0	0	0	117.3
1066	A	28.3	Very low	33.4	Very low	113 Å²	113	139.7 Å²	139.7	93%	0.934	79%	0.794	S	S	*	*			trans	-72	126.9	178.1	0	0	0	0	0	113.6
1067	A	29	Very low	34	Very low	97 Å²	97	141 Å²	141	80%	0.802	80%	0.797	S	S	*	*			trans	-161.9	146.7	161.4	0	0	0	0	0	111.4
1068	A	34.2	Very low	34.8	Very low	98 Å²	98	133 Å²	133	81%	0.81	78%	0.784	S	S	*	*			trans	69.6	164	178.3	0	0	0	0	0	117.5
1069	L	33.7	Very low	35.9	Very low	147 Å²	147	133.8 Å²	133.8	77%	0.77	77%	0.771	S	S	*	*			trans	76.7	88.8	-165.9	-58.2	162.2	0	0	0	112.8
1070	I	39.4	Very low	37.3	Very low	132 Å²	132	137 Å²	137	68%	0.677	77%	0.774	S	S	*	*				96.7	125.7	55.6	-68.3	171.8	0	0	0	111.8
1071	E	34.7	Very low	38.7	Very low	174 Å²	174	134.4 Å²	134.4	81%	0.813	75%	0.751	S	S	*	*			trans	-84.6	133	-164.8	-178.4	177	-149.2	0	0	112.8	K1073	E1071-K1073 PolarHBondContact O-N 3.06Å
1072	V	35.6	Very low	40.5	Very low	83 Å²	83	136.2 Å²	136.2	50%	0.503	75%	0.745	S	S	.	*			trans	-77.1	110.5	177.8	178.8	0	0	0	0	109.9	S1074	V1072-S1074 PolarHBondContact O-N 3.1Å
1073	K	36.6	Very low	42.6	Very low	195 Å²	195	136.1 Å²	136.1	85%	0.848	73%	0.726	S	S	*	*			trans	-100.5	84.2	-171.9	-165.7	177.2	-177.3	-177.8	0	112.3	E1071 K1075	E1071-K1073 PolarHBondContact O-N 3.06Å; K1073-K1075 PolarHBondContact O-N 3.36Å
1074	S	36.6	Very low	44.6	Very low	120 Å²	120	133.4 Å²	133.4	84%	0.839	73%	0.727	S	S	*	*			trans	-55.7	116.1	176.3	178	0	0	0	0	112.9	V1072	V1072-S1074 PolarHBondContact O-N 3.1Å
1075	K	41.5	Very low	46.7	Very low	165 Å²	165	126.2 Å²	126.2	72%	0.717	70%	0.7	S	S	*	*	S	Bend	trans	-149.1	-41.7	145.2	-155.5	172.7	-175	177.5	0	112.6	K1073	K1073-K1075 PolarHBondContact O-N 3.36Å
1076	F	36.3	Very low	48.7	Very low	167 Å²	167	127.2 Å²	127.2	73%	0.732	69%	0.688	S	S	*	*	S	Bend	trans	-146.5	161.2	171.8	-60.9	-75.1	0	0	0	110.4
1077	D	47.4	Very low	50.7	Low	168 Å²	168	128.9 Å²	128.9	90%	0.898	67%	0.67	S	S	*	*			trans	66.1	158.1	166	-52.7	-46	0	0	0	120
1078	A	49.2	Very low	52.6	Low	80 Å²	80	130.3 Å²	130.3	66%	0.661	67%	0.669	S	S	*	*			trans	-97.8	140.3	-168	0	0	0	0	0	113.3
1079	E	51.2	Low	54.1	Low	112 Å²	112	128.8 Å²	128.8	52%	0.523	66%	0.657	S	S	.	*			trans	-100.7	108.7	-176.4	-159.8	-165.8	149.1	0	0	112.9	R1081	E1079-R1081 VanDerWaalsContact CD-NH2 3.34Å; E1079-R1081 HydrophobicContact CG-CG 4.31Å; E1079-R1081 PolarHBondContact O-N 3.21Å; E1079-R1081 IonicContact OE1-CZ 2.68Å; E1079-R1081 VanDerWaalsContact OE1-CZ 3.31Å; E1079-R1081 IonicContact OE1-NE 3.23Å; E1079-R1081 PolarHBondContact OE1-NE 3.16Å; E1079-R1081 IonicContact OE1-NH2 3.94Å; E1079-R1081 PolarHBondContact OE1-NH2 3.08Å; E1079-R1081 IonicContact OE2-CZ 3.48Å; E1079-R1081 IonicContact OE2-NE 2.64Å; E1079-R1081 PolarHBondContact OE2-NE 3.09Å; E1079-R1081 IonicContact OE2-NH2 2.64Å; E1079-R1081 PolarHBondContact OE2-NH2 3.08Å
1080	F	62.3	Low	55.6	Low	201 Å²	201	122.6 Å²	122.6	88%	0.882	63%	0.625	S	S	*	*			trans	-77.9	77.7	180	-66.3	-76.4	0	0	0	113.6
1081	R	62.1	Low	57.1	Low	64 Å²	64	119.7 Å²	119.7	24%	0.242	63%	0.627	C	S	.	*			trans	-75.8	138.6	175	-63.1	-169.8	176	-173.3	1.2	112.6	E1079	E1079-R1081 VanDerWaalsContact CD-NH2 3.34Å; E1079-R1081 HydrophobicContact CG-CG 4.31Å; E1079-R1081 PolarHBondContact O-N 3.21Å; E1079-R1081 IonicContact OE1-CZ 2.68Å; E1079-R1081 VanDerWaalsContact OE1-CZ 3.31Å; E1079-R1081 IonicContact OE1-NE 3.23Å; E1079-R1081 PolarHBondContact OE1-NE 3.16Å; E1079-R1081 IonicContact OE1-NH2 3.94Å; E1079-R1081 PolarHBondContact OE1-NH2 3.08Å; E1079-R1081 IonicContact OE2-CZ 3.48Å; E1079-R1081 IonicContact OE2-NE 2.64Å; E1079-R1081 PolarHBondContact OE2-NE 3.09Å; E1079-R1081 IonicContact OE2-NH2 2.64Å; E1079-R1081 PolarHBondContact OE2-NH2 3.08Å
1082	R	69.5	Low	59.3	Low	223 Å²	223	112.8 Å²	112.8	84%	0.842	60%	0.598	S	S	*	*			trans	-111.9	125.9	166.9	-63.3	-172.5	-174.6	-158.1	4.2	109.9
1083	F	75.4	Confident	61.7	Low	64 Å²	64	109.7 Å²	109.7	28%	0.281	58%	0.579	S	S	.	*			trans	-136.4	149.2	175.9	57	-84.9	0	0	0	110.5	V1085 V1100 L1103 H1104 L1144	F1083-V1085 HydrophobicContact CD2-CG2 3.57Å; F1083-V1085 HydrophobicContact CE2-CG2 3.58Å; F1083-V1100 HydrophobicContact CZ-CG2 4.11Å; F1083-L1103 HydrophobicContact CB-CD1 3.89Å; F1083-L1103 HydrophobicContact CB-CD2 4.06Å; F1083-L1103 HydrophobicContact CD1-CD2 3.58Å; F1083-L1103 HydrophobicContact CD2-CD1 3.89Å; F1083-L1103 HydrophobicContact CD2-CD2 4.28Å; F1083-L1103 HydrophobicContact CE1-CD2 4.04Å; F1083-L1103 HydrophobicContact CG-CD1 3.89Å; F1083-L1103 HydrophobicContact CG-CD2 3.72Å; F1083-H1104 AromaticContact CE1-NE2 3.69Å; F1083-L1144 HydrophobicContact CE1-CD1 4.48Å; F1083-L1144 HydrophobicContact CZ-CD1 3.82Å
1084	S	74.5	Confident	64	Low	122 Å²	122	105 Å²	105	85%	0.853	56%	0.561	S	S	*	*			trans	-98.9	121.5	177.9	56.7	0	0	0	0	110.6
1085	V	72.3	Confident	66.3	Low	53 Å²	53	104.3 Å²	104.3	32%	0.321	54%	0.544	S	S	.	.			trans	-110.7	137.8	170.5	-171.3	0	0	0	0	108.3	F1083 R1087 V1090 L1099	F1083-V1085 HydrophobicContact CD2-CG2 3.57Å; F1083-V1085 HydrophobicContact CE2-CG2 3.58Å; V1085-R1087 PolarHBondContact O-N 3.12Å; V1085-V1090 HydrophobicContact CG1-CG2 3.66Å; V1085-L1099 HydrophobicContact CB-CD2 4.36Å; V1085-L1099 HydrophobicContact CG1-CD2 3.6Å; V1085-L1099 HydrophobicContact CG2-CD2 3.76Å
1086	D	72	Confident	68.5	Low	94 Å²	94	96.8 Å²	96.8	50%	0.503	51%	0.511	S	S	.	.			trans	-70.1	127.7	168.9	171.5	39.6	0	0	0	110.1	T1088 A1089	D1086-T1088 VanDerWaalsContact CG-OG1 3.24Å; D1086-T1088 PolarHBondContact O-N 2.66Å; D1086-T1088 VanDerWaalsContact O-N 3.11Å; D1086-T1088 PolarHBondContact OD1-N 2.77Å; D1086-T1088 PolarHBondContact OD1-OG1 3.03Å; D1086-T1088 VanDerWaalsContact OD1-OG1 3.13Å; D1086-T1088 PolarHBondContact OD2-N 3.23Å; D1086-T1088 PolarHBondContact OD2-OG1 2.95Å; D1086-A1089 HydrophobicContact CB-CB 3.87Å; D1086-A1089 PolarHBondContact O-N 2.94Å; D1086-A1089 PolarHBondContact OD2-N 3.25Å
1087	R	70.3	Confident	70.9	Confident	147 Å²	147	92.2 Å²	92.2	56%	0.555	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.5	-179.8	-78.9	-173.8	172	-131.9	-2	112.9	V1085 L1135 A1138	V1085-R1087 PolarHBondContact O-N 3.12Å; R1087-L1135 PolarHBondContact NH1-O 3.01Å; R1087-L1135 PolarHBondContact NH2-O 2.71Å; R1087-L1135 VanDerWaalsContact NH2-O 3.07Å; R1087-A1138 PolarHBondContact NH2-O 2.85Å
1088	T	70	Confident	72.7	Confident	128 Å²	128	90.5 Å²	90.5	79%	0.785	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-7.2	176.6	34.4	0	0	0	0	115.3	D1086	D1086-T1088 VanDerWaalsContact CG-OG1 3.24Å; D1086-T1088 PolarHBondContact O-N 2.66Å; D1086-T1088 VanDerWaalsContact O-N 3.11Å; D1086-T1088 PolarHBondContact OD1-N 2.77Å; D1086-T1088 PolarHBondContact OD1-OG1 3.03Å; D1086-T1088 VanDerWaalsContact OD1-OG1 3.13Å; D1086-T1088 PolarHBondContact OD2-N 3.23Å; D1086-T1088 PolarHBondContact OD2-OG1 2.95Å
1089	A	65.4	Low	74.5	Confident	66 Å²	66	89.9 Å²	89.9	55%	0.545	46%	0.459	S	S	.	.	S	Bend	trans	-89.4	-9.8	-173.3	0	0	0	0	0	115.2	D1086	D1086-A1089 HydrophobicContact CB-CB 3.87Å; D1086-A1089 PolarHBondContact O-N 2.94Å; D1086-A1089 PolarHBondContact OD2-N 3.25Å
1090	V	64.9	Low	76.1	Confident	17 Å²	17	84.7 Å²	84.7	10%	0.103	44%	0.435	C	S	.	.			trans	-132.6	105	-172.5	-172.6	0	0	0	0	109.8	V1085 Q1095 F1096 L1099 Y1131	V1085-V1090 HydrophobicContact CG1-CG2 3.66Å; V1090-Q1095 HydrophobicContact CG1-CB 3.8Å; V1090-F1096 HydrophobicContact CG1-CB 3.66Å; V1090-F1096 HydrophobicContact CG1-CD2 4.18Å; V1090-F1096 HydrophobicContact CG1-CG 4.42Å; V1090-F1096 VanDerWaalsContact CG1-N 3.35Å; V1090-L1099 HydrophobicContact CG2-CD2 3.83Å; V1090-Y1131 HydrophobicContact CG1-CE1 4.34Å; V1090-Y1131 WeakPolarHBondContact CG1-OH 3.35Å
1091	G	70.9	Confident	77.1	Confident	70 Å²	70	75.2 Å²	75.2	72%	0.722	39%	0.394	S	S	*	.			trans	-93.5	-12.9	-169.7	0	0	0	0	0	116
1092	S	81.8	Confident	78	Confident	29 Å²	29	73.2 Å²	73.2	20%	0.203	39%	0.393	C	S	.	.	S	Bend	trans	-147.6	161.1	179.3	68.1	0	0	0	0	112.8	E1094 Q1095 F1096 D1128	S1092-E1094 PolarHBondContact O-N 3.11Å; S1092-Q1095 PolarHBondContact O-N 3.01Å; S1092-Q1095 VanDerWaalsContact O-N 3.14Å; S1092-F1096 PolarHBondContact O-N 3.1Å; S1092-D1128 WeakPolarHBondContact CA-OD1 3.36Å; S1092-D1128 WeakPolarHBondContact CB-OD1 3.28Å
1093	V	85.7	Confident	78.5	Confident	18 Å²	18	65.7 Å²	65.7	11%	0.109	37%	0.369	C	S	.	.	H	α-helix	trans	-52.9	-41.2	174.4	175.5	0	0	0	0	110.9	Q1095 F1096 R1097 I1125 N1127 D1128 Y1131	V1093-Q1095 VanDerWaalsContact C-N 3.33Å; V1093-Q1095 PolarHBondContact O-N 3.45Å; V1093-F1096 CarbonylContact O-C 3.52Å; V1093-F1096 PolarHBondContact O-N 3.29Å; V1093-F1096 VanDerWaalsContact O-N 3.15Å; V1093-R1097 WeakPolarHBondContact O-CB 3.47Å; V1093-R1097 PolarHBondContact O-N 2.87Å; V1093-I1125 HydrophobicContact CG1-CG2 4.43Å; V1093-I1125 HydrophobicContact CG2-CG2 4.26Å; V1093-N1127 VanDerWaalsContact CG2-O 3.31Å; V1093-N1127 WeakPolarHBondContact CG2-O 3.46Å; V1093-D1128 HydrophobicContact CG2-CB 4.48Å; V1093-D1128 WeakPolarHBondContact CG2-OD1 3.29Å; V1093-D1128 PolarHBondContact N-OD1 2.88Å; V1093-Y1131 HydrophobicContact CG2-CG 4.23Å
1094	E	84.5	Confident	78.5	Confident	98 Å²	98	64 Å²	64	46%	0.458	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-35.4	-176.3	-177.6	56.3	-162.3	0	0	111.8	S1092 K1098	S1092-E1094 PolarHBondContact O-N 3.11Å; E1094-K1098 WeakPolarHBondContact O-CB 3.49Å; E1094-K1098 WeakPolarHBondContact O-CG 3.31Å; E1094-K1098 PolarHBondContact O-N 3.01Å; E1094-K1098 VanDerWaalsContact O-N 3.1Å; E1094-K1098 WeakPolarHBondContact OE1-CE 3.39Å; E1094-K1098 IonicContact OE1-NZ 3.89Å; E1094-K1098 PolarHBondContact OE1-NZ 3.37Å
1095	Q	84.7	Confident	78.5	Confident	105 Å²	105	64.7 Å²	64.7	49%	0.491	35%	0.352	S	S	.	.	H	α-helix	trans	-69	-40.5	170.6	-66.5	176.9	-6.5	0	0	111.4	V1090 S1092 V1093 K1098 L1099	V1090-Q1095 HydrophobicContact CG1-CB 3.8Å; S1092-Q1095 PolarHBondContact O-N 3.01Å; S1092-Q1095 VanDerWaalsContact O-N 3.14Å; V1093-Q1095 VanDerWaalsContact C-N 3.33Å; V1093-Q1095 PolarHBondContact O-N 3.45Å; Q1095-K1098 PolarHBondContact O-N 2.79Å; Q1095-L1099 WeakPolarHBondContact O-CB 3.47Å; Q1095-L1099 PolarHBondContact O-N 2.84Å
1096	F	87.8	Confident	78.6	Confident	7 Å²	7	63.7 Å²	63.7	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-42.7	178.3	-171.1	-117.9	0	0	0	112.6	V1090 S1092 V1093 K1098 L1099 V1100 L1113 I1125 Y1131 L1144	V1090-F1096 HydrophobicContact CG1-CB 3.66Å; V1090-F1096 HydrophobicContact CG1-CD2 4.18Å; V1090-F1096 HydrophobicContact CG1-CG 4.42Å; V1090-F1096 VanDerWaalsContact CG1-N 3.35Å; S1092-F1096 PolarHBondContact O-N 3.1Å; V1093-F1096 CarbonylContact O-C 3.52Å; V1093-F1096 PolarHBondContact O-N 3.29Å; V1093-F1096 VanDerWaalsContact O-N 3.15Å; F1096-K1098 VanDerWaalsContact C-N 3.35Å; F1096-L1099 WeakPolarHBondContact O-CB 3.13Å; F1096-L1099 PolarHBondContact O-N 3.48Å; F1096-V1100 HydrophobicContact CD1-CG2 4.48Å; F1096-V1100 HydrophobicContact CE1-CG2 4.27Å; F1096-V1100 HydrophobicContact CE2-CG2 4.4Å; F1096-V1100 HydrophobicContact CZ-CG2 4.24Å; F1096-V1100 WeakPolarHBondContact O-CG2 3.34Å; F1096-V1100 PolarHBondContact O-N 2.95Å; F1096-L1113 HydrophobicContact CD1-CD1 4.13Å; F1096-L1113 HydrophobicContact CE1-CD1 4.34Å; F1096-L1113 HydrophobicContact CE1-CD2 4.48Å; F1096-I1125 HydrophobicContact CE1-CD1 4.08Å; F1096-Y1131 HydrophobicContact CB-CD2 4.45Å; F1096-Y1131 HydrophobicContact CB-CE1 4.22Å; F1096-Y1131 HydrophobicContact CB-CE2 3.84Å; F1096-Y1131 AromaticContact CD1-CD2 3.8Å; F1096-Y1131 HydrophobicContact CD1-CD2 3.8Å; F1096-Y1131 AromaticContact CD1-CE2 3.38Å; F1096-Y1131 HydrophobicContact CD1-CE2 3.38Å; F1096-Y1131 AromaticContact CD2-CE2 3.58Å; F1096-Y1131 HydrophobicContact CD2-CE2 3.58Å; F1096-Y1131 AromaticContact CD2-CZ 3.66Å; F1096-Y1131 WeakPolarHBondContact CD2-OH 3.42Å; F1096-Y1131 HydrophobicContact CE1-CD2 4.13Å; F1096-Y1131 AromaticContact CE1-CE2 3.67Å; F1096-Y1131 HydrophobicContact CE1-CE2 3.67Å; F1096-Y1131 AromaticContact CE2-CE2 3.85Å; F1096-Y1131 HydrophobicContact CE2-CE2 3.85Å; F1096-Y1131 HydrophobicContact CG-CD2 4.1Å; F1096-Y1131 AromaticContact CG-CE2 3.31Å; F1096-Y1131 HydrophobicContact CG-CE2 3.31Å; F1096-Y1131 AromaticContact CG-CZ 3.57Å; F1096-Y1131 AromaticContact CZ-CE2 3.88Å; F1096-Y1131 HydrophobicContact CZ-CE2 3.88Å; F1096-L1144 HydrophobicContact CE1-CD1 4.18Å; F1096-L1144 HydrophobicContact CE1-CD2 4.06Å; F1096-L1144 HydrophobicContact CZ-CD1 3.67Å; F1096-L1144 HydrophobicContact CZ-CD2 4.1Å
1097	R	87.4	Confident	78.8	Confident	71 Å²	71	66 Å²	66	27%	0.268	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-41.1	176.4	-174.2	178.2	176.6	81.1	10.9	110.7	V1093 G1101 F1111 L1113	V1093-R1097 WeakPolarHBondContact O-CB 3.47Å; V1093-R1097 PolarHBondContact O-N 2.87Å; R1097-G1101 PolarHBondContact O-N 3.35Å; R1097-F1111 HydrophobicContact CG-CE2 3.83Å; R1097-F1111 HydrophobicContact CG-CZ 3.62Å; R1097-F1111 VanDerWaalsContact CZ-O 3.28Å; R1097-F1111 PolarHBondContact NH1-O 3.36Å; R1097-F1111 PolarHBondContact NH2-O 3.34Å; R1097-L1113 HydrophobicContact CB-CD1 4.41Å
1098	K	85.5	Confident	79.1	Confident	132 Å²	132	63.9 Å²	63.9	57%	0.574	35%	0.353	S	S	*	.	H	α-helix	trans	-67.8	-40.5	171.9	-78.1	173.1	170.6	149.9	0	112.8	E1094 Q1095 F1096 G1101 G1102	E1094-K1098 WeakPolarHBondContact O-CB 3.49Å; E1094-K1098 WeakPolarHBondContact O-CG 3.31Å; E1094-K1098 PolarHBondContact O-N 3.01Å; E1094-K1098 VanDerWaalsContact O-N 3.1Å; E1094-K1098 WeakPolarHBondContact OE1-CE 3.39Å; E1094-K1098 IonicContact OE1-NZ 3.89Å; E1094-K1098 PolarHBondContact OE1-NZ 3.37Å; Q1095-K1098 PolarHBondContact O-N 2.79Å; F1096-K1098 VanDerWaalsContact C-N 3.35Å; K1098-G1101 PolarHBondContact O-N 3.21Å; K1098-G1102 PolarHBondContact O-N 2.04Å
1099	L	85.8	Confident	79.2	Confident	67 Å²	67	60 Å²	60	35%	0.351	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-47.3	175	-179.2	64.4	0	0	0	111.9	V1085 V1090 Q1095 F1096 L1103	V1085-L1099 HydrophobicContact CB-CD2 4.36Å; V1085-L1099 HydrophobicContact CG1-CD2 3.6Å; V1085-L1099 HydrophobicContact CG2-CD2 3.76Å; V1090-L1099 HydrophobicContact CG2-CD2 3.83Å; Q1095-L1099 WeakPolarHBondContact O-CB 3.47Å; Q1095-L1099 PolarHBondContact O-N 2.84Å; F1096-L1099 WeakPolarHBondContact O-CB 3.13Å; F1096-L1099 PolarHBondContact O-N 3.48Å; L1099-L1103 WeakPolarHBondContact O-CB 3.47Å; L1099-L1103 PolarHBondContact O-N 3.36Å
1100	V	86.2	Confident	79.7	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-42.4	176	174.4	0	0	0	0	111	F1083 F1096 G1102 L1103 H1104 L1113 L1146	F1083-V1100 HydrophobicContact CZ-CG2 4.11Å; F1096-V1100 HydrophobicContact CD1-CG2 4.48Å; F1096-V1100 HydrophobicContact CE1-CG2 4.27Å; F1096-V1100 HydrophobicContact CE2-CG2 4.4Å; F1096-V1100 HydrophobicContact CZ-CG2 4.24Å; F1096-V1100 WeakPolarHBondContact O-CG2 3.34Å; F1096-V1100 PolarHBondContact O-N 2.95Å; V1100-G1102 PolarHBondContact O-N 2.79Å; V1100-L1103 PolarHBondContact O-N 2.81Å; V1100-H1104 WeakPolarHBondContact O-CB 3.47Å; V1100-H1104 PolarHBondContact O-CD2 3.45Å; V1100-H1104 PolarHBondContact O-N 3.26Å; V1100-L1113 HydrophobicContact CB-CD1 4.49Å; V1100-L1113 HydrophobicContact CG1-CD2 4.41Å; V1100-L1113 HydrophobicContact CG2-CD1 4.48Å; V1100-L1146 HydrophobicContact CG1-CD1 3.63Å; V1100-L1146 HydrophobicContact CG1-CD2 3.79Å; V1100-L1146 HydrophobicContact CG1-CG 4.38Å
1101	G	82.5	Confident	80.5	Confident	2 Å²	2	59.1 Å²	59.1	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-56.2	-50.1	176.7	0	0	0	0	0	112.7	R1097 K1098 H1105 V1106	R1097-G1101 PolarHBondContact O-N 3.35Å; K1098-G1101 PolarHBondContact O-N 3.21Å; G1101-H1105 CarbonylContact O-C 3.48Å; G1101-H1105 WeakPolarHBondContact O-CA 3.44Å; G1101-H1105 PolarHBondContact O-N 2.87Å; G1101-V1106 PolarHBondContact O-N 3.27Å
1102	G	82.1	Confident	80.9	Confident	22 Å²	22	57.4 Å²	57.4	23%	0.227	29%	0.29	C	S	.	.	H	α-helix	trans	-69.3	-36.3	177.4	0	0	0	0	0	113.8	K1098 V1100 H1104 H1105 E1107	K1098-G1102 PolarHBondContact O-N 2.04Å; V1100-G1102 PolarHBondContact O-N 2.79Å; G1102-H1104 VanDerWaalsContact C-N 3.34Å; G1102-H1104 PolarHBondContact O-N 2.83Å; G1102-H1105 PolarHBondContact O-CE1 3.4Å; G1102-H1105 PolarHBondContact O-N 2.84Å; G1102-H1105 PolarHBondContact O-ND1 3.31Å; G1102-E1107 WeakPolarHBondContact CA-OE1 3.35Å; G1102-E1107 PolarHBondContact N-OE1 2.85Å
1103	L	79.6	Confident	81.1	Confident	65 Å²	65	56.3 Å²	56.3	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-74.1	-22.5	-180	-169.1	142.8	0	0	0	113.5	F1083 L1099 V1100	F1083-L1103 HydrophobicContact CB-CD1 3.89Å; F1083-L1103 HydrophobicContact CB-CD2 4.06Å; F1083-L1103 HydrophobicContact CD1-CD2 3.58Å; F1083-L1103 HydrophobicContact CD2-CD1 3.89Å; F1083-L1103 HydrophobicContact CD2-CD2 4.28Å; F1083-L1103 HydrophobicContact CE1-CD2 4.04Å; F1083-L1103 HydrophobicContact CG-CD1 3.89Å; F1083-L1103 HydrophobicContact CG-CD2 3.72Å; L1099-L1103 WeakPolarHBondContact O-CB 3.47Å; L1099-L1103 PolarHBondContact O-N 3.36Å; V1100-L1103 PolarHBondContact O-N 2.81Å
1104	H	74.9	Confident	81.1	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.139	28%	0.282	C	S	.	.	H	α-helix	trans	-106.6	-1.7	174	-71.4	-107	0	0	0	113.8	F1083 V1100 G1102 V1106 L1146	F1083-H1104 AromaticContact CE1-NE2 3.69Å; V1100-H1104 WeakPolarHBondContact O-CB 3.47Å; V1100-H1104 PolarHBondContact O-CD2 3.45Å; V1100-H1104 PolarHBondContact O-N 3.26Å; G1102-H1104 VanDerWaalsContact C-N 3.34Å; G1102-H1104 PolarHBondContact O-N 2.83Å; H1104-V1106 VanDerWaalsContact C-N 3.34Å; H1104-V1106 HydrophobicContact CB-CG1 4.4Å; H1104-V1106 HydrophobicContact CB-CG2 4.06Å; H1104-V1106 PolarHBondContact O-N 2.96Å; H1104-L1146 HydrophobicContact CB-CD2 4.05Å
1105	H	73.4	Confident	81.2	Confident	136 Å²	136	52 Å²	52	63%	0.63	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	42.8	-174.7	-56.1	-37.9	0	0	0	114.2	G1101 G1102	G1101-H1105 CarbonylContact O-C 3.48Å; G1101-H1105 WeakPolarHBondContact O-CA 3.44Å; G1101-H1105 PolarHBondContact O-N 2.87Å; G1102-H1105 PolarHBondContact O-CE1 3.4Å; G1102-H1105 PolarHBondContact O-N 2.84Å; G1102-H1105 PolarHBondContact O-ND1 3.31Å
1106	V	75	Confident	81.1	Confident	31 Å²	31	49 Å²	49	19%	0.188	25%	0.253	C	S	.	.			trans	-114.6	26	179	-63.3	0	0	0	0	112.8	G1101 H1104 D1108 I1109 F1111 L1146	G1101-V1106 PolarHBondContact O-N 3.27Å; H1104-V1106 VanDerWaalsContact C-N 3.34Å; H1104-V1106 HydrophobicContact CB-CG1 4.4Å; H1104-V1106 HydrophobicContact CB-CG2 4.06Å; H1104-V1106 PolarHBondContact O-N 2.96Å; V1106-D1108 VanDerWaalsContact C-N 3.29Å; V1106-D1108 PolarHBondContact O-N 3.02Å; V1106-I1109 HydrophobicContact CB-CB 4.4Å; V1106-I1109 PolarHBondContact O-N 3.4Å; V1106-F1111 HydrophobicContact CB-CD1 4.22Å; V1106-F1111 HydrophobicContact CG2-CD1 3.61Å; V1106-F1111 HydrophobicContact CG2-CE1 3.66Å; V1106-F1111 HydrophobicContact CG2-CG 4.41Å; V1106-F1111 HydrophobicContact CG2-CZ 4.47Å; V1106-L1146 HydrophobicContact CG2-CD2 4.14Å
1107	E	76.9	Confident	80.8	Confident	144 Å²	144	50.2 Å²	50.2	67%	0.673	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.7	-179.7	-60.2	-174.1	172.2	0	0	112.7	G1102 I1109	G1102-E1107 WeakPolarHBondContact CA-OE1 3.35Å; G1102-E1107 PolarHBondContact N-OE1 2.85Å; E1107-I1109 VanDerWaalsContact C-N 3.34Å; E1107-I1109 PolarHBondContact O-N 2.8Å
1108	D	76.3	Confident	80.4	Confident	101 Å²	101	51.5 Å²	51.5	54%	0.54	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.6	178.9	-55.1	-53.7	0	0	0	114.5	T267 V1106	T267-D1108 PolarHBondContact OG1-O 2.91Å; V1106-D1108 VanDerWaalsContact C-N 3.29Å; V1106-D1108 PolarHBondContact O-N 3.02Å
1109	I	72.3	Confident	80	Confident	48 Å²	48	53.1 Å²	53.1	25%	0.246	29%	0.286	C	S	.	.	S	Bend	trans	-115.7	126.5	-167.4	-57.4	179.2	0	0	0	110.1	V1106 E1107 F1111 R1148	V1106-I1109 HydrophobicContact CB-CB 4.4Å; V1106-I1109 PolarHBondContact O-N 3.4Å; E1107-I1109 VanDerWaalsContact C-N 3.34Å; E1107-I1109 PolarHBondContact O-N 2.8Å; I1109-F1111 VanDerWaalsContact O-CD1 3.31Å; I1109-F1111 WeakPolarHBondContact O-CD1 3.4Å; I1109-F1111 PolarHBondContact O-N 2.99Å; I1109-R1148 HydrophobicContact CG2-CG 3.79Å
1110	P	75.9	Confident	79.3	Confident	48 Å²	48	52.7 Å²	52.7	31%	0.312	30%	0.298	S	S	.	.			trans	-68.4	117	174.1	28	-33.6	0	0	0	110.9	K1149	P1110-K1149 HydrophobicContact CB-CB 4Å; P1110-K1149 HydrophobicContact CG-CB 4.37Å; P1110-K1149 WeakPolarHBondContact O-CB 3.47Å; P1110-K1149 PolarHBondContact O-N 3.09Å
1111	F	81.3	Confident	78.7	Confident	15 Å²	15	57.5 Å²	57.5	7%	0.066	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.9	176.4	63.4	-97	0	0	0	112.8	R1097 V1106 I1109 L1113 L1146 Q1147	R1097-F1111 HydrophobicContact CG-CE2 3.83Å; R1097-F1111 HydrophobicContact CG-CZ 3.62Å; R1097-F1111 VanDerWaalsContact CZ-O 3.28Å; R1097-F1111 PolarHBondContact NH1-O 3.36Å; R1097-F1111 PolarHBondContact NH2-O 3.34Å; V1106-F1111 HydrophobicContact CB-CD1 4.22Å; V1106-F1111 HydrophobicContact CG2-CD1 3.61Å; V1106-F1111 HydrophobicContact CG2-CE1 3.66Å; V1106-F1111 HydrophobicContact CG2-CG 4.41Å; V1106-F1111 HydrophobicContact CG2-CZ 4.47Å; I1109-F1111 VanDerWaalsContact O-CD1 3.31Å; I1109-F1111 WeakPolarHBondContact O-CD1 3.4Å; I1109-F1111 PolarHBondContact O-N 2.99Å; F1111-L1113 HydrophobicContact CD2-CG 4.31Å; F1111-L1113 HydrophobicContact CE2-CD1 3.96Å; F1111-L1113 HydrophobicContact CE2-CG 3.98Å; F1111-L1146 HydrophobicContact CD2-CD1 3.36Å; F1111-L1146 HydrophobicContact CD2-CG 4.17Å; F1111-L1146 HydrophobicContact CE2-CD1 3.68Å; F1111-L1146 HydrophobicContact CG-CD1 4.08Å; F1111-L1146 HydrophobicContact CG-CG 4.43Å; F1111-Q1147 CarbonylContact C-O 3.32Å; F1111-Q1147 WeakPolarHBondContact CA-O 3.49Å; F1111-Q1147 VanDerWaalsContact CB-O 3.3Å; F1111-Q1147 WeakPolarHBondContact CB-O 3.43Å
1112	T	79.1	Confident	78.5	Confident	34 Å²	34	61.3 Å²	61.3	21%	0.209	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142.2	165.6	37.6	0	0	0	0	110.1	Q1147	T1112-Q1147 PolarHBondContact N-O 3.09Å; T1112-Q1147 PolarHBondContact O-N 2.55Å; T1112-Q1147 VanDerWaalsContact O-N 3.14Å; T1112-Q1147 PolarHBondContact OG1-O 3.42Å
1113	L	86	Confident	78.4	Confident	6 Å²	6	63.1 Å²	63.1	3%	0.031	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.7	176.3	-107	170.4	0	0	0	107.8	F1096 R1097 V1100 F1111 I1125 L1144 L1146	F1096-L1113 HydrophobicContact CD1-CD1 4.13Å; F1096-L1113 HydrophobicContact CE1-CD1 4.34Å; F1096-L1113 HydrophobicContact CE1-CD2 4.48Å; R1097-L1113 HydrophobicContact CB-CD1 4.41Å; V1100-L1113 HydrophobicContact CB-CD1 4.49Å; V1100-L1113 HydrophobicContact CG1-CD2 4.41Å; V1100-L1113 HydrophobicContact CG2-CD1 4.48Å; F1111-L1113 HydrophobicContact CD2-CG 4.31Å; F1111-L1113 HydrophobicContact CE2-CD1 3.96Å; F1111-L1113 HydrophobicContact CE2-CG 3.98Å; L1113-I1125 HydrophobicContact CB-CB 4.21Å; L1113-I1125 PolarHBondContact O-N 3.1Å; L1113-L1144 HydrophobicContact CD2-CB 4.42Å; L1113-L1144 HydrophobicContact CD2-CD2 4.27Å; L1113-L1146 HydrophobicContact CD2-CD1 3.71Å; L1113-L1146 HydrophobicContact CG-CD1 3.68Å
1114	C	86.7	Confident	78.5	Confident	17 Å²	17	61.3 Å²	61.3	12%	0.115	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159.7	173.9	-57.3	0	0	0	0	110.5	L1122 L1123 L1144 L1145	C1114-L1122 HydrophobicContact CB-CD1 3.68Å; C1114-L1122 HydrophobicContact CB-CD2 4.3Å; C1114-L1122 HydrophobicContact CB-CG 3.76Å; C1114-L1123 CarbonylContact C-O 3.53Å; C1114-L1123 VanDerWaalsContact CA-O 3.23Å; C1114-L1123 WeakPolarHBondContact CA-O 3.41Å; C1114-L1123 WeakPolarHBondContact CB-O 3.36Å; C1114-L1144 CarbonylContact O-C 3.58Å; C1114-L1144 VanDerWaalsContact O-CA 3.32Å; C1114-L1144 WeakPolarHBondContact O-CA 3.16Å; C1114-L1145 HydrophobicContact CB-CB 4.37Å; C1114-L1145 PolarHBondContact N-O 3.06Å; C1114-L1145 PolarHBondContact O-N 3.45Å
1115	Y	86.7	Confident	79	Confident	8 Å²	8	60.2 Å²	60.2	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.9	168.8	68	-77.5	0	0	0	111	D1117 L1122 L1123 I1125 A1134 S1137 L1142 R1143	Y1115-D1117 HydrophobicContact CE2-CB 4.41Å; Y1115-L1122 CarbonylContact O-C 3.47Å; Y1115-L1122 WeakPolarHBondContact O-CA 3.16Å; Y1115-L1123 HydrophobicContact CD1-CB 4.05Å; Y1115-L1123 WeakPolarHBondContact CD1-O 3.4Å; Y1115-L1123 HydrophobicContact CE1-CB 3.59Å; Y1115-L1123 HydrophobicContact CE2-CB 4.27Å; Y1115-L1123 HydrophobicContact CE2-CD1 4.1Å; Y1115-L1123 PolarHBondContact N-O 2.84Å; Y1115-L1123 PolarHBondContact O-N 2.87Å; Y1115-I1125 HydrophobicContact CD1-CD1 4.18Å; Y1115-I1125 HydrophobicContact CD1-CG1 3.66Å; Y1115-I1125 HydrophobicContact CE1-CG1 4.33Å; Y1115-A1134 HydrophobicContact CD1-CB 3.55Å; Y1115-A1134 HydrophobicContact CD2-CB 4.05Å; Y1115-A1134 HydrophobicContact CE1-CB 3.7Å; Y1115-A1134 HydrophobicContact CE2-CB 4.21Å; Y1115-A1134 HydrophobicContact CG-CB 3.72Å; Y1115-S1137 WeakPolarHBondContact CE2-OG 2.96Å; Y1115-L1142 HydrophobicContact CD2-CD1 4.26Å; Y1115-L1142 HydrophobicContact CG-CD1 4.21Å; Y1115-R1143 VanDerWaalsContact CA-O 3.26Å; Y1115-R1143 WeakPolarHBondContact CA-O 3.39Å
1116	S	82.6	Confident	79.4	Confident	43 Å²	43	55.3 Å²	55.3	30%	0.301	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	120.8	166.1	67.6	0	0	0	0	109.5	D1121 R1143	S1116-D1121 WeakPolarHBondContact CA-O 3.49Å; S1116-R1143 PolarHBondContact N-O 3.17Å; S1116-R1143 WeakPolarHBondContact OG-CB 3.35Å
1117	D	80.7	Confident	79.8	Confident	33 Å²	33	57 Å²	57	18%	0.176	32%	0.321	C	S	.	.			trans	-66.9	155.1	168	-172.2	80.1	0	0	0	111	Y1115 H1119 G1120 D1121 L1123	Y1115-D1117 HydrophobicContact CE2-CB 4.41Å; D1117-H1119 PolarHBondContact O-N 2.84Å; D1117-H1119 WeakPolarHBondContact OD2-CB 3.3Å; D1117-H1119 IonicContact OD2-CD2 3.87Å; D1117-H1119 PolarHBondContact OD2-CD2 2.87Å; D1117-H1119 IonicContact OD2-CG 2.79Å; D1117-H1119 PolarHBondContact OD2-N 2.8Å; D1117-G1120 PolarHBondContact O-N 3.05Å; D1117-D1121 PolarHBondContact N-O 2.78Å; D1117-L1123 HydrophobicContact CB-CD1 3.97Å; D1117-L1123 HydrophobicContact CB-CG 4.49Å
1118	P	78	Confident	80.2	Confident	98 Å²	98	54.5 Å²	54.5	64%	0.636	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-20	171.2	-31	38.1	0	0	0	115.9	G1120	P1118-G1120 VanDerWaalsContact C-N 3.3Å
1119	H	77.4	Confident	80.6	Confident	165 Å²	165	53.4 Å²	53.4	76%	0.764	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-10.4	171.2	-67.7	-58.9	0	0	0	114.6	D1117	D1117-H1119 PolarHBondContact O-N 2.84Å; D1117-H1119 WeakPolarHBondContact OD2-CB 3.3Å; D1117-H1119 IonicContact OD2-CD2 3.87Å; D1117-H1119 PolarHBondContact OD2-CD2 2.87Å; D1117-H1119 IonicContact OD2-CG 2.79Å; D1117-H1119 PolarHBondContact OD2-N 2.8Å
1120	G	71.4	Confident	81.2	Confident	59 Å²	59	52.4 Å²	52.4	61%	0.608	30%	0.299	S	S	*	.	S	Bend	trans	97	-11.2	-178.4	0	0	0	0	0	114.4	D1117 P1118	D1117-G1120 PolarHBondContact O-N 3.05Å; P1118-G1120 VanDerWaalsContact C-N 3.3Å
1121	D	73.9	Confident	81.7	Confident	103 Å²	103	50.8 Å²	50.8	55%	0.551	29%	0.287	S	S	*	.			trans	-66.1	139.3	176.7	-66.5	-40.1	0	0	0	111.6	S1116 D1117 L1123	S1116-D1121 WeakPolarHBondContact CA-O 3.49Å; D1117-D1121 PolarHBondContact N-O 2.78Å; D1121-L1123 HydrophobicContact CB-CD2 4.38Å; D1121-L1123 HydrophobicContact CB-CG 4.49Å
1122	L	77.6	Confident	82	Confident	81 Å²	81	55.4 Å²	55.4	42%	0.424	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.1	176.9	-173.7	72	0	0	0	109.5	C1114 Y1115 L1145	C1114-L1122 HydrophobicContact CB-CD1 3.68Å; C1114-L1122 HydrophobicContact CB-CD2 4.3Å; C1114-L1122 HydrophobicContact CB-CG 3.76Å; Y1115-L1122 CarbonylContact O-C 3.47Å; Y1115-L1122 WeakPolarHBondContact O-CA 3.16Å; L1122-L1145 HydrophobicContact CD1-CB 4Å; L1122-L1145 HydrophobicContact CD1-CD2 4.2Å; L1122-L1145 HydrophobicContact CD2-CD2 3.69Å
1123	L	80.8	Confident	82.3	Confident	61 Å²	61	58.1 Å²	58.1	32%	0.319	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.9	-172	-61.7	-179	0	0	0	112.2	C1114 Y1115 D1117 D1121	C1114-L1123 CarbonylContact C-O 3.53Å; C1114-L1123 VanDerWaalsContact CA-O 3.23Å; C1114-L1123 WeakPolarHBondContact CA-O 3.41Å; C1114-L1123 WeakPolarHBondContact CB-O 3.36Å; Y1115-L1123 HydrophobicContact CD1-CB 4.05Å; Y1115-L1123 WeakPolarHBondContact CD1-O 3.4Å; Y1115-L1123 HydrophobicContact CE1-CB 3.59Å; Y1115-L1123 HydrophobicContact CE2-CB 4.27Å; Y1115-L1123 HydrophobicContact CE2-CD1 4.1Å; Y1115-L1123 PolarHBondContact N-O 2.84Å; Y1115-L1123 PolarHBondContact O-N 2.87Å; D1117-L1123 HydrophobicContact CB-CD1 3.97Å; D1117-L1123 HydrophobicContact CB-CG 4.49Å; D1121-L1123 HydrophobicContact CB-CD2 4.38Å; D1121-L1123 HydrophobicContact CB-CG 4.49Å
1124	P	82.5	Confident	82.3	Confident	26 Å²	26	57.8 Å²	57.8	17%	0.169	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133.1	-176.2	29.1	-34.5	0	0	0	113.4	N1126 N1130	P1124-N1126 VanDerWaalsContact C-N 3.26Å; P1124-N1126 HydrophobicContact CB-CB 4.45Å; P1124-N1126 PolarHBondContact O-N 2.85Å; P1124-N1126 VanDerWaalsContact O-N 3.1Å; P1124-N1130 WeakPolarHBondContact O-CB 3.28Å; P1124-N1130 PolarHBondContact O-ND2 2.82Å
1125	I	85.6	Confident	82.3	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.041	32%	0.316	C	S	.	.			trans	-85.4	69.4	169.9	-50.1	-179.3	0	0	0	108.5	V1093 F1096 L1113 Y1115 Y1131 A1134 L1144	V1093-I1125 HydrophobicContact CG1-CG2 4.43Å; V1093-I1125 HydrophobicContact CG2-CG2 4.26Å; F1096-I1125 HydrophobicContact CE1-CD1 4.08Å; L1113-I1125 HydrophobicContact CB-CB 4.21Å; L1113-I1125 PolarHBondContact O-N 3.1Å; Y1115-I1125 HydrophobicContact CD1-CD1 4.18Å; Y1115-I1125 HydrophobicContact CD1-CG1 3.66Å; Y1115-I1125 HydrophobicContact CE1-CG1 4.33Å; I1125-Y1131 HydrophobicContact CG2-CD2 4.01Å; I1125-Y1131 HydrophobicContact CG2-CG 4.27Å; I1125-A1134 HydrophobicContact CD1-CB 4.06Å; I1125-A1134 HydrophobicContact CG1-CB 4.34Å; I1125-L1144 HydrophobicContact CD1-CD2 3.67Å
1126	N	81.6	Confident	82.2	Confident	33 Å²	33	62.5 Å²	62.5	18%	0.176	34%	0.336	C	S	.	.			trans	-99.3	-8.3	-176.3	64.2	12.6	0	0	0	114.2	P1124 N1130 I1189 M1191	P1124-N1126 VanDerWaalsContact C-N 3.26Å; P1124-N1126 HydrophobicContact CB-CB 4.45Å; P1124-N1126 PolarHBondContact O-N 2.85Å; P1124-N1126 VanDerWaalsContact O-N 3.1Å; N1126-N1130 PolarHBondContact OD1-ND2 3.35Å; N1126-I1189 PolarHBondContact ND2-O 2.93Å; N1126-M1191 HydrophobicContact CB-SD 3.63Å
1127	N	82.6	Confident	82.2	Confident	65 Å²	65	61.5 Å²	61.5	35%	0.348	33%	0.328	S	S	.	.	S	Bend	trans	-155.4	162.7	180	74.3	76.5	0	0	0	111.7	V1093 E1129 N1130 Y1131	V1093-N1127 VanDerWaalsContact CG2-O 3.31Å; V1093-N1127 WeakPolarHBondContact CG2-O 3.46Å; N1127-E1129 VanDerWaalsContact C-N 3.29Å; N1127-E1129 PolarHBondContact O-N 3.43Å; N1127-E1129 WeakPolarHBondContact OD1-CA 3.24Å; N1127-E1129 WeakPolarHBondContact OD1-CB 3.01Å; N1127-E1129 PolarHBondContact OD1-N 2.74Å; N1127-N1130 PolarHBondContact ND2-OD1 2.72Å; N1127-N1130 PolarHBondContact O-N 2.81Å; N1127-N1130 PolarHBondContact OD1-N 2.8Å; N1127-Y1131 PolarHBondContact O-N 2.77Å
1128	D	85.8	Confident	82.1	Confident	92 Å²	92	60.2 Å²	60.2	49%	0.492	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-31.6	-172.6	-71.6	-43.6	0	0	0	113.7	S1092 V1093 Y1131 R1132	S1092-D1128 WeakPolarHBondContact CA-OD1 3.36Å; S1092-D1128 WeakPolarHBondContact CB-OD1 3.28Å; V1093-D1128 HydrophobicContact CG2-CB 4.48Å; V1093-D1128 WeakPolarHBondContact CG2-OD1 3.29Å; V1093-D1128 PolarHBondContact N-OD1 2.88Å; D1128-Y1131 PolarHBondContact O-N 3.07Å; D1128-R1132 WeakPolarHBondContact O-CB 3.37Å; D1128-R1132 PolarHBondContact O-N 3.17Å
1129	E	83.6	Confident	81.8	Confident	79 Å²	79	63.1 Å²	63.1	37%	0.369	33%	0.327	S	S	.	.	H	α-helix	trans	-73.6	-33.2	175.9	175.8	59.8	-162.9	0	0	111.7	N1127 R1132 K1133	N1127-E1129 VanDerWaalsContact C-N 3.29Å; N1127-E1129 PolarHBondContact O-N 3.43Å; N1127-E1129 WeakPolarHBondContact OD1-CA 3.24Å; N1127-E1129 WeakPolarHBondContact OD1-CB 3.01Å; N1127-E1129 PolarHBondContact OD1-N 2.74Å; E1129-R1132 IonicContact OE1-CZ 3.76Å; E1129-R1132 IonicContact OE1-NE 3.26Å; E1129-R1132 IonicContact OE1-NH2 3.43Å; E1129-R1132 PolarHBondContact OE1-NH2 3.03Å; E1129-R1132 IonicContact OE2-CZ 2.87Å; E1129-R1132 IonicContact OE2-NE 3.31Å; E1129-R1132 PolarHBondContact OE2-NE 3.08Å; E1129-R1132 IonicContact OE2-NH2 2.82Å; E1129-R1132 PolarHBondContact OE2-NH2 2.65Å; E1129-K1133 VanDerWaalsContact O-CG 3.29Å; E1129-K1133 WeakPolarHBondContact O-CG 3.35Å; E1129-K1133 PolarHBondContact O-N 2.85Å; E1129-K1133 WeakPolarHBondContact OE1-CE 3.33Å; E1129-K1133 IonicContact OE1-NZ 2.61Å
1130	N	84.7	Confident	81.4	Confident	27 Å²	27	61.2 Å²	61.2	14%	0.144	33%	0.329	C	S	.	.	H	α-helix	trans	-70.3	-35.2	170.6	-79	22.7	0	0	0	112	P1124 N1126 N1127 K1133 A1134	P1124-N1130 WeakPolarHBondContact O-CB 3.28Å; P1124-N1130 PolarHBondContact O-ND2 2.82Å; N1126-N1130 PolarHBondContact OD1-ND2 3.35Å; N1127-N1130 PolarHBondContact ND2-OD1 2.72Å; N1127-N1130 PolarHBondContact O-N 2.81Å; N1127-N1130 PolarHBondContact OD1-N 2.8Å; N1130-K1133 PolarHBondContact O-N 2.78Å; N1130-A1134 WeakPolarHBondContact O-CB 3.31Å; N1130-A1134 PolarHBondContact O-N 3.49Å
1131	Y	88.1	Confident	81.5	Confident	13 Å²	13	63.6 Å²	63.6	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-43.3	171.7	179.3	-127.8	0	0	0	112	V1090 V1093 F1096 I1125 N1127 D1128 K1133 A1134 L1135	V1090-Y1131 HydrophobicContact CG1-CE1 4.34Å; V1090-Y1131 WeakPolarHBondContact CG1-OH 3.35Å; V1093-Y1131 HydrophobicContact CG2-CG 4.23Å; F1096-Y1131 HydrophobicContact CB-CD2 4.45Å; F1096-Y1131 HydrophobicContact CB-CE1 4.22Å; F1096-Y1131 HydrophobicContact CB-CE2 3.84Å; F1096-Y1131 AromaticContact CD1-CD2 3.8Å; F1096-Y1131 HydrophobicContact CD1-CD2 3.8Å; F1096-Y1131 AromaticContact CD1-CE2 3.38Å; F1096-Y1131 HydrophobicContact CD1-CE2 3.38Å; F1096-Y1131 AromaticContact CD2-CE2 3.58Å; F1096-Y1131 HydrophobicContact CD2-CE2 3.58Å; F1096-Y1131 AromaticContact CD2-CZ 3.66Å; F1096-Y1131 WeakPolarHBondContact CD2-OH 3.42Å; F1096-Y1131 HydrophobicContact CE1-CD2 4.13Å; F1096-Y1131 AromaticContact CE1-CE2 3.67Å; F1096-Y1131 HydrophobicContact CE1-CE2 3.67Å; F1096-Y1131 AromaticContact CE2-CE2 3.85Å; F1096-Y1131 HydrophobicContact CE2-CE2 3.85Å; F1096-Y1131 HydrophobicContact CG-CD2 4.1Å; F1096-Y1131 AromaticContact CG-CE2 3.31Å; F1096-Y1131 HydrophobicContact CG-CE2 3.31Å; F1096-Y1131 AromaticContact CG-CZ 3.57Å; F1096-Y1131 AromaticContact CZ-CE2 3.88Å; F1096-Y1131 HydrophobicContact CZ-CE2 3.88Å; I1125-Y1131 HydrophobicContact CG2-CD2 4.01Å; I1125-Y1131 HydrophobicContact CG2-CG 4.27Å; N1127-Y1131 PolarHBondContact O-N 2.77Å; D1128-Y1131 PolarHBondContact O-N 3.07Å; Y1131-K1133 VanDerWaalsContact C-N 3.35Å; Y1131-K1133 PolarHBondContact O-N 2.67Å; Y1131-A1134 WeakPolarHBondContact O-CB 3.39Å; Y1131-A1134 PolarHBondContact O-N 3.15Å; Y1131-A1134 VanDerWaalsContact O-N 3.15Å; Y1131-L1135 HydrophobicContact CD1-CD1 4.3Å; Y1131-L1135 HydrophobicContact CD2-CG 4.41Å; Y1131-L1135 HydrophobicContact CE1-CD1 3.82Å; Y1131-L1135 HydrophobicContact CE2-CD1 4.12Å; Y1131-L1135 HydrophobicContact CE2-CD2 4.16Å; Y1131-L1135 HydrophobicContact CE2-CG 4.04Å; Y1131-L1135 WeakPolarHBondContact O-CG 3.41Å; Y1131-L1135 PolarHBondContact O-N 3.41Å
1132	R	85.8	Confident	81.9	Confident	112 Å²	112	60.8 Å²	60.8	42%	0.423	31%	0.312	S	S	.	.	H	α-helix	trans	-58	-45.9	174.2	-160	-168.8	64.9	61.6	12.5	111.3	D1128 E1129 A1134 L1135 D1136	D1128-R1132 WeakPolarHBondContact O-CB 3.37Å; D1128-R1132 PolarHBondContact O-N 3.17Å; E1129-R1132 IonicContact OE1-CZ 3.76Å; E1129-R1132 IonicContact OE1-NE 3.26Å; E1129-R1132 IonicContact OE1-NH2 3.43Å; E1129-R1132 PolarHBondContact OE1-NH2 3.03Å; E1129-R1132 IonicContact OE2-CZ 2.87Å; E1129-R1132 IonicContact OE2-NE 3.31Å; E1129-R1132 PolarHBondContact OE2-NE 3.08Å; E1129-R1132 IonicContact OE2-NH2 2.82Å; E1129-R1132 PolarHBondContact OE2-NH2 2.65Å; R1132-A1134 PolarHBondContact O-N 3.44Å; R1132-L1135 PolarHBondContact O-N 3.47Å; R1132-D1136 IonicContact CZ-OD2 2.69Å; R1132-D1136 IonicContact NH1-OD1 2.76Å; R1132-D1136 IonicContact NH1-OD2 3.19Å; R1132-D1136 PolarHBondContact NH1-OD2 2.98Å; R1132-D1136 IonicContact NH2-OD2 2.79Å; R1132-D1136 PolarHBondContact O-N 2.97Å
1133	K	85.6	Confident	82.2	Confident	91 Å²	91	66 Å²	66	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-39.3	173.5	-73.4	167.5	-176.5	165.3	0	113.3	E1129 N1130 Y1131 L1135 D1136 S1137	E1129-K1133 VanDerWaalsContact O-CG 3.29Å; E1129-K1133 WeakPolarHBondContact O-CG 3.35Å; E1129-K1133 PolarHBondContact O-N 2.85Å; E1129-K1133 WeakPolarHBondContact OE1-CE 3.33Å; E1129-K1133 IonicContact OE1-NZ 2.61Å; N1130-K1133 PolarHBondContact O-N 2.78Å; Y1131-K1133 VanDerWaalsContact C-N 3.35Å; Y1131-K1133 PolarHBondContact O-N 2.67Å; K1133-L1135 VanDerWaalsContact C-N 3.32Å; K1133-L1135 PolarHBondContact O-N 3.1Å; K1133-D1136 PolarHBondContact O-N 3.22Å; K1133-S1137 WeakPolarHBondContact O-CB 3.19Å; K1133-S1137 PolarHBondContact O-N 3.46Å; K1133-S1137 PolarHBondContact O-OG 2.86Å
1134	A	86.7	Confident	82.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-37.3	174.7	0	0	0	0	0	112.2	Y1115 I1125 N1130 Y1131 R1132 S1137 A1138 L1142	Y1115-A1134 HydrophobicContact CD1-CB 3.55Å; Y1115-A1134 HydrophobicContact CD2-CB 4.05Å; Y1115-A1134 HydrophobicContact CE1-CB 3.7Å; Y1115-A1134 HydrophobicContact CE2-CB 4.21Å; Y1115-A1134 HydrophobicContact CG-CB 3.72Å; I1125-A1134 HydrophobicContact CD1-CB 4.06Å; I1125-A1134 HydrophobicContact CG1-CB 4.34Å; N1130-A1134 WeakPolarHBondContact O-CB 3.31Å; N1130-A1134 PolarHBondContact O-N 3.49Å; Y1131-A1134 WeakPolarHBondContact O-CB 3.39Å; Y1131-A1134 PolarHBondContact O-N 3.15Å; Y1131-A1134 VanDerWaalsContact O-N 3.15Å; R1132-A1134 PolarHBondContact O-N 3.44Å; A1134-S1137 PolarHBondContact O-OG 2.96Å; A1134-A1138 WeakPolarHBondContact O-CB 3.41Å; A1134-A1138 PolarHBondContact O-N 2.92Å; A1134-L1142 HydrophobicContact CB-CD1 4.18Å; A1134-L1142 HydrophobicContact CB-CD2 4.02Å; A1134-L1142 WeakPolarHBondContact O-CD1 3.36Å
1135	L	86.3	Confident	82.3	Confident	40 Å²	40	68 Å²	68	21%	0.209	34%	0.335	C	S	.	.	H	α-helix	trans	-72.9	-32.1	174.7	-67	175.4	0	0	0	113.1	R1087 Y1131 R1132 K1133 L1142	R1087-L1135 PolarHBondContact NH1-O 3.01Å; R1087-L1135 PolarHBondContact NH2-O 2.71Å; R1087-L1135 VanDerWaalsContact NH2-O 3.07Å; Y1131-L1135 HydrophobicContact CD1-CD1 4.3Å; Y1131-L1135 HydrophobicContact CD2-CG 4.41Å; Y1131-L1135 HydrophobicContact CE1-CD1 3.82Å; Y1131-L1135 HydrophobicContact CE2-CD1 4.12Å; Y1131-L1135 HydrophobicContact CE2-CD2 4.16Å; Y1131-L1135 HydrophobicContact CE2-CG 4.04Å; Y1131-L1135 WeakPolarHBondContact O-CG 3.41Å; Y1131-L1135 PolarHBondContact O-N 3.41Å; R1132-L1135 PolarHBondContact O-N 3.47Å; K1133-L1135 VanDerWaalsContact C-N 3.32Å; K1133-L1135 PolarHBondContact O-N 3.1Å; L1135-L1142 HydrophobicContact CD2-CD2 4.5Å
1136	D	84.7	Confident	82.2	Confident	84 Å²	84	70.2 Å²	70.2	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-71	-43.2	174.6	-71.3	-16.2	0	0	0	111.7	R1132 K1133 A1138	R1132-D1136 IonicContact CZ-OD2 2.69Å; R1132-D1136 IonicContact NH1-OD1 2.76Å; R1132-D1136 IonicContact NH1-OD2 3.19Å; R1132-D1136 PolarHBondContact NH1-OD2 2.98Å; R1132-D1136 IonicContact NH2-OD2 2.79Å; R1132-D1136 PolarHBondContact O-N 2.97Å; K1133-D1136 PolarHBondContact O-N 3.22Å; D1136-A1138 VanDerWaalsContact C-N 3.27Å; D1136-A1138 PolarHBondContact O-N 2.83Å
1137	S	83.4	Confident	81.8	Confident	21 Å²	21	71.6 Å²	71.6	15%	0.147	35%	0.352	C	S	.	.	H	α-helix	trans	-74.1	-16.2	-178.9	70.4	0	0	0	0	113.9	Y1115 K1133 A1134 H1139	Y1115-S1137 WeakPolarHBondContact CE2-OG 2.96Å; K1133-S1137 WeakPolarHBondContact O-CB 3.19Å; K1133-S1137 PolarHBondContact O-N 3.46Å; K1133-S1137 PolarHBondContact O-OG 2.86Å; A1134-S1137 PolarHBondContact O-OG 2.96Å; S1137-H1139 PolarHBondContact O-N 2.75Å
1138	A	77.5	Confident	81.3	Confident	7 Å²	7	74.7 Å²	74.7	6%	0.058	36%	0.359	C	S	.	.			trans	-69.6	82.4	-176.5	0	0	0	0	0	114.3	R1087 A1134 D1136 L1142	R1087-A1138 PolarHBondContact NH2-O 2.85Å; A1134-A1138 WeakPolarHBondContact O-CB 3.41Å; A1134-A1138 PolarHBondContact O-N 2.92Å; D1136-A1138 VanDerWaalsContact C-N 3.27Å; D1136-A1138 PolarHBondContact O-N 2.83Å; A1138-L1142 HydrophobicContact CB-CB 3.69Å; A1138-L1142 HydrophobicContact CB-CD1 4.24Å; A1138-L1142 HydrophobicContact CB-CG 4.41Å
1139	H	71.5	Confident	80.5	Confident	159 Å²	159	73.1 Å²	73.1	74%	0.736	35%	0.348	S	S	*	.	S	Bend	trans	-120.7	107.1	177.1	-73.4	-55	0	0	0	112.9	S1137	S1137-H1139 PolarHBondContact O-N 2.75Å
1140	P	68.9	Low	79.5	Confident	124 Å²	124	71.2 Å²	71.2	81%	0.805	35%	0.35	S	S	*	.	S	Bend	cis	-90.6	-4.3	-14.3	36.6	-33.3	0	0	0	113.6
1141	L	75	Confident	78.3	Confident	110 Å²	110	74.7 Å²	74.7	58%	0.576	37%	0.365	S	S	*	.			trans	-124.2	127.5	-176	-68.2	172.1	0	0	0	109.8	R1143	L1141-R1143 PolarHBondContact O-N 2.69Å
1142	L	82.5	Confident	76.8	Confident	43 Å²	43	74.7 Å²	74.7	23%	0.225	37%	0.367	C	S	.	.			trans	-76.3	114.4	167.8	-173.6	49.3	0	0	0	108.7	Y1115 A1134 L1135 A1138 L1144	Y1115-L1142 HydrophobicContact CD2-CD1 4.26Å; Y1115-L1142 HydrophobicContact CG-CD1 4.21Å; A1134-L1142 HydrophobicContact CB-CD1 4.18Å; A1134-L1142 HydrophobicContact CB-CD2 4.02Å; A1134-L1142 WeakPolarHBondContact O-CD1 3.36Å; L1135-L1142 HydrophobicContact CD2-CD2 4.5Å; A1138-L1142 HydrophobicContact CB-CB 3.69Å; A1138-L1142 HydrophobicContact CB-CD1 4.24Å; A1138-L1142 HydrophobicContact CB-CG 4.41Å; L1142-L1144 HydrophobicContact CD2-CD2 3.83Å; L1142-L1144 HydrophobicContact CG-CD2 3.78Å; L1142-L1144 HydrophobicContact CG-CG 4.2Å
1143	R	82.4	Confident	75.2	Confident	191 Å²	191	73.8 Å²	73.8	72%	0.721	37%	0.37	S	S	*	.			trans	-82.7	122.2	169.2	-61.5	-176.2	-176.8	-143	4.1	108.2	Y1115 S1116 L1141	Y1115-R1143 VanDerWaalsContact CA-O 3.26Å; Y1115-R1143 WeakPolarHBondContact CA-O 3.39Å; S1116-R1143 PolarHBondContact N-O 3.17Å; S1116-R1143 WeakPolarHBondContact OG-CB 3.35Å; L1141-R1143 PolarHBondContact O-N 2.69Å
1144	L	84.4	Confident	73.8	Confident	53 Å²	53	73.2 Å²	73.2	28%	0.277	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.2	176.9	-59.5	167.1	0	0	0	108.9	F1083 F1096 L1113 C1114 I1125 L1142	F1083-L1144 HydrophobicContact CE1-CD1 4.48Å; F1083-L1144 HydrophobicContact CZ-CD1 3.82Å; F1096-L1144 HydrophobicContact CE1-CD1 4.18Å; F1096-L1144 HydrophobicContact CE1-CD2 4.06Å; F1096-L1144 HydrophobicContact CZ-CD1 3.67Å; F1096-L1144 HydrophobicContact CZ-CD2 4.1Å; L1113-L1144 HydrophobicContact CD2-CB 4.42Å; L1113-L1144 HydrophobicContact CD2-CD2 4.27Å; C1114-L1144 CarbonylContact O-C 3.58Å; C1114-L1144 VanDerWaalsContact O-CA 3.32Å; C1114-L1144 WeakPolarHBondContact O-CA 3.16Å; I1125-L1144 HydrophobicContact CD1-CD2 3.67Å; L1142-L1144 HydrophobicContact CD2-CD2 3.83Å; L1142-L1144 HydrophobicContact CG-CD2 3.78Å; L1142-L1144 HydrophobicContact CG-CG 4.2Å
1145	L	82.7	Confident	72.3	Confident	75 Å²	75	75.8 Å²	75.8	39%	0.393	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.2	162.9	-166.6	74.9	0	0	0	108.2	C1114 L1122	C1114-L1145 HydrophobicContact CB-CB 4.37Å; C1114-L1145 PolarHBondContact N-O 3.06Å; C1114-L1145 PolarHBondContact O-N 3.45Å; L1122-L1145 HydrophobicContact CD1-CB 4Å; L1122-L1145 HydrophobicContact CD1-CD2 4.2Å; L1122-L1145 HydrophobicContact CD2-CD2 3.69Å
1146	L	81.6	Confident	70.6	Confident	56 Å²	56	81.8 Å²	81.8	29%	0.293	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	101.1	176.7	-157.2	69.1	0	0	0	107.8	V1100 H1104 V1106 F1111 L1113	V1100-L1146 HydrophobicContact CG1-CD1 3.63Å; V1100-L1146 HydrophobicContact CG1-CD2 3.79Å; V1100-L1146 HydrophobicContact CG1-CG 4.38Å; H1104-L1146 HydrophobicContact CB-CD2 4.05Å; V1106-L1146 HydrophobicContact CG2-CD2 4.14Å; F1111-L1146 HydrophobicContact CD2-CD1 3.36Å; F1111-L1146 HydrophobicContact CD2-CG 4.17Å; F1111-L1146 HydrophobicContact CE2-CD1 3.68Å; F1111-L1146 HydrophobicContact CG-CD1 4.08Å; F1111-L1146 HydrophobicContact CG-CG 4.43Å; L1113-L1146 HydrophobicContact CD2-CD1 3.71Å; L1113-L1146 HydrophobicContact CG-CD1 3.68Å
1147	Q	74	Confident	68.9	Low	62 Å²	62	84.4 Å²	84.4	29%	0.29	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.7	-177.1	-173.3	169.5	8.6	0	0	109.9	F1111 T1112 E1151	F1111-Q1147 CarbonylContact C-O 3.32Å; F1111-Q1147 WeakPolarHBondContact CA-O 3.49Å; F1111-Q1147 VanDerWaalsContact CB-O 3.3Å; F1111-Q1147 WeakPolarHBondContact CB-O 3.43Å; T1112-Q1147 PolarHBondContact N-O 3.09Å; T1112-Q1147 PolarHBondContact O-N 2.55Å; T1112-Q1147 VanDerWaalsContact O-N 3.14Å; T1112-Q1147 PolarHBondContact OG1-O 3.42Å; Q1147-E1151 PolarHBondContact NE2-O 3.42Å
1148	R	72.3	Confident	67	Low	130 Å²	130	84.5 Å²	84.5	49%	0.491	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	137.2	177.7	-164.4	172.4	172	-145.8	5.3	110	I1109 G1150 E1151	I1109-R1148 HydrophobicContact CG2-CG 3.79Å; R1148-G1150 PolarHBondContact O-N 2.78Å; R1148-E1151 HydrophobicContact CB-CG 4.28Å; R1148-E1151 WeakPolarHBondContact CB-OE2 3.19Å; R1148-E1151 WeakPolarHBondContact CD-OE1 3.33Å; R1148-E1151 IonicContact CZ-OE1 3.75Å; R1148-E1151 IonicContact NH1-OE1 3.11Å; R1148-E1151 PolarHBondContact NH1-OE1 2.91Å; R1148-E1151 PolarHBondContact O-N 3.32Å
1149	K	68.8	Low	65.5	Low	59 Å²	59	88 Å²	88	26%	0.257	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	129.7	179.8	-158	177.2	-173.8	-171	0	109.8	P1110 E1155 D1194	P1110-K1149 HydrophobicContact CB-CB 4Å; P1110-K1149 HydrophobicContact CG-CB 4.37Å; P1110-K1149 WeakPolarHBondContact O-CB 3.47Å; P1110-K1149 PolarHBondContact O-N 3.09Å; K1149-E1155 WeakPolarHBondContact CG-OE1 3.45Å; K1149-D1194 VanDerWaalsContact CE-OD1 3.29Å; K1149-D1194 WeakPolarHBondContact CE-OD1 3.22Å; K1149-D1194 IonicContact NZ-OD1 2.65Å; K1149-D1194 PolarHBondContact NZ-OD1 3.04Å; K1149-D1194 IonicContact NZ-OD2 2.66Å; K1149-D1194 PolarHBondContact NZ-OD2 3.02Å
1150	G	63.5	Low	64.4	Low	39 Å²	39	84.5 Å²	84.5	40%	0.402	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	0.7	-172.4	0	0	0	0	0	115.4	R1148 E1155	R1148-G1150 PolarHBondContact O-N 2.78Å; G1150-E1155 WeakPolarHBondContact CA-OE2 3.4Å; G1150-E1155 PolarHBondContact N-OE1 3.15Å; G1150-E1155 VanDerWaalsContact N-OE1 3.08Å; G1150-E1155 PolarHBondContact N-OE2 3.15Å
1151	E	59.6	Low	63	Low	100 Å²	100	81.5 Å²	81.5	47%	0.467	41%	0.408	S	S	.	.			trans	-107.6	0.7	176.9	-67	177	-174.8	0	0	113.4	Q1147 R1148	Q1147-E1151 PolarHBondContact NE2-O 3.42Å; R1148-E1151 HydrophobicContact CB-CG 4.28Å; R1148-E1151 WeakPolarHBondContact CB-OE2 3.19Å; R1148-E1151 WeakPolarHBondContact CD-OE1 3.33Å; R1148-E1151 IonicContact CZ-OE1 3.75Å; R1148-E1151 IonicContact NH1-OE1 3.11Å; R1148-E1151 PolarHBondContact NH1-OE1 2.91Å; R1148-E1151 PolarHBondContact O-N 3.32Å
1152	S	56	Low	61.3	Low	12 Å²	12	81.8 Å²	81.8	8%	0.084	41%	0.41	C	S	.	.	S	Bend	trans	-78.4	158	170.8	68.3	0	0	0	0	112.6	E1154 E1155 R1156	S1152-E1154 VanDerWaalsContact C-N 3.34Å; S1152-E1155 WeakPolarHBondContact CB-OE2 3.41Å; S1152-E1155 PolarHBondContact N-OE2 2.68Å; S1152-E1155 PolarHBondContact O-N 3.47Å; S1152-E1155 VanDerWaalsContact OG-CB 3.25Å; S1152-E1155 WeakPolarHBondContact OG-CB 3.32Å; S1152-E1155 WeakPolarHBondContact OG-CG 3.19Å; S1152-E1155 PolarHBondContact OG-N 2.98Å; S1152-E1155 PolarHBondContact OG-OE2 3.08Å; S1152-R1156 PolarHBondContact O-N 2.89Å; S1152-R1156 VanDerWaalsContact O-N 3.1Å
1153	L	52.7	Low	59.3	Low	94 Å²	94	83.1 Å²	83.1	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-73.9	-31.8	-177.9	-158.8	145.5	0	0	0	110.5	R1156 Y1157 L1164	L1153-R1156 PolarHBondContact O-N 3.22Å; L1153-Y1157 HydrophobicContact CD2-CD2 3.9Å; L1153-Y1157 HydrophobicContact CG-CD2 3.83Å; L1153-Y1157 HydrophobicContact CG-CE2 4.2Å; L1153-Y1157 WeakPolarHBondContact O-CB 3.43Å; L1153-Y1157 WeakPolarHBondContact O-CD2 3.41Å; L1153-Y1157 PolarHBondContact O-N 3.31Å; L1153-L1164 HydrophobicContact CD2-CD1 4.12Å
1154	E	55.3	Low	57.2	Low	79 Å²	79	80.6 Å²	80.6	37%	0.369	42%	0.424	S	S	.	.	H	α-helix	trans	-68.8	-37	174.4	-62.1	64	-139.7	0	0	112.2	S1152 G1158 Y1159	S1152-E1154 VanDerWaalsContact C-N 3.34Å; E1154-G1158 CarbonylContact O-C 3.53Å; E1154-G1158 VanDerWaalsContact O-C 3.25Å; E1154-G1158 WeakPolarHBondContact O-CA 3.32Å; E1154-G1158 PolarHBondContact O-N 2.86Å; E1154-Y1159 HydrophobicContact CB-CD1 3.7Å; E1154-Y1159 HydrophobicContact CB-CD2 4.35Å; E1154-Y1159 HydrophobicContact CB-CE1 3.46Å; E1154-Y1159 VanDerWaalsContact CB-CE1 3.46Å; E1154-Y1159 HydrophobicContact CB-CE2 4.14Å; E1154-Y1159 HydrophobicContact CB-CG 4.14Å; E1154-Y1159 HydrophobicContact CG-CD1 4.12Å; E1154-Y1159 HydrophobicContact CG-CE1 3.96Å; E1154-Y1159 PolarHBondContact O-N 2.82Å; E1154-Y1159 VanDerWaalsContact O-N 3.09Å
1155	E	55.3	Low	54.8	Low	53 Å²	53	86 Å²	86	25%	0.248	45%	0.445	C	S	.	.	H	α-helix	trans	-71.3	-38.3	173.5	-73	168.3	126.5	0	0	111.8	K1149 G1150 S1152 Y1159	K1149-E1155 WeakPolarHBondContact CG-OE1 3.45Å; G1150-E1155 WeakPolarHBondContact CA-OE2 3.4Å; G1150-E1155 PolarHBondContact N-OE1 3.15Å; G1150-E1155 VanDerWaalsContact N-OE1 3.08Å; G1150-E1155 PolarHBondContact N-OE2 3.15Å; S1152-E1155 WeakPolarHBondContact CB-OE2 3.41Å; S1152-E1155 PolarHBondContact N-OE2 2.68Å; S1152-E1155 PolarHBondContact O-N 3.47Å; S1152-E1155 VanDerWaalsContact OG-CB 3.25Å; S1152-E1155 WeakPolarHBondContact OG-CB 3.32Å; S1152-E1155 WeakPolarHBondContact OG-CG 3.19Å; S1152-E1155 PolarHBondContact OG-N 2.98Å; S1152-E1155 PolarHBondContact OG-OE2 3.08Å; E1155-Y1159 HydrophobicContact CG-CE2 4.26Å
1156	R	49.6	Very low	52.6	Low	167 Å²	167	91.1 Å²	91.1	63%	0.63	46%	0.464	S	S	*	.	H	α-helix	trans	-78.4	-32.2	-177.6	-171.4	171	-66.9	-176.9	1.4	114.2	S1152 L1153	S1152-R1156 PolarHBondContact O-N 2.89Å; S1152-R1156 VanDerWaalsContact O-N 3.1Å; L1153-R1156 PolarHBondContact O-N 3.22Å
1157	Y	49.5	Very low	50.3	Low	139 Å²	139	92.1 Å²	92.1	55%	0.545	46%	0.464	S	S	.	.	H	α-helix	trans	-115.3	1.8	-178	-60.4	-82.4	0	0	0	114.1	L1153 T1161	L1153-Y1157 HydrophobicContact CD2-CD2 3.9Å; L1153-Y1157 HydrophobicContact CG-CD2 3.83Å; L1153-Y1157 HydrophobicContact CG-CE2 4.2Å; L1153-Y1157 WeakPolarHBondContact O-CB 3.43Å; L1153-Y1157 WeakPolarHBondContact O-CD2 3.41Å; L1153-Y1157 PolarHBondContact O-N 3.31Å; Y1157-T1161 PolarHBondContact O-OG1 3.3Å
1158	G	44.8	Very low	48.3	Very low	23 Å²	23	94.3 Å²	94.3	24%	0.237	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	118.8	172.1	0	0	0	0	0	114	E1154 G1160 T1161	E1154-G1158 CarbonylContact O-C 3.53Å; E1154-G1158 VanDerWaalsContact O-C 3.25Å; E1154-G1158 WeakPolarHBondContact O-CA 3.32Å; E1154-G1158 PolarHBondContact O-N 2.86Å; G1158-G1160 PolarHBondContact O-N 3.41Å; G1158-T1161 PolarHBondContact O-N 3.1Å; G1158-T1161 VanDerWaalsContact O-N 3.16Å
1159	Y	46	Very low	46.9	Very low	79 Å²	79	95 Å²	95	31%	0.31	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.7	122.9	167.8	-64.3	-87.3	0	0	0	111.4	E1154 E1155 D1188 R1196	E1154-Y1159 HydrophobicContact CB-CD1 3.7Å; E1154-Y1159 HydrophobicContact CB-CD2 4.35Å; E1154-Y1159 HydrophobicContact CB-CE1 3.46Å; E1154-Y1159 VanDerWaalsContact CB-CE1 3.46Å; E1154-Y1159 HydrophobicContact CB-CE2 4.14Å; E1154-Y1159 HydrophobicContact CB-CG 4.14Å; E1154-Y1159 HydrophobicContact CG-CD1 4.12Å; E1154-Y1159 HydrophobicContact CG-CE1 3.96Å; E1154-Y1159 PolarHBondContact O-N 2.82Å; E1154-Y1159 VanDerWaalsContact O-N 3.09Å; E1155-Y1159 HydrophobicContact CG-CE2 4.26Å; Y1159-D1188 HydrophobicContact CE1-CB 4.37Å; Y1159-R1196 PolarHBondContact O-NH1 3.21Å
1160	G	47.3	Very low	45.5	Very low	87 Å²	87	95.4 Å²	95.4	90%	0.897	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	4	176.2	0	0	0	0	0	117.1	G1158	G1158-G1160 PolarHBondContact O-N 3.41Å
1161	T	40.4	Very low	44.2	Very low	60 Å²	60	98.5 Å²	98.5	37%	0.368	50%	0.5	S	S	.	.			trans	-87.1	118.9	170.8	83.4	0	0	0	0	111.6	Y1157 G1158 S1163	Y1157-T1161 PolarHBondContact O-OG1 3.3Å; G1158-T1161 PolarHBondContact O-N 3.1Å; G1158-T1161 VanDerWaalsContact O-N 3.16Å; T1161-S1163 PolarHBondContact O-N 3.24Å; T1161-S1163 PolarHBondContact O-OG 2.95Å; T1161-S1163 PolarHBondContact OG1-OG 2.8Å; T1161-S1163 VanDerWaalsContact OG1-OG 3.05Å
1162	D	38.5	Very low	43.1	Very low	116 Å²	116	104.8 Å²	104.8	62%	0.62	52%	0.519	S	S	*	.			trans	-79.5	37.1	-177.8	-138.7	-18.9	0	0	0	112.6	L1164 K1165	D1162-L1164 PolarHBondContact O-N 2.97Å; D1162-K1165 WeakPolarHBondContact OD1-CD 3.31Å; D1162-K1165 IonicContact OD1-NZ 3.58Å; D1162-K1165 PolarHBondContact OD1-NZ 3.25Å; D1162-K1165 IonicContact OD2-NZ 2.69Å
1163	S	39.8	Very low	42.5	Very low	71 Å²	71	113.2 Å²	113.2	50%	0.497	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	-17.9	-160.7	47.1	0	0	0	0	115.1	T1161	T1161-S1163 PolarHBondContact O-N 3.24Å; T1161-S1163 PolarHBondContact O-OG 2.95Å; T1161-S1163 PolarHBondContact OG1-OG 2.8Å; T1161-S1163 VanDerWaalsContact OG1-OG 3.05Å
1164	L	39.4	Very low	41.8	Very low	139 Å²	139	114.9 Å²	114.9	73%	0.728	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	2.6	-178.2	-75.2	167.9	0	0	0	115.2	L1153 D1162 K1166	L1153-L1164 HydrophobicContact CD2-CD1 4.12Å; D1162-L1164 PolarHBondContact O-N 2.97Å; L1164-K1166 PolarHBondContact O-N 3.24Å
1165	K	34	Very low	40.6	Very low	166 Å²	166	114.7 Å²	114.7	72%	0.722	58%	0.583	S	S	*	*			trans	-92.4	35.1	-176.7	-64.8	-161.6	-174.8	93.2	0	115.7	D1162	D1162-K1165 WeakPolarHBondContact OD1-CD 3.31Å; D1162-K1165 IonicContact OD1-NZ 3.58Å; D1162-K1165 PolarHBondContact OD1-NZ 3.25Å; D1162-K1165 IonicContact OD2-NZ 2.69Å
1166	K	35.9	Very low	39.6	Very low	182 Å²	182	117.4 Å²	117.4	79%	0.791	61%	0.614	S	S	*	*			trans	-158.1	129.9	172.7	-96.9	175.2	-174.2	170	0	107.2	L1164	L1164-K1166 PolarHBondContact O-N 3.24Å
1167	R	33.2	Very low	38.6	Very low	78 Å²	78	113.5 Å²	113.5	29%	0.294	63%	0.626	S	S	.	*			cis	-144.2	144.7	-1.6	-59.6	149.5	77.1	144.9	1.6	108.9	R931	R931-R1167 VanDerWaalsContact NE-NH2 3.19Å
1168	N	33.3	Very low	37.7	Very low	108 Å²	108	111.5 Å²	111.5	58%	0.578	64%	0.638	S	S	*	*				-153	137.5	110.3	-95.2	-18.5	0	0	0	107.7	R931	R931-N1168 PolarHBondContact NH2-OD1 2.83Å
1169	R	41.9	Very low	37.2	Very low	144 Å²	144	117.3 Å²	117.3	54%	0.543	67%	0.669	S	S	.	*			trans	-96.2	-14	-166.1	-79.1	-170.8	168.1	-167.9	-5.3	114.3	S1171 R1172	R1169-S1171 PolarHBondContact O-N 2.93Å; R1169-S1171 VanDerWaalsContact O-N 3.13Å; R1169-R1172 PolarHBondContact O-N 2.94Å
1170	I	39.3	Very low	36.5	Very low	67 Å²	67	120.2 Å²	120.2	34%	0.344	70%	0.695	S	S	.	*	G	3₁₀ helix	trans	-46.6	-41.3	179	-51.5	177	0	0	0	112.7	D853 R1172 F1173 L1174	D853-I1170 VanDerWaalsContact OD1-CG1 3.25Å; D853-I1170 WeakPolarHBondContact OD1-CG1 3.38Å; I1170-R1172 PolarHBondContact O-N 3.27Å; I1170-F1173 PolarHBondContact O-N 2.53Å; I1170-L1174 HydrophobicContact CG2-CD1 4.46Å
1171	S	36.9	Very low	35.8	Very low	105 Å²	105	118.1 Å²	118.1	73%	0.734	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-65.6	-0.8	-175.1	61.5	0	0	0	0	116.3	R1169	R1169-S1171 PolarHBondContact O-N 2.93Å; R1169-S1171 VanDerWaalsContact O-N 3.13Å
1172	R	36.2	Very low	35.4	Very low	231 Å²	231	121.4 Å²	121.4	87%	0.872	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-108.5	-11.6	172.5	-66.6	-171.4	-172.9	169.1	2.9	115	R1169 I1170	R1169-R1172 PolarHBondContact O-N 2.94Å; I1170-R1172 PolarHBondContact O-N 3.27Å
1173	F	42.8	Very low	35	Very low	189 Å²	189	126.8 Å²	126.8	83%	0.829	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-19	-176.5	-117.8	-93.5	0	0	0	113.9	I1170	I1170-F1173 PolarHBondContact O-N 2.53Å
1174	L	38.1	Very low	34.7	Very low	129 Å²	129	128.9 Å²	128.9	68%	0.675	72%	0.724	S	S	*	*	S	Bend	trans	-108.8	106.2	179.3	-70.8	171.8	0	0	0	112.9	I1170	I1170-L1174 HydrophobicContact CG2-CD1 4.46Å
1175	G	30.5	Very low	34.4	Very low	75 Å²	75	131.1 Å²	131.1	77%	0.773	72%	0.722	S	S	*	*			trans	79.6	63.3	134.2	0	0	0	0	0	119.8
1176	A	33.9	Very low	34.5	Very low	110 Å²	110	127.4 Å²	127.4	91%	0.909	72%	0.723	S	S	*	*			trans	54.6	121.9	142.1	0	0	0	0	0	121.3
1177	G	29	Very low	34.8	Very low	85 Å²	85	126.9 Å²	126.9	88%	0.876	72%	0.717	S	S	*	*				114.2	41.5	126.1	0	0	0	0	0	119.7
1178	A	31	Very low	35.3	Very low	97 Å²	97	127 Å²	127	80%	0.802	72%	0.724	S	S	*	*			trans	-128.5	135.7	162.8	0	0	0	0	0	111.5	T1180	A1178-T1180 PolarHBondContact O-N 2.81Å
1179	V	34	Very low	36.1	Very low	146 Å²	146	127.1 Å²	127.1	89%	0.885	72%	0.723	S	S	*	*			trans	-56.2	122.7	-170	178	0	0	0	0	112.8	G1181	V1179-G1181 PolarHBondContact O-N 2.8Å
1180	T	30.4	Very low	36.5	Very low	139 Å²	139	121.3 Å²	121.3	85%	0.853	70%	0.704	S	S	*	*			trans	-78.3	82.4	171.2	52.8	0	0	0	0	111.3	A1178	A1178-T1180 PolarHBondContact O-N 2.81Å
1181	G	32.4	Very low	37.1	Very low	44 Å²	44	120.8 Å²	120.8	45%	0.454	70%	0.701	S	S	.	*			trans	-72.7	146	158.3	0	0	0	0	0	110.4	V1179 Y1183	V1179-G1181 PolarHBondContact O-N 2.8Å; G1181-Y1183 PolarHBondContact O-N 2.87Å
1182	P	32.1	Very low	37.8	Very low	129 Å²	129	120.2 Å²	120.2	84%	0.838	70%	0.695	S	S	*	*			trans	-68.6	112.6	169.3	28.8	-31.8	0	0	0	108.6	S1184	P1182-S1184 PolarHBondContact O-N 3.32Å
1183	Y	30.4	Very low	38.5	Very low	229 Å²	229	116.4 Å²	116.4	90%	0.898	69%	0.687	S	S	*	*			trans	-59.6	114.2	168.9	-85.6	-88.1	0	0	0	108.6	G1181	G1181-Y1183 PolarHBondContact O-N 2.87Å
1184	S	33.9	Very low	38.7	Very low	114 Å²	114	109.3 Å²	109.3	80%	0.797	66%	0.658	S	S	*	*			trans	-57.4	141.2	175.3	-170.3	0	0	0	0	109.5	P1182 A1186	P1182-S1184 PolarHBondContact O-N 3.32Å; S1184-A1186 PolarHBondContact O-N 2.87Å; S1184-A1186 VanDerWaalsContact O-N 3.12Å
1185	R	33	Very low	39.2	Very low	187 Å²	187	110.3 Å²	110.3	71%	0.706	66%	0.657	S	S	*	*			trans	-73.4	104.8	169.6	-70.8	178.5	178.7	163	-3.2	107.7	Y1187	R1185-Y1187 HydrophobicContact CB-CD2 3.82Å; R1185-Y1187 HydrophobicContact CB-CE2 3.49Å; R1185-Y1187 VanDerWaalsContact CB-CE2 3.49Å; R1185-Y1187 VanDerWaalsContact CD-OH 3.29Å; R1185-Y1187 WeakPolarHBondContact CD-OH 3.05Å; R1185-Y1187 HydrophobicContact CG-CE2 4.33Å; R1185-Y1187 PolarHBondContact NH1-OH 3.5Å; R1185-Y1187 VanDerWaalsContact NH1-OH 3.09Å; R1185-Y1187 VanDerWaalsContact O-CD2 3.32Å; R1185-Y1187 WeakPolarHBondContact O-CD2 3.07Å; R1185-Y1187 PolarHBondContact O-N 2.82Å
1186	A	35.7	Very low	40	Very low	88 Å²	88	111.7 Å²	111.7	73%	0.727	64%	0.639	S	S	*	*			trans	-60.8	106.1	157.9	0	0	0	0	0	107.5	S1184	S1184-A1186 PolarHBondContact O-N 2.87Å; S1184-A1186 VanDerWaalsContact O-N 3.12Å
1187	Y	42.7	Very low	41	Very low	171 Å²	171	112.6 Å²	112.6	67%	0.671	62%	0.624	S	S	*	*			trans	-93.2	94.1	168.9	-74.8	-85.6	0	0	0	106.6	R1185 I1189	R1185-Y1187 HydrophobicContact CB-CD2 3.82Å; R1185-Y1187 HydrophobicContact CB-CE2 3.49Å; R1185-Y1187 VanDerWaalsContact CB-CE2 3.49Å; R1185-Y1187 VanDerWaalsContact CD-OH 3.29Å; R1185-Y1187 WeakPolarHBondContact CD-OH 3.05Å; R1185-Y1187 HydrophobicContact CG-CE2 4.33Å; R1185-Y1187 PolarHBondContact NH1-OH 3.5Å; R1185-Y1187 VanDerWaalsContact NH1-OH 3.09Å; R1185-Y1187 VanDerWaalsContact O-CD2 3.32Å; R1185-Y1187 WeakPolarHBondContact O-CD2 3.07Å; R1185-Y1187 PolarHBondContact O-N 2.82Å; Y1187-I1189 PolarHBondContact O-N 3.1Å; Y1187-I1189 VanDerWaalsContact O-N 3.16Å
1188	D	44.2	Very low	42.3	Very low	81 Å²	81	114.2 Å²	114.2	43%	0.433	62%	0.617	S	S	.	*			trans	-62.8	118.8	179.4	-87.6	-61.6	0	0	0	111.4	Y1159 S1190	Y1159-D1188 HydrophobicContact CE1-CB 4.37Å; D1188-S1190 VanDerWaalsContact C-N 3.26Å; D1188-S1190 PolarHBondContact O-N 3.07Å
1189	I	49.3	Very low	44	Very low	110 Å²	110	110.4 Å²	110.4	56%	0.564	58%	0.584	S	S	*	*			trans	-81.9	80.4	-179.4	-52.2	-179.8	0	0	0	107.7	N1126 Y1187	N1126-I1189 PolarHBondContact ND2-O 2.93Å; Y1187-I1189 PolarHBondContact O-N 3.1Å; Y1187-I1189 VanDerWaalsContact O-N 3.16Å
1190	S	50.9	Low	46	Very low	22 Å²	22	105.5 Å²	105.5	15%	0.154	56%	0.559	C	S	.	*			trans	-54	168.6	174.2	63.4	0	0	0	0	113.1	D1188	D1188-S1190 VanDerWaalsContact C-N 3.26Å; D1188-S1190 PolarHBondContact O-N 3.07Å
1191	M	52.8	Low	48.1	Very low	56 Å²	56	101.9 Å²	101.9	28%	0.276	53%	0.534	S	S	.	.			trans	-68.5	153.5	177.9	-63.8	-70.1	-67.2	0	0	109.8	N1126 Q1193 D1194	N1126-M1191 HydrophobicContact CB-SD 3.63Å; M1191-Q1193 PolarHBondContact O-N 3.47Å; M1191-D1194 VanDerWaalsContact CB-OD2 3.31Å; M1191-D1194 WeakPolarHBondContact CB-OD2 3.41Å; M1191-D1194 PolarHBondContact N-OD2 2.73Å; M1191-D1194 VanDerWaalsContact N-OD2 3.11Å; M1191-D1194 WeakPolarHBondContact O-CB 3.47Å; M1191-D1194 PolarHBondContact O-N 2.91Å
1192	P	50	Low	50.1	Low	93 Å²	93	102 Å²	102	60%	0.604	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-14	178.2	-26.8	35.9	0	0	0	115.6	D1194 F1195	P1192-D1194 VanDerWaalsContact C-N 3.32Å; P1192-F1195 HydrophobicContact CB-CD2 4.23Å; P1192-F1195 HydrophobicContact CB-CE2 3.98Å; P1192-F1195 WeakPolarHBondContact O-CD2 3.2Å
1193	Q	50.5	Low	51.7	Low	150 Å²	150	98.6 Å²	98.6	70%	0.701	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.1	174	-64.6	163.5	-10.6	0	0	112.9	M1191	M1191-Q1193 PolarHBondContact O-N 3.47Å
1194	D	48	Very low	53.3	Low	40 Å²	40	91.6 Å²	91.6	21%	0.214	48%	0.479	C	S	.	.			trans	-100.7	3.8	-171.8	-49.7	-32.8	0	0	0	111.8	K1149 M1191 P1192 R1196	K1149-D1194 VanDerWaalsContact CE-OD1 3.29Å; K1149-D1194 WeakPolarHBondContact CE-OD1 3.22Å; K1149-D1194 IonicContact NZ-OD1 2.65Å; K1149-D1194 PolarHBondContact NZ-OD1 3.04Å; K1149-D1194 IonicContact NZ-OD2 2.66Å; K1149-D1194 PolarHBondContact NZ-OD2 3.02Å; M1191-D1194 VanDerWaalsContact CB-OD2 3.31Å; M1191-D1194 WeakPolarHBondContact CB-OD2 3.41Å; M1191-D1194 PolarHBondContact N-OD2 2.73Å; M1191-D1194 VanDerWaalsContact N-OD2 3.11Å; M1191-D1194 WeakPolarHBondContact O-CB 3.47Å; M1191-D1194 PolarHBondContact O-N 2.91Å; P1192-D1194 VanDerWaalsContact C-N 3.32Å; D1194-R1196 PolarHBondContact O-N 3.19Å
1195	F	47.5	Very low	54.8	Low	151 Å²	151	94 Å²	94	66%	0.662	48%	0.483	S	S	*	.			trans	-67.4	94.9	175.8	-73.1	-45.6	0	0	0	111.3	P1192	P1192-F1195 HydrophobicContact CB-CD2 4.23Å; P1192-F1195 HydrophobicContact CB-CE2 3.98Å; P1192-F1195 WeakPolarHBondContact O-CD2 3.2Å
1196	R	49	Very low	56.9	Low	104 Å²	104	91.2 Å²	91.2	39%	0.392	48%	0.481	S	S	.	.			trans	-53.5	144.1	172.8	-160.6	175.7	-171.1	174.3	3.3	111.4	Y1159 D1194 V1198 H1219	Y1159-R1196 PolarHBondContact O-NH1 3.21Å; D1194-R1196 PolarHBondContact O-N 3.19Å; R1196-V1198 WeakPolarHBondContact O-CG2 3.26Å; R1196-V1198 PolarHBondContact O-N 2.62Å; R1196-H1219 PolarHBondContact NH2-O 2.64Å
1197	Q	54.3	Low	58.6	Low	128 Å²	128	87.9 Å²	87.9	60%	0.598	45%	0.452	S	S	*	.			trans	-61.3	111.2	169.1	-82	-171.3	-2.6	0	0	110.1
1198	V	56	Low	60.2	Low	119 Å²	119	83.3 Å²	83.3	72%	0.721	44%	0.443	S	S	*	.			trans	-84.4	144.1	178.3	-160.9	0	0	0	0	109.5	R1196	R1196-V1198 WeakPolarHBondContact O-CG2 3.26Å; R1196-V1198 PolarHBondContact O-N 2.62Å
1199	S	67.7	Low	61.3	Low	17 Å²	17	87.6 Å²	87.6	12%	0.119	46%	0.46	C	S	.	.			trans	-65.9	136.9	167	-62.7	0	0	0	0	109.5	R1215 C1217 T1262 L1264	S1199-R1215 CarbonylContact C-O 3.52Å; S1199-R1215 WeakPolarHBondContact CA-O 3.13Å; S1199-R1215 WeakPolarHBondContact CB-O 3.43Å; S1199-C1217 PolarHBondContact OG-N 3.27Å; S1199-C1217 VanDerWaalsContact OG-N 3.08Å; S1199-T1262 VanDerWaalsContact CB-CG2 3.41Å; S1199-L1264 WeakPolarHBondContact O-CD1 3.37Å
1200	A	74.8	Confident	62.5	Low	44 Å²	44	85.3 Å²	85.3	36%	0.364	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.1	-164.4	0	0	0	0	0	113	R1215	A1200-R1215 PolarHBondContact N-O 3.1Å; A1200-R1215 PolarHBondContact O-N 3.49Å
1201	I	74.4	Confident	64.1	Low	63 Å²	63	87 Å²	87	32%	0.323	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	133.6	164.1	-55.6	178.3	0	0	0	107.7	V1204 R1212 R1213 L1264	I1201-V1204 HydrophobicContact CG2-CG2 3.79Å; I1201-R1212 HydrophobicContact CD1-CG 4.29Å; I1201-R1212 HydrophobicContact CG1-CG 4.38Å; I1201-R1212 HydrophobicContact CG2-CG 4.13Å; I1201-R1213 CarbonylContact C-O 3.57Å; I1201-R1213 WeakPolarHBondContact CA-O 3.22Å; I1201-R1213 WeakPolarHBondContact CG2-O 3.5Å; I1201-L1264 HydrophobicContact CD1-CD2 4.12Å; I1201-L1264 HydrophobicContact CG1-CD1 4.38Å; I1201-L1264 HydrophobicContact CG1-CD2 3.86Å
1202	I	75.7	Confident	65.6	Low	47 Å²	47	85.1 Å²	85.1	24%	0.241	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	163.1	177.1	-3.7	173	0	0	0	110.2	V1204 R1213 R1215 I1299	I1202-V1204 PolarHBondContact O-N 3.04Å; I1202-V1204 VanDerWaalsContact O-N 3.08Å; I1202-R1213 HydrophobicContact CD1-CG 4.09Å; I1202-R1213 HydrophobicContact CG1-CG 4.16Å; I1202-R1213 PolarHBondContact N-O 3.32Å; I1202-R1215 HydrophobicContact CD1-CB 3.78Å; I1202-R1215 HydrophobicContact CD1-CG 4.45Å; I1202-R1215 HydrophobicContact CG1-CB 3.99Å; I1202-I1299 HydrophobicContact CD1-CB 4.39Å; I1202-I1299 HydrophobicContact CD1-CD1 3.84Å; I1202-I1299 HydrophobicContact CD1-CG1 3.87Å; I1202-I1299 HydrophobicContact CD1-CG2 3.7Å
1203	D	65.5	Low	67.4	Low	57 Å²	57	82.9 Å²	82.9	31%	0.305	43%	0.428	S	S	.	.			trans	55.3	32.6	162.6	-54.7	-19.2	0	0	0	115.3	D1205 I1206 V1207 R1213	D1203-D1205 PolarHBondContact O-N 3.18Å; D1203-I1206 HydrophobicContact CB-CB 4.21Å; D1203-I1206 HydrophobicContact CB-CD1 4.23Å; D1203-I1206 HydrophobicContact CB-CG1 4.43Å; D1203-I1206 PolarHBondContact O-N 3.02Å; D1203-V1207 HydrophobicContact CB-CG2 3.91Å; D1203-V1207 PolarHBondContact O-N 3.14Å; D1203-V1207 VanDerWaalsContact O-N 3.1Å; D1203-R1213 WeakPolarHBondContact OD2-CD 3.42Å; D1203-R1213 IonicContact OD2-CZ 3.9Å; D1203-R1213 IonicContact OD2-NE 2.69Å; D1203-R1213 IonicContact OD2-NH1 3Å; D1203-R1213 PolarHBondContact OD2-NH1 3.42Å
1204	V	63.1	Low	69.2	Low	81 Å²	81	75.7 Å²	75.7	49%	0.491	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-30.8	-177.1	-177.6	0	0	0	0	112.7	I1201 I1202 L1311	I1201-V1204 HydrophobicContact CG2-CG2 3.79Å; I1202-V1204 PolarHBondContact O-N 3.04Å; I1202-V1204 VanDerWaalsContact O-N 3.08Å; V1204-L1311 HydrophobicContact CG1-CD1 4.11Å
1205	D	66	Low	71.1	Confident	164 Å²	164	78.1 Å²	78.1	88%	0.877	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-3.2	-178.7	-50.3	-56.3	0	0	0	114.1	D1203	D1203-D1205 PolarHBondContact O-N 3.18Å
1206	I	76.1	Confident	72.7	Confident	129 Å²	129	71 Å²	71	66%	0.662	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-40.4	-173.9	-50.9	177.1	0	0	0	111.4	D1203	D1203-I1206 HydrophobicContact CB-CB 4.21Å; D1203-I1206 HydrophobicContact CB-CD1 4.23Å; D1203-I1206 HydrophobicContact CB-CG1 4.43Å; D1203-I1206 PolarHBondContact O-N 3.02Å
1207	V	72.3	Confident	73.9	Confident	19 Å²	19	66.5 Å²	66.5	12%	0.115	35%	0.354	C	S	.	.	S	Bend	trans	-83.8	137.5	180	-161.2	0	0	0	0	108.9	D1203 H1211 R1213 T1301	D1203-V1207 HydrophobicContact CB-CG2 3.91Å; D1203-V1207 PolarHBondContact O-N 3.14Å; D1203-V1207 VanDerWaalsContact O-N 3.1Å; V1207-H1211 HydrophobicContact CG1-CB 3.55Å; V1207-R1213 HydrophobicContact CG2-CB 4.1Å; V1207-T1301 HydrophobicContact CG1-CG2 3.78Å
1208	P	76.9	Confident	74.7	Confident	75 Å²	75	63.7 Å²	63.7	49%	0.487	34%	0.34	S	S	.	.			trans	-57	149.2	-175.4	-26.9	34.5	0	0	0	114.2	C1210 H1211	P1208-C1210 PolarHBondContact O-N 3.07Å; P1208-H1211 WeakPolarHBondContact O-CB 3.44Å; P1208-H1211 PolarHBondContact O-N 2.69Å
1209	E	66.3	Low	75	Confident	170 Å²	170	62.4 Å²	62.4	79%	0.794	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-18.1	-170.7	-59.8	-178.6	165.5	0	0	116.4	H1211 T1310	E1209-H1211 VanDerWaalsContact C-N 3.33Å; E1209-T1310 WeakPolarHBondContact O-CG2 3.26Å
1210	C	74.4	Confident	74.5	Confident	63 Å²	63	65.5 Å²	65.5	43%	0.426	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	13.5	176.2	60.5	0	0	0	0	114.2	P1208	P1208-C1210 PolarHBondContact O-N 3.07Å
1211	H	84.8	Confident	73.7	Confident	56 Å²	56	65.8 Å²	65.8	26%	0.259	36%	0.36	S	S	.	.			trans	-133.4	161.7	-175.4	-59	129.5	0	0	0	111.5	V1207 P1208 E1209 L1272 V1302 R1303	V1207-H1211 HydrophobicContact CG1-CB 3.55Å; P1208-H1211 WeakPolarHBondContact O-CB 3.44Å; P1208-H1211 PolarHBondContact O-N 2.69Å; E1209-H1211 VanDerWaalsContact C-N 3.33Å; H1211-L1272 WeakPolarHBondContact CD2-CD1 3.49Å; H1211-L1272 WeakPolarHBondContact NE2-CD1 3.5Å; H1211-V1302 CarbonylContact C-O 3.59Å; H1211-V1302 WeakPolarHBondContact CA-O 3.49Å; H1211-R1303 PolarHBondContact NE2-NE 3.1Å; H1211-R1303 PolarHBondContact NE2-NH2 2.82Å
1212	R	85	Confident	73	Confident	18 Å²	18	71.5 Å²	71.5	7%	0.068	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	121.9	-179.9	177.5	175.9	58.8	-178.7	-3	109.2	I1201 V1214 L1264 D1269 V1302 P1304	I1201-R1212 HydrophobicContact CD1-CG 4.29Å; I1201-R1212 HydrophobicContact CG1-CG 4.38Å; I1201-R1212 HydrophobicContact CG2-CG 4.13Å; R1212-V1214 HydrophobicContact CG-CG2 3.83Å; R1212-L1264 PolarHBondContact NE-O 2.7Å; R1212-L1264 PolarHBondContact NH1-O 2.94Å; R1212-L1264 PolarHBondContact NH2-O 3.17Å; R1212-L1264 VanDerWaalsContact NH2-O 3.1Å; R1212-D1269 IonicContact NH2-OD2 3.83Å; R1212-D1269 PolarHBondContact NH2-OD2 3.42Å; R1212-V1302 HydrophobicContact CB-CG2 4.24Å; R1212-V1302 PolarHBondContact N-O 3.44Å; R1212-V1302 WeakPolarHBondContact O-CG2 3.41Å; R1212-V1302 PolarHBondContact O-N 3.01Å; R1212-P1304 HydrophobicContact CB-CG 4.02Å
1213	R	88.2	Confident	72.4	Confident	45 Å²	45	76.1 Å²	76.1	17%	0.17	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.1	173.1	-173.5	175.4	-75.2	163.2	-2.3	109.9	I1201 I1202 D1203 V1207 E1273 I1299 I1300 T1301	I1201-R1213 CarbonylContact C-O 3.57Å; I1201-R1213 WeakPolarHBondContact CA-O 3.22Å; I1201-R1213 WeakPolarHBondContact CG2-O 3.5Å; I1202-R1213 HydrophobicContact CD1-CG 4.09Å; I1202-R1213 HydrophobicContact CG1-CG 4.16Å; I1202-R1213 PolarHBondContact N-O 3.32Å; D1203-R1213 WeakPolarHBondContact OD2-CD 3.42Å; D1203-R1213 IonicContact OD2-CZ 3.9Å; D1203-R1213 IonicContact OD2-NE 2.69Å; D1203-R1213 IonicContact OD2-NH1 3Å; D1203-R1213 PolarHBondContact OD2-NH1 3.42Å; V1207-R1213 HydrophobicContact CG2-CB 4.1Å; R1213-E1273 IonicContact CZ-OE2 3.66Å; R1213-E1273 IonicContact NE-OE2 3.7Å; R1213-E1273 IonicContact NH2-OE1 3.06Å; R1213-E1273 IonicContact NH2-OE2 2.71Å; R1213-E1273 PolarHBondContact NH2-OE2 2.84Å; R1213-I1299 HydrophobicContact CG-CG2 3.64Å; R1213-I1300 CarbonylContact C-O 3.57Å; R1213-I1300 WeakPolarHBondContact CA-O 3.24Å; R1213-T1301 PolarHBondContact NE-OG1 3.19Å
1214	V	87.5	Confident	72.8	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.3	-170.6	-179.2	0	0	0	0	109.6	R1212 L1216 L1264 L1265 I1299 I1300	R1212-V1214 HydrophobicContact CG-CG2 3.83Å; V1214-L1216 HydrophobicContact CG1-CD2 4.19Å; V1214-L1216 HydrophobicContact CG1-CG 4.44Å; V1214-L1264 HydrophobicContact CG1-CB 3.62Å; V1214-L1264 HydrophobicContact CG1-CD1 3.96Å; V1214-L1264 HydrophobicContact CG1-CG 4.47Å; V1214-L1264 HydrophobicContact CG2-CB 4.27Å; V1214-L1264 WeakPolarHBondContact CG2-O 3.18Å; V1214-L1265 HydrophobicContact CB-CD2 4.29Å; V1214-L1265 HydrophobicContact CG1-CD2 4.46Å; V1214-L1265 HydrophobicContact CG1-CG 4.45Å; V1214-L1265 HydrophobicContact CG2-CD2 4.01Å; V1214-I1299 CarbonylContact O-C 3.34Å; V1214-I1299 WeakPolarHBondContact O-CA 3.27Å; V1214-I1300 PolarHBondContact N-O 3.04Å; V1214-I1300 PolarHBondContact O-N 2.92Å
1215	R	87.4	Confident	73.5	Confident	91 Å²	91	75.4 Å²	75.4	34%	0.343	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.8	171.1	-167.9	177	-174.6	179.5	0.2	109.6	S1199 A1200 I1202 N1297 I1299	S1199-R1215 CarbonylContact C-O 3.52Å; S1199-R1215 WeakPolarHBondContact CA-O 3.13Å; S1199-R1215 WeakPolarHBondContact CB-O 3.43Å; A1200-R1215 PolarHBondContact N-O 3.1Å; A1200-R1215 PolarHBondContact O-N 3.49Å; I1202-R1215 HydrophobicContact CD1-CB 3.78Å; I1202-R1215 HydrophobicContact CD1-CG 4.45Å; I1202-R1215 HydrophobicContact CG1-CB 3.99Å; R1215-N1297 PolarHBondContact NE-OD1 2.87Å; R1215-N1297 PolarHBondContact NH2-OD1 3.11Å; R1215-I1299 HydrophobicContact CG-CG1 4.18Å
1216	L	82.5	Confident	74.3	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.4	170.4	-63.9	179.9	0	0	0	109.8	V1214 L1225 F1227 L1258 A1259 T1262 L1265 L1298 I1300	V1214-L1216 HydrophobicContact CG1-CD2 4.19Å; V1214-L1216 HydrophobicContact CG1-CG 4.44Å; L1216-L1225 HydrophobicContact CB-CD2 4.43Å; L1216-L1225 HydrophobicContact CD1-CD2 4.49Å; L1216-F1227 HydrophobicContact CD1-CD1 4.3Å; L1216-F1227 HydrophobicContact CD1-CE1 3.79Å; L1216-L1258 HydrophobicContact CB-CD2 4.42Å; L1216-A1259 HydrophobicContact CD1-CB 4.34Å; L1216-T1262 HydrophobicContact CD2-CG2 3.99Å; L1216-L1265 HydrophobicContact CD1-CD1 3.93Å; L1216-L1298 PolarHBondContact N-O 3.5Å; L1216-L1298 PolarHBondContact O-N 2.81Å; L1216-L1298 VanDerWaalsContact O-N 3.1Å; L1216-I1300 HydrophobicContact CD1-CD1 4.33Å
1217	C	72.5	Confident	75	Confident	10 Å²	10	62.9 Å²	62.9	7%	0.068	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	110.8	-179.7	-61.8	0	0	0	0	110.8	S1199 H1219	S1199-C1217 PolarHBondContact OG-N 3.27Å; S1199-C1217 VanDerWaalsContact OG-N 3.08Å; C1217-H1219 PolarHBondContact O-N 3.16Å; C1217-H1219 VanDerWaalsContact O-N 3.09Å
1218	K	71.4	Confident	75.8	Confident	69 Å²	69	67.2 Å²	67.2	30%	0.3	35%	0.351	S	S	.	.			trans	-83.8	80.5	179.9	-175.4	-175.5	176.7	179.5	0	110.5	G1220 S1221 E1222 K1223 L1258 A1295 S1296	K1218-G1220 PolarHBondContact O-N 2.83Å; K1218-S1221 WeakPolarHBondContact CE-O 3.01Å; K1218-E1222 VanDerWaalsContact CE-C 3.46Å; K1218-E1222 WeakPolarHBondContact CE-O 3.11Å; K1218-E1222 PolarHBondContact NZ-O 2.95Å; K1218-K1223 VanDerWaalsContact CE-O 3.23Å; K1218-K1223 WeakPolarHBondContact CE-O 3.36Å; K1218-L1258 HydrophobicContact CB-CD2 4.4Å; K1218-A1295 VanDerWaalsContact CB-O 3.31Å; K1218-A1295 WeakPolarHBondContact CB-O 3.29Å; K1218-S1296 PolarHBondContact N-O 3.22Å; K1218-S1296 VanDerWaalsContact N-O 3.08Å
1219	H	61.8	Low	76.6	Confident	93 Å²	93	65 Å²	65	43%	0.431	34%	0.335	S	S	.	.			trans	-89.4	97.8	-170.7	-165.7	97.4	0	0	0	113.7	R1196 C1217	R1196-H1219 PolarHBondContact NH2-O 2.64Å; C1217-H1219 PolarHBondContact O-N 3.16Å; C1217-H1219 VanDerWaalsContact O-N 3.09Å
1220	G	57.9	Low	77.8	Confident	82 Å²	82	61.3 Å²	61.3	85%	0.845	31%	0.314	S	S	*	.	S	Bend	trans	75	22	165.7	0	0	0	0	0	116	K1218	K1218-G1220 PolarHBondContact O-N 2.83Å
1221	S	58	Low	78.6	Confident	50 Å²	50	62.7 Å²	62.7	35%	0.35	32%	0.317	S	S	.	.			trans	-141.7	132.8	174.5	70.4	0	0	0	0	111	K1218 K1223	K1218-S1221 WeakPolarHBondContact CE-O 3.01Å; S1221-K1223 PolarHBondContact O-N 2.9Å; S1221-K1223 VanDerWaalsContact O-N 3.16Å
1222	E	59.9	Low	78.6	Confident	183 Å²	183	61.2 Å²	61.2	86%	0.855	32%	0.317	S	S	*	.			trans	-65	-19.1	179.4	-62.5	-149.4	118.9	0	0	114.5	K1218	K1218-E1222 VanDerWaalsContact CE-C 3.46Å; K1218-E1222 WeakPolarHBondContact CE-O 3.11Å; K1218-E1222 PolarHBondContact NZ-O 2.95Å
1223	K	63.6	Low	78.6	Confident	143 Å²	143	64.7 Å²	64.7	62%	0.622	34%	0.34	S	S	*	.			trans	-41.6	137.6	-178.1	-67.2	179.9	178.6	176.6	0	112.7	K1218 S1221	K1218-K1223 VanDerWaalsContact CE-O 3.23Å; K1218-K1223 WeakPolarHBondContact CE-O 3.36Å; S1221-K1223 PolarHBondContact O-N 2.9Å; S1221-K1223 VanDerWaalsContact O-N 3.16Å
1224	P	72.6	Confident	78.3	Confident	100 Å²	100	63 Å²	63	65%	0.649	34%	0.336	S	S	*	.			trans	-63.4	158.3	179.7	27.9	-35.7	0	0	0	111.5	G1226	P1224-G1226 PolarHBondContact O-N 2.99Å
1225	L	77.5	Confident	78	Confident	24 Å²	24	67 Å²	67	13%	0.126	36%	0.36	C	S	.	.			trans	-57.4	-17	-178.4	-67.8	165.6	0	0	0	114.1	L1216 F1227 L1258 A1259 A1295 L1298	L1216-L1225 HydrophobicContact CB-CD2 4.43Å; L1216-L1225 HydrophobicContact CD1-CD2 4.49Å; L1225-F1227 HydrophobicContact CB-CD1 4.01Å; L1225-F1227 HydrophobicContact CB-CE1 3.78Å; L1225-F1227 HydrophobicContact CD1-CE1 4.24Å; L1225-L1258 HydrophobicContact CD2-CD2 4.01Å; L1225-A1259 WeakPolarHBondContact O-CB 3.17Å; L1225-A1259 PolarHBondContact O-N 3.16Å; L1225-A1295 HydrophobicContact CD1-CB 4.13Å; L1225-L1298 HydrophobicContact CD1-CD2 3.51Å
1226	G	84.6	Confident	77.4	Confident	4 Å²	4	66.3 Å²	66.3	4%	0.041	36%	0.357	C	S	.	.	S	Bend	trans	80.4	26.8	166	0	0	0	0	0	115	P1224 V1254	P1224-G1226 PolarHBondContact O-N 2.99Å; G1226-V1254 PolarHBondContact O-N 2.87Å
1227	F	89.7	Confident	77	Confident	25 Å²	25	72.2 Å²	72.2	11%	0.11	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	158.3	167.3	69.5	-80.1	0	0	0	110.1	L1216 L1225 I1229 I1250 R1252 L1253 A1259 L1265 M1291 L1298 I1300	L1216-F1227 HydrophobicContact CD1-CD1 4.3Å; L1216-F1227 HydrophobicContact CD1-CE1 3.79Å; L1225-F1227 HydrophobicContact CB-CD1 4.01Å; L1225-F1227 HydrophobicContact CB-CE1 3.78Å; L1225-F1227 HydrophobicContact CD1-CE1 4.24Å; F1227-I1229 HydrophobicContact CD2-CG2 4.19Å; F1227-I1229 HydrophobicContact CE2-CG2 3.98Å; F1227-I1250 HydrophobicContact CB-CG2 4.31Å; F1227-I1250 HydrophobicContact CD2-CD1 4.28Å; F1227-I1250 HydrophobicContact CD2-CG1 4.28Å; F1227-R1252 WeakPolarHBondContact CA-O 3.47Å; F1227-L1253 HydrophobicContact CB-CD2 3.64Å; F1227-A1259 HydrophobicContact CB-CB 3.93Å; F1227-A1259 HydrophobicContact CD1-CB 3.69Å; F1227-A1259 HydrophobicContact CG-CB 4.19Å; F1227-L1265 HydrophobicContact CD1-CD1 4.47Å; F1227-M1291 HydrophobicContact CE2-CE 4.14Å; F1227-M1291 HydrophobicContact CE2-SD 3.72Å; F1227-M1291 HydrophobicContact CZ-CE 4.35Å; F1227-M1291 HydrophobicContact CZ-SD 3.66Å; F1227-L1298 HydrophobicContact CE1-CD2 4.35Å; F1227-L1298 HydrophobicContact CZ-CD2 4.12Å; F1227-I1300 HydrophobicContact CE1-CD1 4.08Å; F1227-I1300 HydrophobicContact CE2-CD1 4.13Å; F1227-I1300 HydrophobicContact CZ-CD1 3.47Å; F1227-I1300 VanDerWaalsContact CZ-CD1 3.47Å
1228	Y	90	Very high	76.8	Confident	111 Å²	111	74.1 Å²	74.1	44%	0.435	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	152.1	173.9	-67.4	-99.2	0	0	0	109.4	I1250 S1251 R1252 V1254	Y1228-I1250 CarbonylContact O-C 3.36Å; Y1228-I1250 WeakPolarHBondContact O-CA 2.99Å; Y1228-S1251 VanDerWaalsContact C-OG 3.28Å; Y1228-S1251 WeakPolarHBondContact CB-OG 3.02Å; Y1228-S1251 PolarHBondContact O-N 3.38Å; Y1228-S1251 PolarHBondContact O-OG 2.84Å; Y1228-R1252 HydrophobicContact CD2-CG 3.64Å; Y1228-R1252 HydrophobicContact CE2-CG 4.45Å; Y1228-R1252 HydrophobicContact CG-CG 4.04Å; Y1228-R1252 PolarHBondContact N-O 3.3Å; Y1228-R1252 PolarHBondContact OH-NH2 2.74Å; Y1228-V1254 HydrophobicContact CD2-CG2 4.25Å; Y1228-V1254 HydrophobicContact CE2-CG2 3.6Å
1229	I	92	Very high	76.9	Confident	28 Å²	28	76.2 Å²	76.2	14%	0.144	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	163.2	174.6	51.6	175	0	0	0	111	F1227 I1248 F1249 S1251 V1271 L1284 V1287 M1291	F1227-I1229 HydrophobicContact CD2-CG2 4.19Å; F1227-I1229 HydrophobicContact CE2-CG2 3.98Å; I1229-I1248 HydrophobicContact CB-CG2 3.72Å; I1229-I1248 HydrophobicContact CD1-CG2 4.1Å; I1229-I1248 HydrophobicContact CG1-CG2 4.4Å; I1229-I1248 HydrophobicContact CG2-CG2 4.05Å; I1229-F1249 CarbonylContact C-O 3.55Å; I1229-F1249 VanDerWaalsContact CA-O 3.3Å; I1229-F1249 WeakPolarHBondContact CA-O 3.2Å; I1229-S1251 PolarHBondContact O-OG 2.04Å; I1229-V1271 HydrophobicContact CG2-CG2 4.41Å; I1229-L1284 HydrophobicContact CB-CD1 4.23Å; I1229-L1284 HydrophobicContact CD1-CD1 3.83Å; I1229-L1284 HydrophobicContact CG1-CD1 3.81Å; I1229-V1287 HydrophobicContact CD1-CG1 4.21Å; I1229-M1291 HydrophobicContact CD1-CE 4.4Å; I1229-M1291 HydrophobicContact CD1-SD 4.21Å; I1229-M1291 HydrophobicContact CG2-CE 4.27Å
1230	R	91.8	Very high	77.5	Confident	93 Å²	93	80.7 Å²	80.7	35%	0.351	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.1	172.9	64.1	177.7	179	76.6	-2.8	110.1	I1248 F1249 N1268	R1230-I1248 CarbonylContact O-C 3.59Å; R1230-I1248 WeakPolarHBondContact O-CA 3.41Å; R1230-F1249 HydrophobicContact CG-CB 4.25Å; R1230-F1249 PolarHBondContact N-O 2.95Å; R1230-F1249 PolarHBondContact O-N 2.89Å; R1230-N1268 PolarHBondContact NH2-OD1 2.04Å
1231	D	91.3	Very high	78.3	Confident	92 Å²	92	78.4 Å²	78.4	49%	0.492	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	164.1	166.1	-69.4	-37.8	0	0	0	112.4
1232	G	86.2	Confident	78.9	Confident	25 Å²	25	82.3 Å²	82.3	26%	0.258	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-170.3	175.4	0	0	0	0	0	111.4	G1247	G1232-G1247 CarbonylContact C-O 3.53Å; G1232-G1247 PolarHBondContact N-O 2.86Å; G1232-G1247 PolarHBondContact O-N 2.99Å; G1232-G1247 VanDerWaalsContact O-O 3.09Å
1233	T	84.7	Confident	79.8	Confident	91 Å²	91	76.3 Å²	76.3	56%	0.558	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.2	176.9	61.9	0	0	0	0	111.3	M1245	T1233-M1245 CarbonylContact C-O 3.17Å; T1233-M1245 WeakPolarHBondContact CA-O 3.16Å
1234	S	81.8	Confident	80.6	Confident	10 Å²	10	77.2 Å²	77.2	7%	0.07	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	141.5	167.6	64.7	0	0	0	0	110.9	R1236 M1245 E1270	S1234-R1236 PolarHBondContact OG-NE 3.45Å; S1234-R1236 VanDerWaalsContact OG-NE 3.16Å; S1234-M1245 PolarHBondContact N-O 3.47Å; S1234-M1245 PolarHBondContact O-N 3.47Å; S1234-E1270 VanDerWaalsContact CB-CD 3.45Å; S1234-E1270 WeakPolarHBondContact CB-OE1 3.47Å; S1234-E1270 WeakPolarHBondContact CB-OE2 3.27Å; S1234-E1270 PolarHBondContact OG-OE1 3.08Å
1235	V	80.4	Confident	81	Confident	83 Å²	83	75.6 Å²	75.6	50%	0.503	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.6	177.1	-174.7	0	0	0	0	107.9	L1242 K1244	V1235-L1242 HydrophobicContact CG1-CB 3.94Å; V1235-L1242 HydrophobicContact CG1-CD2 3.9Å; V1235-L1242 HydrophobicContact CG1-CG 3.85Å; V1235-K1244 HydrophobicContact CG2-CG 4.39Å
1236	R	74.7	Confident	81.3	Confident	76 Å²	76	79 Å²	79	29%	0.287	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140	-177.6	-55.7	-171.1	-173.1	-177.8	-0.9	109.6	S1234 S1238 V1243 M1245 E1270 L1272	S1234-R1236 PolarHBondContact OG-NE 3.45Å; S1234-R1236 VanDerWaalsContact OG-NE 3.16Å; R1236-S1238 PolarHBondContact O-N 2.94Å; R1236-V1243 PolarHBondContact N-O 3.16Å; R1236-V1243 PolarHBondContact O-N 3.11Å; R1236-M1245 HydrophobicContact CB-CG 4.41Å; R1236-M1245 HydrophobicContact CG-CG 4.16Å; R1236-E1270 IonicContact CZ-OE1 3.53Å; R1236-E1270 IonicContact NE-OE1 3.57Å; R1236-E1270 IonicContact NH2-OE1 2.7Å; R1236-E1270 PolarHBondContact NH2-OE1 2.98Å; R1236-L1272 VanDerWaalsContact NH2-CD2 3.3Å
1237	V	74.7	Confident	81.5	Confident	124 Å²	124	79.3 Å²	79.3	75%	0.752	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.5	177	-177.6	0	0	0	0	108.6	L1242	V1237-L1242 HydrophobicContact CG2-CD1 4.24Å
1238	S	67.9	Low	81.6	Confident	51 Å²	51	78.3 Å²	78.3	36%	0.357	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	162.3	168.8	178.5	0	0	0	0	110	R1236 Q1240 G1241	R1236-S1238 PolarHBondContact O-N 2.94Å; S1238-Q1240 PolarHBondContact O-N 3.01Å; S1238-Q1240 PolarHBondContact OG-N 3.1Å; S1238-G1241 WeakPolarHBondContact CA-O 3.24Å; S1238-G1241 WeakPolarHBondContact CB-O 3.43Å; S1238-G1241 PolarHBondContact N-O 2.91Å; S1238-G1241 PolarHBondContact O-N 2.86Å
1239	A	73	Confident	81.8	Confident	113 Å²	113	74.3 Å²	74.3	93%	0.934	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.7	169.1	0	0	0	0	0	113.5
1240	Q	74.6	Confident	81.8	Confident	187 Å²	187	73 Å²	73	87%	0.874	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	0.1	177	-65.4	171	-13.4	0	0	113.7	S1238	S1238-Q1240 PolarHBondContact O-N 3.01Å; S1238-Q1240 PolarHBondContact OG-N 3.1Å
1241	G	74.6	Confident	81.8	Confident	33 Å²	33	70.4 Å²	70.4	34%	0.34	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	122.8	-166.6	-178.5	0	0	0	0	0	113.8	S1238 V1243	S1238-G1241 WeakPolarHBondContact CA-O 3.24Å; S1238-G1241 WeakPolarHBondContact CB-O 3.43Å; S1238-G1241 PolarHBondContact N-O 2.91Å; S1238-G1241 PolarHBondContact O-N 2.86Å; G1241-V1243 PolarHBondContact O-N 3.42Å
1242	L	72.3	Confident	81.7	Confident	132 Å²	132	72.1 Å²	72.1	69%	0.691	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.3	175.5	-88.6	61.8	0	0	0	109.9	V1235 V1237	V1235-L1242 HydrophobicContact CG1-CB 3.94Å; V1235-L1242 HydrophobicContact CG1-CD2 3.9Å; V1235-L1242 HydrophobicContact CG1-CG 3.85Å; V1237-L1242 HydrophobicContact CG2-CD1 4.24Å
1243	V	78	Confident	81.8	Confident	57 Å²	57	72.4 Å²	72.4	35%	0.345	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129	176.2	179.2	0	0	0	0	109	R1236 G1241 M1245	R1236-V1243 PolarHBondContact N-O 3.16Å; R1236-V1243 PolarHBondContact O-N 3.11Å; G1241-V1243 PolarHBondContact O-N 3.42Å; V1243-M1245 HydrophobicContact CG1-CG 4.35Å; V1243-M1245 HydrophobicContact CG1-SD 4.31Å
1244	K	81.3	Confident	81.7	Confident	162 Å²	162	70.1 Å²	70.1	70%	0.704	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.8	168.3	-66.8	-171.8	176.3	-172.6	0	108.8	V1235	V1235-K1244 HydrophobicContact CG2-CG 4.39Å
1245	M	79.2	Confident	81.5	Confident	67 Å²	67	74.9 Å²	74.9	33%	0.33	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	143.7	177.5	-63.7	-85.9	-72.1	0	0	108.8	T1233 S1234 R1236 V1243	T1233-M1245 CarbonylContact C-O 3.17Å; T1233-M1245 WeakPolarHBondContact CA-O 3.16Å; S1234-M1245 PolarHBondContact N-O 3.47Å; S1234-M1245 PolarHBondContact O-N 3.47Å; R1236-M1245 HydrophobicContact CB-CG 4.41Å; R1236-M1245 HydrophobicContact CG-CG 4.16Å; V1243-M1245 HydrophobicContact CG1-CG 4.35Å; V1243-M1245 HydrophobicContact CG1-SD 4.31Å
1246	P	85.2	Confident	81	Confident	96 Å²	96	74 Å²	74	62%	0.623	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.7	146	164.4	30.1	-33.8	0	0	0	109.7
1247	G	88.2	Confident	81	Confident	10 Å²	10	70.9 Å²	70.9	10%	0.103	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	153	177.1	0	0	0	0	0	111.2	G1232 F1249	G1232-G1247 CarbonylContact C-O 3.53Å; G1232-G1247 PolarHBondContact N-O 2.86Å; G1232-G1247 PolarHBondContact O-N 2.99Å; G1232-G1247 VanDerWaalsContact O-O 3.09Å; G1247-F1249 VanDerWaalsContact O-CD2 3.29Å; G1247-F1249 WeakPolarHBondContact O-CD2 3.43Å; G1247-F1249 VanDerWaalsContact O-CE2 3.28Å; G1247-F1249 WeakPolarHBondContact O-CE2 3.07Å
1248	I	92.7	Very high	81.2	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	139.5	-178.9	-63.2	-178.5	0	0	0	109	I1229 R1230 E1270 V1271 V1279 L1284 V1287	I1229-I1248 HydrophobicContact CB-CG2 3.72Å; I1229-I1248 HydrophobicContact CD1-CG2 4.1Å; I1229-I1248 HydrophobicContact CG1-CG2 4.4Å; I1229-I1248 HydrophobicContact CG2-CG2 4.05Å; R1230-I1248 CarbonylContact O-C 3.59Å; R1230-I1248 WeakPolarHBondContact O-CA 3.41Å; I1248-E1270 CarbonylContact O-C 3.46Å; I1248-E1270 WeakPolarHBondContact O-CA 3.36Å; I1248-V1271 PolarHBondContact O-N 2.88Å; I1248-V1279 HydrophobicContact CB-CG1 4.06Å; I1248-V1279 HydrophobicContact CD1-CG1 3.73Å; I1248-V1279 HydrophobicContact CG1-CG1 3.89Å; I1248-L1284 HydrophobicContact CD1-CD1 4.05Å; I1248-L1284 HydrophobicContact CG1-CD1 4.3Å; I1248-L1284 HydrophobicContact CG2-CD1 3.98Å; I1248-V1287 HydrophobicContact CD1-CB 3.69Å; I1248-V1287 HydrophobicContact CD1-CG1 3.91Å; I1248-V1287 HydrophobicContact CD1-CG2 3.67Å
1249	F	92.9	Very high	81.9	Confident	27 Å²	27	64.7 Å²	64.7	12%	0.118	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.5	-175.8	-63.3	-98.1	0	0	0	110.7	I1229 R1230 G1247 S1251 D1269 E1270	I1229-F1249 CarbonylContact C-O 3.55Å; I1229-F1249 VanDerWaalsContact CA-O 3.3Å; I1229-F1249 WeakPolarHBondContact CA-O 3.2Å; R1230-F1249 HydrophobicContact CG-CB 4.25Å; R1230-F1249 PolarHBondContact N-O 2.95Å; R1230-F1249 PolarHBondContact O-N 2.89Å; G1247-F1249 VanDerWaalsContact O-CD2 3.29Å; G1247-F1249 WeakPolarHBondContact O-CD2 3.43Å; G1247-F1249 VanDerWaalsContact O-CE2 3.28Å; G1247-F1249 WeakPolarHBondContact O-CE2 3.07Å; F1249-S1251 PolarHBondContact O-N 2.94Å; F1249-D1269 WeakPolarHBondContact CA-O 3.37Å; F1249-E1270 HydrophobicContact CD1-CB 3.86Å; F1249-E1270 HydrophobicContact CD1-CG 4.39Å; F1249-E1270 HydrophobicContact CE1-CB 3.65Å; F1249-E1270 HydrophobicContact CE1-CG 3.97Å; F1249-E1270 HydrophobicContact CZ-CB 4.27Å; F1249-E1270 HydrophobicContact CZ-CG 4.07Å
1250	I	91.9	Very high	82.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	116.9	171.1	-62	-176.5	0	0	0	108.9	F1227 Y1228 L1253 L1265 N1268 D1269 V1271	F1227-I1250 HydrophobicContact CB-CG2 4.31Å; F1227-I1250 HydrophobicContact CD2-CD1 4.28Å; F1227-I1250 HydrophobicContact CD2-CG1 4.28Å; Y1228-I1250 CarbonylContact O-C 3.36Å; Y1228-I1250 WeakPolarHBondContact O-CA 2.99Å; I1250-L1253 HydrophobicContact CG2-CD2 4.01Å; I1250-L1265 HydrophobicContact CD1-CB 3.88Å; I1250-L1265 HydrophobicContact CD1-CD1 3.99Å; I1250-L1265 HydrophobicContact CD1-CD2 4Å; I1250-L1265 HydrophobicContact CD1-CG 4.17Å; I1250-N1268 PolarHBondContact O-N 2.85Å; I1250-D1269 HydrophobicContact CD1-CB 4.21Å; I1250-D1269 HydrophobicContact CG1-CB 4.48Å; I1250-D1269 PolarHBondContact N-O 2.88Å; I1250-V1271 HydrophobicContact CG1-CG2 4.24Å
1251	S	91.8	Very high	82.1	Confident	38 Å²	38	58.2 Å²	58.2	27%	0.266	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-39.8	-173	56.4	0	0	0	0	113.4	Y1228 I1229 F1249 V1267	Y1228-S1251 VanDerWaalsContact C-OG 3.28Å; Y1228-S1251 WeakPolarHBondContact CB-OG 3.02Å; Y1228-S1251 PolarHBondContact O-N 3.38Å; Y1228-S1251 PolarHBondContact O-OG 2.84Å; I1229-S1251 PolarHBondContact O-OG 2.04Å; F1249-S1251 PolarHBondContact O-N 2.94Å; S1251-V1267 WeakPolarHBondContact O-CG1 2.99Å
1252	R	90.2	Very high	82.1	Confident	129 Å²	129	58.4 Å²	58.4	49%	0.487	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	153.3	173.7	59.8	-177.6	178.1	110.3	-3.7	111.1	F1227 Y1228	F1227-R1252 WeakPolarHBondContact CA-O 3.47Å; Y1228-R1252 HydrophobicContact CD2-CG 3.64Å; Y1228-R1252 HydrophobicContact CE2-CG 4.45Å; Y1228-R1252 HydrophobicContact CG-CG 4.04Å; Y1228-R1252 PolarHBondContact N-O 3.3Å; Y1228-R1252 PolarHBondContact OH-NH2 2.74Å
1253	L	87	Confident	82.4	Confident	31 Å²	31	54.5 Å²	54.5	16%	0.162	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	156.1	167.9	-58.7	176.3	0	0	0	109.6	F1227 I1250 A1259 E1260 V1267	F1227-L1253 HydrophobicContact CB-CD2 3.64Å; I1250-L1253 HydrophobicContact CG2-CD2 4.01Å; L1253-A1259 HydrophobicContact CD2-CB 4.19Å; L1253-E1260 HydrophobicContact CB-CB 4.15Å; L1253-E1260 HydrophobicContact CB-CG 4.38Å; L1253-E1260 HydrophobicContact CD1-CB 4.42Å; L1253-E1260 HydrophobicContact CD1-CG 4.36Å; L1253-V1267 HydrophobicContact CD1-CG2 4.46Å; L1253-V1267 HydrophobicContact CG-CG2 4.03Å
1254	V	83.1	Confident	82.6	Confident	42 Å²	42	53.2 Å²	53.2	26%	0.255	32%	0.317	S	S	.	.			trans	-92	125	173.6	174.3	0	0	0	0	109	G1226 Y1228 G1256 G1257 E1260	G1226-V1254 PolarHBondContact O-N 2.87Å; Y1228-V1254 HydrophobicContact CD2-CG2 4.25Å; Y1228-V1254 HydrophobicContact CE2-CG2 3.6Å; V1254-G1256 PolarHBondContact O-N 2.91Å; V1254-G1256 VanDerWaalsContact O-N 3.12Å; V1254-G1257 WeakPolarHBondContact O-CA 3.32Å; V1254-G1257 PolarHBondContact O-N 3.35Å; V1254-E1260 WeakPolarHBondContact O-CB 2.7Å
1255	P	77.9	Confident	82.9	Confident	111 Å²	111	45.8 Å²	45.8	72%	0.721	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	114.4	174.6	-29.4	37.6	0	0	0	112.9	G1257 E1260	P1255-G1257 VanDerWaalsContact C-N 3.31Å; P1255-E1260 WeakPolarHBondContact CA-OE1 3.41Å; P1255-E1260 WeakPolarHBondContact CA-OE2 2.98Å
1256	G	69.6	Low	83.3	Confident	65 Å²	65	43.8 Å²	43.8	67%	0.67	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	12.3	-174	0	0	0	0	0	115.3	V1254 E1260	V1254-G1256 PolarHBondContact O-N 2.91Å; V1254-G1256 VanDerWaalsContact O-N 3.12Å; G1256-E1260 PolarHBondContact N-OE2 3.1Å
1257	G	75.3	Confident	83.5	Confident	10 Å²	10	42.1 Å²	42.1	10%	0.103	27%	0.267	C	S	.	.	S	Bend	trans	-78.5	165	170.7	0	0	0	0	0	112.4	V1254 P1255 A1259 E1260 S1261	V1254-G1257 WeakPolarHBondContact O-CA 3.32Å; V1254-G1257 PolarHBondContact O-N 3.35Å; P1255-G1257 VanDerWaalsContact C-N 3.31Å; G1257-A1259 PolarHBondContact O-N 2.72Å; G1257-E1260 PolarHBondContact O-N 3.2Å; G1257-S1261 WeakPolarHBondContact O-CB 3.37Å; G1257-S1261 PolarHBondContact O-N 2.82Å; G1257-S1261 PolarHBondContact O-OG 2.03Å
1258	L	77.6	Confident	83.5	Confident	45 Å²	45	45.3 Å²	45.3	24%	0.236	28%	0.282	C	S	.	.	H	α-helix	trans	-56.7	-55	-172.8	-174.1	69	0	0	0	111.7	L1216 K1218 L1225 E1260 S1261 T1262	L1216-L1258 HydrophobicContact CB-CD2 4.42Å; K1218-L1258 HydrophobicContact CB-CD2 4.4Å; L1225-L1258 HydrophobicContact CD2-CD2 4.01Å; L1258-E1260 PolarHBondContact O-N 2.6Å; L1258-S1261 PolarHBondContact O-N 3.33Å; L1258-S1261 VanDerWaalsContact O-N 3.1Å; L1258-S1261 PolarHBondContact O-OG 3.26Å; L1258-T1262 WeakPolarHBondContact O-CG2 3.41Å; L1258-T1262 PolarHBondContact O-N 2.6Å; L1258-T1262 VanDerWaalsContact O-N 3.17Å
1259	A	83.6	Confident	83.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-55.8	-45.6	-179.2	0	0	0	0	0	113.3	L1216 L1225 F1227 L1253 G1257 T1262 L1265	L1216-A1259 HydrophobicContact CD1-CB 4.34Å; L1225-A1259 WeakPolarHBondContact O-CB 3.17Å; L1225-A1259 PolarHBondContact O-N 3.16Å; F1227-A1259 HydrophobicContact CB-CB 3.93Å; F1227-A1259 HydrophobicContact CD1-CB 3.69Å; F1227-A1259 HydrophobicContact CG-CB 4.19Å; L1253-A1259 HydrophobicContact CD2-CB 4.19Å; G1257-A1259 PolarHBondContact O-N 2.72Å; A1259-T1262 PolarHBondContact O-N 2.86Å; A1259-T1262 PolarHBondContact O-OG1 2.9Å; A1259-L1265 HydrophobicContact CB-CD1 4.16Å
1260	E	81.7	Confident	83.4	Confident	80 Å²	80	44.2 Å²	44.2	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-46.8	175.4	-165.1	-168	-109.4	0	0	111.4	L1253 V1254 P1255 G1256 G1257 L1258 T1262 G1263	L1253-E1260 HydrophobicContact CB-CB 4.15Å; L1253-E1260 HydrophobicContact CB-CG 4.38Å; L1253-E1260 HydrophobicContact CD1-CB 4.42Å; L1253-E1260 HydrophobicContact CD1-CG 4.36Å; V1254-E1260 WeakPolarHBondContact O-CB 2.7Å; P1255-E1260 WeakPolarHBondContact CA-OE1 3.41Å; P1255-E1260 WeakPolarHBondContact CA-OE2 2.98Å; G1256-E1260 PolarHBondContact N-OE2 3.1Å; G1257-E1260 PolarHBondContact O-N 3.2Å; L1258-E1260 PolarHBondContact O-N 2.6Å; E1260-T1262 PolarHBondContact O-N 3.33Å; E1260-T1262 VanDerWaalsContact O-N 3.12Å; E1260-G1263 PolarHBondContact O-N 2.94Å
1261	S	69.2	Low	83.4	Confident	84 Å²	84	44.3 Å²	44.3	59%	0.587	28%	0.277	S	S	*	.	H	α-helix	trans	-61.8	-22	-178.3	73.4	0	0	0	0	114.2	G1257 L1258	G1257-S1261 WeakPolarHBondContact O-CB 3.37Å; G1257-S1261 PolarHBondContact O-N 2.82Å; G1257-S1261 PolarHBondContact O-OG 2.03Å; L1258-S1261 PolarHBondContact O-N 3.33Å; L1258-S1261 VanDerWaalsContact O-N 3.1Å; L1258-S1261 PolarHBondContact O-OG 3.26Å
1262	T	75.9	Confident	83.3	Confident	36 Å²	36	43.6 Å²	43.6	22%	0.221	27%	0.271	C	S	.	.	H	α-helix	trans	-81.4	-26.4	174.9	68.3	0	0	0	0	113.8	S1199 L1216 L1258 A1259 E1260 L1264	S1199-T1262 VanDerWaalsContact CB-CG2 3.41Å; L1216-T1262 HydrophobicContact CD2-CG2 3.99Å; L1258-T1262 WeakPolarHBondContact O-CG2 3.41Å; L1258-T1262 PolarHBondContact O-N 2.6Å; L1258-T1262 VanDerWaalsContact O-N 3.17Å; A1259-T1262 PolarHBondContact O-N 2.86Å; A1259-T1262 PolarHBondContact O-OG1 2.9Å; E1260-T1262 PolarHBondContact O-N 3.33Å; E1260-T1262 VanDerWaalsContact O-N 3.12Å; T1262-L1264 PolarHBondContact O-N 2.86Å; T1262-L1264 VanDerWaalsContact O-N 3.12Å; T1262-L1264 PolarHBondContact OG1-N 2.37Å; T1262-L1264 VanDerWaalsContact OG1-N 3.16Å
1263	G	77.9	Confident	83.4	Confident	51 Å²	51	39.4 Å²	39.4	53%	0.526	26%	0.257	S	S	.	.			trans	62.3	6.3	-168.1	0	0	0	0	0	115.3	E1260	E1260-G1263 PolarHBondContact O-N 2.94Å
1264	L	83.1	Confident	83.6	Confident	30 Å²	30	38 Å²	38	16%	0.157	25%	0.249	C	C	.	.			trans	-86.9	-6.4	-174.9	-62.4	-174.5	0	0	0	114	S1199 I1201 R1212 V1214 T1262	S1199-L1264 WeakPolarHBondContact O-CD1 3.37Å; I1201-L1264 HydrophobicContact CD1-CD2 4.12Å; I1201-L1264 HydrophobicContact CG1-CD1 4.38Å; I1201-L1264 HydrophobicContact CG1-CD2 3.86Å; R1212-L1264 PolarHBondContact NE-O 2.7Å; R1212-L1264 PolarHBondContact NH1-O 2.94Å; R1212-L1264 PolarHBondContact NH2-O 3.17Å; R1212-L1264 VanDerWaalsContact NH2-O 3.1Å; V1214-L1264 HydrophobicContact CG1-CB 3.62Å; V1214-L1264 HydrophobicContact CG1-CD1 3.96Å; V1214-L1264 HydrophobicContact CG1-CG 4.47Å; V1214-L1264 HydrophobicContact CG2-CB 4.27Å; V1214-L1264 WeakPolarHBondContact CG2-O 3.18Å; T1262-L1264 PolarHBondContact O-N 2.86Å; T1262-L1264 VanDerWaalsContact O-N 3.12Å; T1262-L1264 PolarHBondContact OG1-N 2.37Å; T1262-L1264 VanDerWaalsContact OG1-N 3.16Å
1265	L	87.8	Confident	83.8	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.031	25%	0.249	C	C	.	.			trans	-130.1	142.3	175.1	-64.9	175.5	0	0	0	109.3	V1214 L1216 F1227 I1250 A1259 I1300 V1302	V1214-L1265 HydrophobicContact CB-CD2 4.29Å; V1214-L1265 HydrophobicContact CG1-CD2 4.46Å; V1214-L1265 HydrophobicContact CG1-CG 4.45Å; V1214-L1265 HydrophobicContact CG2-CD2 4.01Å; L1216-L1265 HydrophobicContact CD1-CD1 3.93Å; F1227-L1265 HydrophobicContact CD1-CD1 4.47Å; I1250-L1265 HydrophobicContact CD1-CB 3.88Å; I1250-L1265 HydrophobicContact CD1-CD1 3.99Å; I1250-L1265 HydrophobicContact CD1-CD2 4Å; I1250-L1265 HydrophobicContact CD1-CG 4.17Å; A1259-L1265 HydrophobicContact CB-CD1 4.16Å; L1265-I1300 HydrophobicContact CD1-CD1 4.16Å; L1265-V1302 HydrophobicContact CD2-CG1 3.98Å; L1265-V1302 HydrophobicContact CD2-CG2 4.19Å
1266	A	87.1	Confident	84.1	Confident	24 Å²	24	35.7 Å²	35.7	20%	0.198	24%	0.243	C	C	.	.			trans	-120.1	160.2	175.5	0	0	0	0	0	111.9	D1269 L1309	A1266-D1269 PolarHBondContact N-OD2 2.71Å; A1266-D1269 WeakPolarHBondContact O-CB 3.36Å; A1266-D1269 PolarHBondContact O-N 3.25Å; A1266-L1309 HydrophobicContact CB-CD1 4.18Å
1267	V	88.4	Confident	85.1	Confident	62 Å²	62	36.6 Å²	36.6	38%	0.376	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	137.5	171.8	-178.9	0	0	0	0	109.2	S1251 L1253 D1269	S1251-V1267 WeakPolarHBondContact O-CG1 2.99Å; L1253-V1267 HydrophobicContact CD1-CG2 4.46Å; L1253-V1267 HydrophobicContact CG-CG2 4.03Å; V1267-D1269 VanDerWaalsContact C-N 3.35Å
1268	N	89	Confident	85.8	Confident	76 Å²	76	42.4 Å²	42.4	41%	0.406	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	9.9	-170.9	-55.6	-59	0	0	0	116.8	R1230 I1250 E1270 A1305	R1230-N1268 PolarHBondContact NH2-OD1 2.04Å; I1250-N1268 PolarHBondContact O-N 2.85Å; N1268-E1270 PolarHBondContact O-N 3.43Å; N1268-A1305 HydrophobicContact CB-CB 4.06Å
1269	D	91.5	Very high	86.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-60.8	129.2	165.2	-76.6	1.5	0	0	0	109.6	R1212 F1249 I1250 A1266 V1267 V1302 P1304 A1305	R1212-D1269 IonicContact NH2-OD2 3.83Å; R1212-D1269 PolarHBondContact NH2-OD2 3.42Å; F1249-D1269 WeakPolarHBondContact CA-O 3.37Å; I1250-D1269 HydrophobicContact CD1-CB 4.21Å; I1250-D1269 HydrophobicContact CG1-CB 4.48Å; I1250-D1269 PolarHBondContact N-O 2.88Å; A1266-D1269 PolarHBondContact N-OD2 2.71Å; A1266-D1269 WeakPolarHBondContact O-CB 3.36Å; A1266-D1269 PolarHBondContact O-N 3.25Å; V1267-D1269 VanDerWaalsContact C-N 3.35Å; D1269-V1302 HydrophobicContact CB-CB 4.18Å; D1269-V1302 HydrophobicContact CB-CG1 4.48Å; D1269-V1302 HydrophobicContact CB-CG2 4.36Å; D1269-P1304 VanDerWaalsContact OD1-CA 3.26Å; D1269-P1304 WeakPolarHBondContact OD1-CA 3.44Å; D1269-A1305 PolarHBondContact OD1-N 3.1Å
1270	E	91.5	Very high	86.5	Confident	9 Å²	9	43.4 Å²	43.4	4%	0.042	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.1	177.9	-178.8	-169.8	178.1	0	0	109.5	S1234 R1236 I1248 F1249 N1268 L1272 V1302 R1303	S1234-E1270 VanDerWaalsContact CB-CD 3.45Å; S1234-E1270 WeakPolarHBondContact CB-OE1 3.47Å; S1234-E1270 WeakPolarHBondContact CB-OE2 3.27Å; S1234-E1270 PolarHBondContact OG-OE1 3.08Å; R1236-E1270 IonicContact CZ-OE1 3.53Å; R1236-E1270 IonicContact NE-OE1 3.57Å; R1236-E1270 IonicContact NH2-OE1 2.7Å; R1236-E1270 PolarHBondContact NH2-OE1 2.98Å; I1248-E1270 CarbonylContact O-C 3.46Å; I1248-E1270 WeakPolarHBondContact O-CA 3.36Å; F1249-E1270 HydrophobicContact CD1-CB 3.86Å; F1249-E1270 HydrophobicContact CD1-CG 4.39Å; F1249-E1270 HydrophobicContact CE1-CB 3.65Å; F1249-E1270 HydrophobicContact CE1-CG 3.97Å; F1249-E1270 HydrophobicContact CZ-CB 4.27Å; F1249-E1270 HydrophobicContact CZ-CG 4.07Å; N1268-E1270 PolarHBondContact O-N 3.43Å; E1270-L1272 HydrophobicContact CG-CD2 3.98Å; E1270-V1302 CarbonylContact O-C 3.49Å; E1270-V1302 WeakPolarHBondContact O-CA 3.33Å; E1270-R1303 HydrophobicContact CB-CB 4.23Å; E1270-R1303 PolarHBondContact N-O 3.34Å; E1270-R1303 PolarHBondContact O-N 2.89Å; E1270-R1303 IonicContact OE1-NH1 3.59Å; E1270-R1303 IonicContact OE2-CZ 3.71Å; E1270-R1303 IonicContact OE2-NH1 3.56Å; E1270-R1303 PolarHBondContact OE2-NH1 2.84Å
1271	V	91.9	Very high	86.6	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.3	177.6	-172.3	0	0	0	0	109.5	I1229 I1248 I1250 V1274 V1279 M1291 I1300 V1302	I1229-V1271 HydrophobicContact CG2-CG2 4.41Å; I1248-V1271 PolarHBondContact O-N 2.88Å; I1250-V1271 HydrophobicContact CG1-CG2 4.24Å; V1271-V1274 HydrophobicContact CG1-CG2 3.97Å; V1271-V1279 HydrophobicContact CG1-CG2 4.02Å; V1271-M1291 HydrophobicContact CG1-CE 4.01Å; V1271-M1291 HydrophobicContact CG2-CE 4.41Å; V1271-I1300 HydrophobicContact CG1-CG2 3.65Å; V1271-I1300 HydrophobicContact CG2-CG2 4.45Å; V1271-V1302 HydrophobicContact CG2-CG1 4.37Å
1272	L	90.7	Very high	87.5	Confident	24 Å²	24	42.6 Å²	42.6	13%	0.126	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-36.4	-176.2	-60	178.3	0	0	0	112.8	H1211 R1236 E1270 E1278 V1279 T1301 R1303	H1211-L1272 WeakPolarHBondContact CD2-CD1 3.49Å; H1211-L1272 WeakPolarHBondContact NE2-CD1 3.5Å; R1236-L1272 VanDerWaalsContact NH2-CD2 3.3Å; E1270-L1272 HydrophobicContact CG-CD2 3.98Å; L1272-E1278 WeakPolarHBondContact O-CA 3.45Å; L1272-V1279 PolarHBondContact O-N 3.21Å; L1272-T1301 PolarHBondContact N-O 3.17Å; L1272-R1303 HydrophobicContact CD1-CB 4.16Å
1273	E	91.7	Very high	88.2	Confident	41 Å²	41	43 Å²	43	19%	0.192	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	147.4	177.5	-48.9	167	159.7	0	0	110.3	R1213 I1277 T1301	R1213-E1273 IonicContact CZ-OE2 3.66Å; R1213-E1273 IonicContact NE-OE2 3.7Å; R1213-E1273 IonicContact NH2-OE1 3.06Å; R1213-E1273 IonicContact NH2-OE2 2.71Å; R1213-E1273 PolarHBondContact NH2-OE2 2.84Å; E1273-I1277 CarbonylContact C-O 3.51Å; E1273-I1277 VanDerWaalsContact CA-O 3.24Å; E1273-I1277 WeakPolarHBondContact CA-O 2.99Å; E1273-T1301 PolarHBondContact N-O 3.43Å; E1273-T1301 PolarHBondContact O-N 2.99Å; E1273-T1301 WeakPolarHBondContact OE2-CB 3.35Å; E1273-T1301 PolarHBondContact OE2-OG1 3.35Å
1274	V	90.7	Very high	88.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.5	169.3	178.2	0	0	0	0	108.1	V1271 G1276 I1277 V1279 V1287 M1290 M1291 L1298	V1271-V1274 HydrophobicContact CG1-CG2 3.97Å; V1274-G1276 PolarHBondContact O-N 3.36Å; V1274-I1277 PolarHBondContact N-O 3.26Å; V1274-I1277 WeakPolarHBondContact O-CB 3.44Å; V1274-I1277 PolarHBondContact O-N 3.1Å; V1274-V1279 HydrophobicContact CG2-CG2 4.03Å; V1274-V1287 HydrophobicContact CG2-CG1 4.1Å; V1274-M1290 HydrophobicContact CB-CE 3.97Å; V1274-M1290 HydrophobicContact CG1-CB 4.34Å; V1274-M1291 HydrophobicContact CG1-CG 3.83Å; V1274-M1291 HydrophobicContact CG2-CE 3.57Å; V1274-M1291 HydrophobicContact CG2-CG 4.1Å; V1274-L1298 HydrophobicContact CG1-CD1 3.74Å
1275	N	88.1	Confident	89.2	Confident	49 Å²	49	46.4 Å²	46.4	26%	0.262	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	37.1	-176.2	-58.7	-47	0	0	0	113.9	I1277 N1294 L1298 I1299	N1275-I1277 VanDerWaalsContact C-N 3.34Å; N1275-N1294 WeakPolarHBondContact ND2-CB 3.04Å; N1275-L1298 WeakPolarHBondContact ND2-CD1 3.43Å; N1275-I1299 PolarHBondContact N-O 3.41Å; N1275-I1299 PolarHBondContact OD1-N 3.39Å
1276	G	84.7	Confident	89.3	Confident	57 Å²	57	50.8 Å²	50.8	59%	0.588	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	3.8	-178.7	0	0	0	0	0	115.3	V1274	V1274-G1276 PolarHBondContact O-N 3.36Å
1277	I	89.3	Confident	89.5	Confident	84 Å²	84	49.6 Å²	49.6	43%	0.431	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.7	175.6	-51.1	175.9	0	0	0	108.9	E1273 V1274 N1275 M1290	E1273-I1277 CarbonylContact C-O 3.51Å; E1273-I1277 VanDerWaalsContact CA-O 3.24Å; E1273-I1277 WeakPolarHBondContact CA-O 2.99Å; V1274-I1277 PolarHBondContact N-O 3.26Å; V1274-I1277 WeakPolarHBondContact O-CB 3.44Å; V1274-I1277 PolarHBondContact O-N 3.1Å; N1275-I1277 VanDerWaalsContact C-N 3.34Å; I1277-M1290 HydrophobicContact CB-CE 3.72Å; I1277-M1290 HydrophobicContact CD1-CE 4.25Å; I1277-M1290 HydrophobicContact CG2-CE 3.79Å; I1277-M1290 HydrophobicContact CG2-SD 4.34Å
1278	E	90.2	Very high	89.5	Confident	131 Å²	131	49 Å²	49	61%	0.612	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	142.5	175.6	-71.9	-167.1	-174.3	0	0	112.6	L1272 K1282	L1272-E1278 WeakPolarHBondContact O-CA 3.45Å; E1278-K1282 WeakPolarHBondContact O-CD 3.47Å; E1278-K1282 WeakPolarHBondContact O-CE 3.26Å
1279	V	90	Very high	89.4	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.042	30%	0.301	C	S	.	.			trans	-83.6	-18.1	176.4	161.7	0	0	0	0	112.7	I1248 V1271 L1272 V1274 G1281 K1282 V1287	I1248-V1279 HydrophobicContact CB-CG1 4.06Å; I1248-V1279 HydrophobicContact CD1-CG1 3.73Å; I1248-V1279 HydrophobicContact CG1-CG1 3.89Å; V1271-V1279 HydrophobicContact CG1-CG2 4.02Å; L1272-V1279 PolarHBondContact O-N 3.21Å; V1274-V1279 HydrophobicContact CG2-CG2 4.03Å; V1279-G1281 PolarHBondContact O-N 3.36Å; V1279-G1281 VanDerWaalsContact O-N 3.17Å; V1279-K1282 PolarHBondContact O-N 2.87Å; V1279-V1287 HydrophobicContact CG1-CG2 4.19Å; V1279-V1287 HydrophobicContact CG2-CG1 3.98Å; V1279-V1287 HydrophobicContact CG2-CG2 4.07Å
1280	A	85.8	Confident	89.2	Confident	60 Å²	60	51.7 Å²	51.7	50%	0.496	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	118.2	-175.4	0	0	0	0	0	112.4
1281	G	84.6	Confident	89	Confident	78 Å²	78	51.9 Å²	51.9	80%	0.804	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	3.9	177.2	0	0	0	0	0	116	V1279	V1279-G1281 PolarHBondContact O-N 3.36Å; V1279-G1281 VanDerWaalsContact O-N 3.17Å
1282	K	88.9	Confident	88.7	Confident	68 Å²	68	57.2 Å²	57.2	30%	0.296	34%	0.337	S	S	.	.			trans	-87.9	157.6	170.2	-65.5	173.9	177.7	-77.3	0	111.3	E1278 V1279 Q1286 V1287 M1290	E1278-K1282 WeakPolarHBondContact O-CD 3.47Å; E1278-K1282 WeakPolarHBondContact O-CE 3.26Å; V1279-K1282 PolarHBondContact O-N 2.87Å; K1282-Q1286 HydrophobicContact CB-CB 4.32Å; K1282-V1287 HydrophobicContact CB-CG2 3.65Å; K1282-V1287 HydrophobicContact CD-CG2 3.88Å; K1282-V1287 HydrophobicContact CG-CG2 4.43Å; K1282-M1290 HydrophobicContact CD-CE 4.01Å; K1282-M1290 HydrophobicContact CD-SD 3.61Å; K1282-M1290 WeakPolarHBondContact CE-SD 3.34Å; K1282-M1290 PolarHBondContact NZ-SD 3.16Å
1283	S	90.3	Very high	88.3	Confident	46 Å²	46	59.8 Å²	59.8	32%	0.322	36%	0.362	S	S	.	.			trans	-78.4	160.9	168.2	72.6	0	0	0	0	111.9	D1285 Q1286 V1287	S1283-D1285 PolarHBondContact O-N 3.1Å; S1283-Q1286 PolarHBondContact O-N 2.9Å; S1283-Q1286 WeakPolarHBondContact OG-CG 3.35Å; S1283-Q1286 PolarHBondContact OG-N 2.77Å; S1283-V1287 PolarHBondContact O-N 2.84Å; S1283-V1287 VanDerWaalsContact O-N 3.1Å
1284	L	91.1	Very high	87.6	Confident	42 Å²	42	61.8 Å²	61.8	22%	0.22	37%	0.374	C	S	.	.	H	α-helix	trans	-55.5	-39.4	173.9	-170.2	63.5	0	0	0	111.9	I1229 I1248 V1287 T1288	I1229-L1284 HydrophobicContact CB-CD1 4.23Å; I1229-L1284 HydrophobicContact CD1-CD1 3.83Å; I1229-L1284 HydrophobicContact CG1-CD1 3.81Å; I1248-L1284 HydrophobicContact CD1-CD1 4.05Å; I1248-L1284 HydrophobicContact CG1-CD1 4.3Å; I1248-L1284 HydrophobicContact CG2-CD1 3.98Å; L1284-V1287 PolarHBondContact O-N 3.37Å; L1284-T1288 WeakPolarHBondContact O-CB 3.28Å; L1284-T1288 PolarHBondContact O-N 3.24Å; L1284-T1288 PolarHBondContact O-OG1 2.98Å
1285	D	89.7	Confident	86.9	Confident	109 Å²	109	62.9 Å²	62.9	58%	0.583	38%	0.383	S	S	*	.	H	α-helix	trans	-64.9	-50.7	177.7	-40.8	-58.6	0	0	0	111	S1283 V1287 T1288 D1289	S1283-D1285 PolarHBondContact O-N 3.1Å; D1285-V1287 PolarHBondContact O-N 3.48Å; D1285-V1287 VanDerWaalsContact O-N 3.16Å; D1285-T1288 CarbonylContact O-C 3.59Å; D1285-T1288 WeakPolarHBondContact O-CA 3.5Å; D1285-T1288 VanDerWaalsContact O-CB 3.28Å; D1285-T1288 WeakPolarHBondContact O-CB 3.27Å; D1285-T1288 PolarHBondContact O-N 3.02Å; D1285-D1289 PolarHBondContact O-N 3.04Å
1286	Q	90.3	Very high	86.2	Confident	98 Å²	98	64.5 Å²	64.5	46%	0.458	40%	0.397	S	S	.	.	H	α-helix	trans	-57.8	-33.7	177.8	-73.3	173.1	-6.9	0	0	113	K1282 S1283 M1290	K1282-Q1286 HydrophobicContact CB-CB 4.32Å; S1283-Q1286 PolarHBondContact O-N 2.9Å; S1283-Q1286 WeakPolarHBondContact OG-CG 3.35Å; S1283-Q1286 PolarHBondContact OG-N 2.77Å; Q1286-M1290 WeakPolarHBondContact O-CB 3.17Å; Q1286-M1290 VanDerWaalsContact O-CG 3.26Å; Q1286-M1290 WeakPolarHBondContact O-CG 3.48Å; Q1286-M1290 PolarHBondContact O-N 2.78Å; Q1286-M1290 VanDerWaalsContact O-N 3.11Å
1287	V	90.6	Very high	86	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-79.2	-31.4	176.5	176.2	0	0	0	0	111.4	I1229 I1248 V1274 V1279 K1282 S1283 L1284 D1285 M1290 M1291	I1229-V1287 HydrophobicContact CD1-CG1 4.21Å; I1248-V1287 HydrophobicContact CD1-CB 3.69Å; I1248-V1287 HydrophobicContact CD1-CG1 3.91Å; I1248-V1287 HydrophobicContact CD1-CG2 3.67Å; V1274-V1287 HydrophobicContact CG2-CG1 4.1Å; V1279-V1287 HydrophobicContact CG1-CG2 4.19Å; V1279-V1287 HydrophobicContact CG2-CG1 3.98Å; V1279-V1287 HydrophobicContact CG2-CG2 4.07Å; K1282-V1287 HydrophobicContact CB-CG2 3.65Å; K1282-V1287 HydrophobicContact CD-CG2 3.88Å; K1282-V1287 HydrophobicContact CG-CG2 4.43Å; S1283-V1287 PolarHBondContact O-N 2.84Å; S1283-V1287 VanDerWaalsContact O-N 3.1Å; L1284-V1287 PolarHBondContact O-N 3.37Å; D1285-V1287 PolarHBondContact O-N 3.48Å; D1285-V1287 VanDerWaalsContact O-N 3.16Å; V1287-M1290 PolarHBondContact O-N 3.25Å; V1287-M1291 HydrophobicContact CG1-CE 4.09Å; V1287-M1291 WeakPolarHBondContact O-CG 3.12Å; V1287-M1291 PolarHBondContact O-N 2.98Å
1288	T	88.7	Confident	85.8	Confident	50 Å²	50	60.7 Å²	60.7	31%	0.307	36%	0.364	S	S	.	.	H	α-helix	trans	-63.1	-48.2	170.1	-56.5	0	0	0	0	110.6	L1284 D1285 M1290 M1291 I1292	L1284-T1288 WeakPolarHBondContact O-CB 3.28Å; L1284-T1288 PolarHBondContact O-N 3.24Å; L1284-T1288 PolarHBondContact O-OG1 2.98Å; D1285-T1288 CarbonylContact O-C 3.59Å; D1285-T1288 WeakPolarHBondContact O-CA 3.5Å; D1285-T1288 VanDerWaalsContact O-CB 3.28Å; D1285-T1288 WeakPolarHBondContact O-CB 3.27Å; D1285-T1288 PolarHBondContact O-N 3.02Å; T1288-M1290 PolarHBondContact O-N 2.04Å; T1288-M1291 PolarHBondContact O-N 3.05Å; T1288-M1291 VanDerWaalsContact O-N 3.09Å; T1288-I1292 HydrophobicContact CG2-CD1 3.82Å; T1288-I1292 HydrophobicContact CG2-CG1 4.46Å; T1288-I1292 WeakPolarHBondContact O-CG1 3.48Å; T1288-I1292 PolarHBondContact O-N 3.34Å
1289	D	87.2	Confident	85.8	Confident	100 Å²	100	56.5 Å²	56.5	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-57.7	-46	175.2	-63.6	-27.7	0	0	0	111.5	D1285 M1291 I1292 A1293	D1285-D1289 PolarHBondContact O-N 3.04Å; D1289-M1291 VanDerWaalsContact C-N 3.27Å; D1289-M1291 PolarHBondContact O-N 3.34Å; D1289-I1292 PolarHBondContact O-N 2.91Å; D1289-A1293 VanDerWaalsContact O-CB 3.31Å; D1289-A1293 WeakPolarHBondContact O-CB 3.37Å; D1289-A1293 PolarHBondContact O-N 2.74Å
1290	M	87.7	Confident	85.8	Confident	32 Å²	32	56.2 Å²	56.2	16%	0.158	34%	0.344	C	S	.	.	H	α-helix	trans	-62.3	-29.1	176.1	-80	172.7	37.3	0	0	114	V1274 I1277 K1282 Q1286 V1287 T1288	V1274-M1290 HydrophobicContact CB-CE 3.97Å; V1274-M1290 HydrophobicContact CG1-CB 4.34Å; I1277-M1290 HydrophobicContact CB-CE 3.72Å; I1277-M1290 HydrophobicContact CD1-CE 4.25Å; I1277-M1290 HydrophobicContact CG2-CE 3.79Å; I1277-M1290 HydrophobicContact CG2-SD 4.34Å; K1282-M1290 HydrophobicContact CD-CE 4.01Å; K1282-M1290 HydrophobicContact CD-SD 3.61Å; K1282-M1290 WeakPolarHBondContact CE-SD 3.34Å; K1282-M1290 PolarHBondContact NZ-SD 3.16Å; Q1286-M1290 WeakPolarHBondContact O-CB 3.17Å; Q1286-M1290 VanDerWaalsContact O-CG 3.26Å; Q1286-M1290 WeakPolarHBondContact O-CG 3.48Å; Q1286-M1290 PolarHBondContact O-N 2.78Å; Q1286-M1290 VanDerWaalsContact O-N 3.11Å; V1287-M1290 PolarHBondContact O-N 3.25Å; T1288-M1290 PolarHBondContact O-N 2.04Å
1291	M	87.9	Confident	86	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.059	32%	0.322	C	S	.	.	H	α-helix	trans	-78.8	-39.9	173.2	-72.2	-175.5	-178.6	0	0	112.1	F1227 I1229 V1271 V1274 V1287 T1288 D1289 A1295 L1298 I1300	F1227-M1291 HydrophobicContact CE2-CE 4.14Å; F1227-M1291 HydrophobicContact CE2-SD 3.72Å; F1227-M1291 HydrophobicContact CZ-CE 4.35Å; F1227-M1291 HydrophobicContact CZ-SD 3.66Å; I1229-M1291 HydrophobicContact CD1-CE 4.4Å; I1229-M1291 HydrophobicContact CD1-SD 4.21Å; I1229-M1291 HydrophobicContact CG2-CE 4.27Å; V1271-M1291 HydrophobicContact CG1-CE 4.01Å; V1271-M1291 HydrophobicContact CG2-CE 4.41Å; V1274-M1291 HydrophobicContact CG1-CG 3.83Å; V1274-M1291 HydrophobicContact CG2-CE 3.57Å; V1274-M1291 HydrophobicContact CG2-CG 4.1Å; V1287-M1291 HydrophobicContact CG1-CE 4.09Å; V1287-M1291 WeakPolarHBondContact O-CG 3.12Å; V1287-M1291 PolarHBondContact O-N 2.98Å; T1288-M1291 PolarHBondContact O-N 3.05Å; T1288-M1291 VanDerWaalsContact O-N 3.09Å; D1289-M1291 VanDerWaalsContact C-N 3.27Å; D1289-M1291 PolarHBondContact O-N 3.34Å; M1291-A1295 PolarHBondContact O-N 3.31Å; M1291-L1298 HydrophobicContact CB-CD1 4.33Å; M1291-L1298 HydrophobicContact CB-CD2 4.06Å; M1291-L1298 HydrophobicContact CG-CD1 4.27Å; M1291-L1298 HydrophobicContact CG-CD2 4.07Å; M1291-I1300 HydrophobicContact CE-CD1 4.4Å
1292	I	84.5	Confident	86.3	Confident	114 Å²	114	49.8 Å²	49.8	59%	0.585	28%	0.283	S	S	*	.	H	α-helix	trans	-67.5	-45.6	-179.9	-69.8	171.6	0	0	0	111	T1288 D1289 N1294 A1295	T1288-I1292 HydrophobicContact CG2-CD1 3.82Å; T1288-I1292 HydrophobicContact CG2-CG1 4.46Å; T1288-I1292 WeakPolarHBondContact O-CG1 3.48Å; T1288-I1292 PolarHBondContact O-N 3.34Å; D1289-I1292 PolarHBondContact O-N 2.91Å; I1292-N1294 PolarHBondContact O-N 3.35Å; I1292-A1295 WeakPolarHBondContact O-CB 3.32Å; I1292-A1295 PolarHBondContact O-N 2.8Å; I1292-A1295 VanDerWaalsContact O-N 3.08Å
1293	A	81.7	Confident	86.3	Confident	78 Å²	78	49.7 Å²	49.7	65%	0.645	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-17.9	-176.5	0	0	0	0	0	114.8	D1289	D1289-A1293 VanDerWaalsContact O-CB 3.31Å; D1289-A1293 WeakPolarHBondContact O-CB 3.37Å; D1289-A1293 PolarHBondContact O-N 2.74Å
1294	N	78.3	Confident	85.9	Confident	83 Å²	83	48 Å²	48	44%	0.444	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.5	30.8	177.5	-81.1	-76.6	0	0	0	112.5	N1275 I1292 S1296 N1297 L1298	N1275-N1294 WeakPolarHBondContact ND2-CB 3.04Å; I1292-N1294 PolarHBondContact O-N 3.35Å; N1294-S1296 PolarHBondContact O-N 3.06Å; N1294-N1297 CarbonylContact O-C 3.53Å; N1294-N1297 PolarHBondContact O-N 3.03Å; N1294-L1298 PolarHBondContact O-N 2.78Å
1295	A	75.9	Confident	85.4	Confident	23 Å²	23	48.8 Å²	48.8	19%	0.19	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-9	-174.3	0	0	0	0	0	115.8	K1218 L1225 M1291 I1292	K1218-A1295 VanDerWaalsContact CB-O 3.31Å; K1218-A1295 WeakPolarHBondContact CB-O 3.29Å; L1225-A1295 HydrophobicContact CD1-CB 4.13Å; M1291-A1295 PolarHBondContact O-N 3.31Å; I1292-A1295 WeakPolarHBondContact O-CB 3.32Å; I1292-A1295 PolarHBondContact O-N 2.8Å; I1292-A1295 VanDerWaalsContact O-N 3.08Å
1296	S	74.2	Confident	84.3	Confident	82 Å²	82	47.1 Å²	47.1	57%	0.573	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-34	172	54.6	0	0	0	0	112.9	K1218 N1294	K1218-S1296 PolarHBondContact N-O 3.22Å; K1218-S1296 VanDerWaalsContact N-O 3.08Å; N1294-S1296 PolarHBondContact O-N 3.06Å
1297	N	78.5	Confident	82.9	Confident	61 Å²	61	50 Å²	50	33%	0.326	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	52.1	-166.3	-177.8	40.2	0	0	0	110.6	R1215 N1294 I1299	R1215-N1297 PolarHBondContact NE-OD1 2.87Å; R1215-N1297 PolarHBondContact NH2-OD1 3.11Å; N1294-N1297 CarbonylContact O-C 3.53Å; N1294-N1297 PolarHBondContact O-N 3.03Å; N1297-I1299 PolarHBondContact O-N 2.72Å
1298	L	86.6	Confident	81.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	121.2	-169.7	-176.8	61.9	0	0	0	111.5	L1216 L1225 F1227 V1274 N1275 M1291 N1294 I1300	L1216-L1298 PolarHBondContact N-O 3.5Å; L1216-L1298 PolarHBondContact O-N 2.81Å; L1216-L1298 VanDerWaalsContact O-N 3.1Å; L1225-L1298 HydrophobicContact CD1-CD2 3.51Å; F1227-L1298 HydrophobicContact CE1-CD2 4.35Å; F1227-L1298 HydrophobicContact CZ-CD2 4.12Å; V1274-L1298 HydrophobicContact CG1-CD1 3.74Å; N1275-L1298 WeakPolarHBondContact ND2-CD1 3.43Å; M1291-L1298 HydrophobicContact CB-CD1 4.33Å; M1291-L1298 HydrophobicContact CB-CD2 4.06Å; M1291-L1298 HydrophobicContact CG-CD1 4.27Å; M1291-L1298 HydrophobicContact CG-CD2 4.07Å; N1294-L1298 PolarHBondContact O-N 2.78Å; L1298-I1300 HydrophobicContact CD1-CG1 4.49Å; L1298-I1300 HydrophobicContact CD2-CD1 3.77Å; L1298-I1300 HydrophobicContact CD2-CG1 4Å; L1298-I1300 HydrophobicContact CG-CD1 4.14Å; L1298-I1300 HydrophobicContact CG-CG1 3.81Å
1299	I	88.6	Confident	79.4	Confident	44 Å²	44	61.8 Å²	61.8	23%	0.226	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.9	173	-60.6	175.8	0	0	0	109	I1202 R1213 V1214 R1215 N1275 N1297	I1202-I1299 HydrophobicContact CD1-CB 4.39Å; I1202-I1299 HydrophobicContact CD1-CD1 3.84Å; I1202-I1299 HydrophobicContact CD1-CG1 3.87Å; I1202-I1299 HydrophobicContact CD1-CG2 3.7Å; R1213-I1299 HydrophobicContact CG-CG2 3.64Å; V1214-I1299 CarbonylContact O-C 3.34Å; V1214-I1299 WeakPolarHBondContact O-CA 3.27Å; R1215-I1299 HydrophobicContact CG-CG1 4.18Å; N1275-I1299 PolarHBondContact N-O 3.41Å; N1275-I1299 PolarHBondContact OD1-N 3.39Å; N1297-I1299 PolarHBondContact O-N 2.72Å
1300	I	89.9	Confident	77.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126.1	-179.5	-43.3	-178.6	0	0	0	109.5	R1213 V1214 L1216 F1227 L1265 V1271 M1291 L1298 V1302	R1213-I1300 CarbonylContact C-O 3.57Å; R1213-I1300 WeakPolarHBondContact CA-O 3.24Å; V1214-I1300 PolarHBondContact N-O 3.04Å; V1214-I1300 PolarHBondContact O-N 2.92Å; L1216-I1300 HydrophobicContact CD1-CD1 4.33Å; F1227-I1300 HydrophobicContact CE1-CD1 4.08Å; F1227-I1300 HydrophobicContact CE2-CD1 4.13Å; F1227-I1300 HydrophobicContact CZ-CD1 3.47Å; F1227-I1300 VanDerWaalsContact CZ-CD1 3.47Å; L1265-I1300 HydrophobicContact CD1-CD1 4.16Å; V1271-I1300 HydrophobicContact CG1-CG2 3.65Å; V1271-I1300 HydrophobicContact CG2-CG2 4.45Å; M1291-I1300 HydrophobicContact CE-CD1 4.4Å; L1298-I1300 HydrophobicContact CD1-CG1 4.49Å; L1298-I1300 HydrophobicContact CD2-CD1 3.77Å; L1298-I1300 HydrophobicContact CD2-CG1 4Å; L1298-I1300 HydrophobicContact CG-CD1 4.14Å; L1298-I1300 HydrophobicContact CG-CG1 3.81Å; I1300-V1302 HydrophobicContact CG2-CG1 3.7Å
1301	T	91	Very high	75.7	Confident	4 Å²	4	63.8 Å²	63.8	3%	0.025	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	119.7	168.7	-53.5	0	0	0	0	109.1	V1207 R1213 L1272 E1273	V1207-T1301 HydrophobicContact CG1-CG2 3.78Å; R1213-T1301 PolarHBondContact NE-OG1 3.19Å; L1272-T1301 PolarHBondContact N-O 3.17Å; E1273-T1301 PolarHBondContact N-O 3.43Å; E1273-T1301 PolarHBondContact O-N 2.99Å; E1273-T1301 WeakPolarHBondContact OE2-CB 3.35Å; E1273-T1301 PolarHBondContact OE2-OG1 3.35Å
1302	V	90.1	Very high	73.7	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.1	-178.9	-57.9	0	0	0	0	112.5	H1211 R1212 L1265 D1269 E1270 V1271 I1300	H1211-V1302 CarbonylContact C-O 3.59Å; H1211-V1302 WeakPolarHBondContact CA-O 3.49Å; R1212-V1302 HydrophobicContact CB-CG2 4.24Å; R1212-V1302 PolarHBondContact N-O 3.44Å; R1212-V1302 WeakPolarHBondContact O-CG2 3.41Å; R1212-V1302 PolarHBondContact O-N 3.01Å; L1265-V1302 HydrophobicContact CD2-CG1 3.98Å; L1265-V1302 HydrophobicContact CD2-CG2 4.19Å; D1269-V1302 HydrophobicContact CB-CB 4.18Å; D1269-V1302 HydrophobicContact CB-CG1 4.48Å; D1269-V1302 HydrophobicContact CB-CG2 4.36Å; E1270-V1302 CarbonylContact O-C 3.49Å; E1270-V1302 WeakPolarHBondContact O-CA 3.33Å; V1271-V1302 HydrophobicContact CG2-CG1 4.37Å; I1300-V1302 HydrophobicContact CG2-CG1 3.7Å
1303	R	88.7	Confident	71.2	Confident	66 Å²	66	71.2 Å²	71.2	25%	0.249	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	112.6	160.2	173.7	179.3	-70	132.8	-1.4	107.9	H1211 E1270 L1272	H1211-R1303 PolarHBondContact NE2-NE 3.1Å; H1211-R1303 PolarHBondContact NE2-NH2 2.82Å; E1270-R1303 HydrophobicContact CB-CB 4.23Å; E1270-R1303 PolarHBondContact N-O 3.34Å; E1270-R1303 PolarHBondContact O-N 2.89Å; E1270-R1303 IonicContact OE1-NH1 3.59Å; E1270-R1303 IonicContact OE2-CZ 3.71Å; E1270-R1303 IonicContact OE2-NH1 3.56Å; E1270-R1303 PolarHBondContact OE2-NH1 2.84Å; L1272-R1303 HydrophobicContact CD1-CB 4.16Å
1304	P	83.9	Confident	68.8	Low	11 Å²	11	73.1 Å²	73.1	7%	0.071	38%	0.382	C	S	.	.			trans	-62.8	143.4	-176.7	-26.7	37.1	0	0	0	114	R1212 D1269 T1310	R1212-P1304 HydrophobicContact CB-CG 4.02Å; D1269-P1304 VanDerWaalsContact OD1-CA 3.26Å; D1269-P1304 WeakPolarHBondContact OD1-CA 3.44Å; P1304-T1310 HydrophobicContact CG-CG2 4.16Å
1305	A	78.7	Confident	66.7	Low	58 Å²	58	75 Å²	75	48%	0.479	39%	0.392	S	S	.	.	S	Bend	trans	-70	-43.2	178	0	0	0	0	0	113.1	N1268 D1269	N1268-A1305 HydrophobicContact CB-CB 4.06Å; D1269-A1305 PolarHBondContact OD1-N 3.1Å
1306	D	66.6	Low	64.6	Low	73 Å²	73	81.7 Å²	81.7	39%	0.39	42%	0.424	S	S	.	.	S	Bend	trans	-99.3	116.1	171.6	-171.1	-8.1	0	0	0	110.1	R1308 L1309	D1306-R1308 PolarHBondContact O-N 3.49Å; D1306-R1308 VanDerWaalsContact OD1-CB 3.28Å; D1306-R1308 WeakPolarHBondContact OD1-CB 3.38Å; D1306-R1308 VanDerWaalsContact OD1-CG 3.3Å; D1306-R1308 WeakPolarHBondContact OD1-CG 3.15Å; D1306-R1308 PolarHBondContact OD1-N 3.03Å; D1306-R1308 WeakPolarHBondContact OD2-CD 2.96Å; D1306-L1309 HydrophobicContact CB-CD1 4.41Å; D1306-L1309 WeakPolarHBondContact O-CB 3.41Å; D1306-L1309 PolarHBondContact O-N 3.04Å
1307	Q	60.8	Low	62.7	Low	158 Å²	158	83.4 Å²	83.4	74%	0.738	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-0.6	175.5	-66.2	-178.3	-12.1	0	0	113.7	L1309 T1310	Q1307-L1309 VanDerWaalsContact C-N 3.32Å; Q1307-T1310 WeakPolarHBondContact CA-OG1 3.41Å; Q1307-T1310 PolarHBondContact O-OG1 2.55Å
1308	R	54.7	Low	60.5	Low	216 Å²	216	91.9 Å²	91.9	82%	0.815	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-16.2	164.4	-66.5	168.9	164	158.8	-4.8	113.6	D1306	D1306-R1308 PolarHBondContact O-N 3.49Å; D1306-R1308 VanDerWaalsContact OD1-CB 3.28Å; D1306-R1308 WeakPolarHBondContact OD1-CB 3.38Å; D1306-R1308 VanDerWaalsContact OD1-CG 3.3Å; D1306-R1308 WeakPolarHBondContact OD1-CG 3.15Å; D1306-R1308 PolarHBondContact OD1-N 3.03Å; D1306-R1308 WeakPolarHBondContact OD2-CD 2.96Å
1309	L	51.1	Low	57.8	Low	83 Å²	83	95.7 Å²	95.7	44%	0.435	49%	0.494	S	S	.	.	S	Bend	trans	-90.3	-10.1	176.4	-64.6	170.8	0	0	0	113.1	A1266 D1306 Q1307	A1266-L1309 HydrophobicContact CB-CD1 4.18Å; D1306-L1309 HydrophobicContact CB-CD1 4.41Å; D1306-L1309 WeakPolarHBondContact O-CB 3.41Å; D1306-L1309 PolarHBondContact O-N 3.04Å; Q1307-L1309 VanDerWaalsContact C-N 3.32Å
1310	T	50.8	Low	55.1	Low	26 Å²	26	99.2 Å²	99.2	16%	0.16	52%	0.522	C	S	.	.	S	Bend	trans	-77.7	133.9	164.3	30	0	0	0	0	110.5	E1209 P1304 Q1307 A1312	E1209-T1310 WeakPolarHBondContact O-CG2 3.26Å; P1304-T1310 HydrophobicContact CG-CG2 4.16Å; Q1307-T1310 WeakPolarHBondContact CA-OG1 3.41Å; Q1307-T1310 PolarHBondContact O-OG1 2.55Å; T1310-A1312 PolarHBondContact O-N 2.79Å; T1310-A1312 VanDerWaalsContact O-N 3.12Å
1311	L	47.9	Very low	52.5	Low	147 Å²	147	107.4 Å²	107.4	77%	0.77	56%	0.561	S	S	*	*	S	Bend	trans	-64.4	-19	-166.9	-78.4	164.1	0	0	0	115.4	V1204	V1204-L1311 HydrophobicContact CG1-CD1 4.11Å
1312	A	44.5	Very low	49.7	Very low	58 Å²	58	114.4 Å²	114.4	48%	0.479	60%	0.596	S	S	.	*			trans	-109.1	109.3	-177.8	0	0	0	0	0	112	T1310 C1314	T1310-A1312 PolarHBondContact O-N 2.79Å; T1310-A1312 VanDerWaalsContact O-N 3.12Å; A1312-C1314 PolarHBondContact O-N 3.22Å; A1312-C1314 VanDerWaalsContact O-N 3.17Å
1313	R	33.7	Very low	46.9	Very low	224 Å²	224	117.9 Å²	117.9	85%	0.845	62%	0.621	S	S	*	*			trans	-62.8	112.7	162.9	178.2	-177.1	-174.4	171.1	2.4	108.4	N1315	R1313-N1315 VanDerWaalsContact C-N 3.35Å; R1313-N1315 PolarHBondContact O-N 2.99Å
1314	C	31.2	Very low	44.3	Very low	119 Å²	119	124.1 Å²	124.1	80%	0.804	65%	0.649	S	S	*	*			trans	-56.8	94	173.8	-65.6	0	0	0	0	110.8	A1312 N1316	A1312-C1314 PolarHBondContact O-N 3.22Å; A1312-C1314 VanDerWaalsContact O-N 3.17Å; C1314-N1316 PolarHBondContact O-N 3.19Å; C1314-N1316 VanDerWaalsContact O-N 3.07Å
1315	N	34.1	Very low	41.9	Very low	123 Å²	123	130.1 Å²	130.1	66%	0.658	69%	0.686	S	S	*	*			trans	-90.1	81.7	-165.1	-163.1	26.1	0	0	0	110.6	R1313 N1317	R1313-N1315 VanDerWaalsContact C-N 3.35Å; R1313-N1315 PolarHBondContact O-N 2.99Å; N1315-N1317 PolarHBondContact O-N 3.3Å
1316	N	31.6	Very low	39.8	Very low	162 Å²	162	131.6 Å²	131.6	87%	0.866	69%	0.692	S	S	*	*			trans	-43.3	110.4	176.3	-95.9	-27.2	0	0	0	112.1	C1314	C1314-N1316 PolarHBondContact O-N 3.19Å; C1314-N1316 VanDerWaalsContact O-N 3.07Å
1317	N	34.2	Very low	38.2	Very low	118 Å²	118	134.5 Å²	134.5	63%	0.631	71%	0.708	S	S	*	*			trans	-148.1	117.4	175	-140.4	-23.9	0	0	0	111.3	N1315	N1315-N1317 PolarHBondContact O-N 3.3Å
1318	R	32	Very low	36.8	Very low	240 Å²	240	133 Å²	133	91%	0.906	71%	0.71	S	S	*	*			trans	68.3	75.6	164.6	-59.7	165.4	-170.2	-156.5	-2.9	117.5
1319	G	29.3	Very low	35.7	Very low	80 Å²	80	133.7 Å²	133.7	83%	0.825	71%	0.712	S	S	*	*			trans	-146.6	78.9	157.5	0	0	0	0	0	110.4
1320	S	31.7	Very low	34.7	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	73%	0.728	S	S	*	*			trans	-80.4	124.7	-174.6	56.4	0	0	0	0	112.5
1321	Q	36	Very low	33.6	Very low	173 Å²	173	138.5 Å²	138.5	81%	0.808	75%	0.754	S	S	*	*			trans	-152.3	139.1	131.3	-78	-140.7	9.3	0	0	111.8
1322	I	32.6	Very low	32.9	Very low	150 Å²	150	140 Å²	140	77%	0.769	76%	0.759	S	S	*	*			trans	16.6	145.2	133.6	-90.8	162.6	0	0	0	120.1
1323	S	31.3	Very low	32.4	Very low	74 Å²	74	147 Å²	147	52%	0.517	78%	0.775	S	S	.	*			cis	178.8	140.9	-30.5	59.3	0	0	0	0	109.4
1324	K	33.9	Very low	32.2	Very low	196 Å²	196	140.9 Å²	140.9	85%	0.852	77%	0.772	S	S	*	*			trans	65.6	162.2	170.4	-47.1	154.8	-176.4	173.4	0	112.3
1325	V	33.7	Very low	32.4	Very low	138 Å²	138	140.6 Å²	140.6	84%	0.836	77%	0.772	S	S	*	*			cis	-128.1	166	9.3	175.8	0	0	0	0	108.9
1326	S	35	Very low	32.3	Very low	88 Å²	88	141.5 Å²	141.5	62%	0.615	78%	0.776	S	S	*	*			trans	-93.3	167.6	-177.7	62.8	0	0	0	0	115.2
1327	D	32.2	Very low	32.4	Very low	135 Å²	135	141.5 Å²	141.5	72%	0.722	77%	0.771	S	S	*	*			trans	81.8	137.3	142.2	-70.7	-47.7	0	0	0	124.3
1328	T	30.7	Very low	32.3	Very low	127 Å²	127	140 Å²	140	78%	0.779	77%	0.77	S	S	*	*			trans	83.4	149.9	150.2	60.4	0	0	0	0	123.1
1329	R	32.1	Very low	32.3	Very low	229 Å²	229	135.7 Å²	135.7	86%	0.864	77%	0.765	S	S	*	*			trans	84.5	106.6	169	-46	-178.2	90	100.3	-0.2	114.4
1330	S	29.3	Very low	32.5	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	76%	0.763	S	S	*	*			cis	89.9	121.9	36.1	-54.9	0	0	0	0	115.6
1331	S	29.2	Very low	32.4	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	76%	0.762	S	S	*	*			trans	61.5	115.6	144.4	63.7	0	0	0	0	121.9
1332	M	33	Very low	32.3	Very low	178 Å²	178	140.1 Å²	140.1	88%	0.877	76%	0.76	S	S	*	*				-150.8	115	129	-104.2	169.4	166.3	0	0	107.5
1333	Y	33.2	Very low	32.2	Very low	206 Å²	206	141.4 Å²	141.4	81%	0.808	76%	0.763	S	S	*	*				58	106.9	88.5	-68.3	-65.9	0	0	0	112
1334	A	30.4	Very low	32.3	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	77%	0.771	S	S	*	*			cis	96	111.7	23	0	0	0	0	0	115.8
1335	S	34.6	Very low	32.3	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	76%	0.757	S	S	*	*			trans	-172	132.1	162.1	55.1	0	0	0	0	110.7
1336	N	32.5	Very low	32.4	Very low	142 Å²	142	140.2 Å²	140.2	76%	0.759	76%	0.756	S	S	*	*			trans	20.2	149.2	153.8	-56.5	18.2	0	0	0	120.7
1337	E	33.7	Very low	32.4	Very low	161 Å²	161	144.4 Å²	144.4	75%	0.752	76%	0.763	S	S	*	*			cis	-162.8	160.9	35.8	-140.9	137.2	-125.4	0	0	111.1
1338	S	32.5	Very low	32.4	Very low	87 Å²	87	143.1 Å²	143.1	61%	0.608	76%	0.756	S	S	*	*			trans	18.1	133.5	153.3	51.8	0	0	0	0	121.5
1339	D	31.3	Very low	32.7	Very low	149 Å²	149	145.2 Å²	145.2	80%	0.797	76%	0.761	S	S	*	*			cis	-154.5	157.8	7.3	-78.1	-38.5	0	0	0	113.2
1340	E	32.8	Very low	32.9	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	77%	0.765	S	S	*	*			trans	35.9	111.6	150.6	-63.8	-179.3	169	0	0	123.5
1341	E	31.4	Very low	33	Very low	172 Å²	172	142.3 Å²	142.3	80%	0.804	76%	0.761	S	S	*	*				69.7	136.4	126.1	-57.7	-163.7	167	0	0	122.2
1342	T	32.7	Very low	33.4	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	77%	0.765	S	S	*	*			cis	-148.8	141.2	-13.5	13.9	0	0	0	0	110.2
1343	E	31.3	Very low	33.4	Very low	178 Å²	178	143 Å²	143	83%	0.832	77%	0.765	S	S	*	*			trans	-104.1	-177.3	165.2	-69.6	-165.6	109.8	0	0	111
1344	D	32.3	Very low	33.5	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	76%	0.764	S	S	*	*			trans	67	113.9	159.4	-69.9	-31.7	0	0	0	121
1345	E	34.3	Very low	33.7	Very low	119 Å²	119	141.4 Å²	141.4	56%	0.556	77%	0.77	S	S	*	*				-153.8	113.5	98.2	-112.8	-157.2	123.4	0	0	113.2	K950	K950-E1345 WeakPolarHBondContact CD-OE2 3.31Å; K950-E1345 IonicContact NZ-OE1 3.84Å; K950-E1345 PolarHBondContact NZ-OE1 2.83Å; K950-E1345 IonicContact NZ-OE2 2.79Å; K950-E1345 PolarHBondContact NZ-OE2 2.58Å
1346	V	36.7	Very low	33.7	Very low	133 Å²	133	140.6 Å²	140.6	81%	0.806	77%	0.77	S	S	*	*			trans	-105.9	96.4	167.9	177.6	0	0	0	0	109.8
1347	K	33.8	Very low	33.6	Very low	177 Å²	177	147.1 Å²	147.1	77%	0.77	80%	0.796	S	S	*	*			trans	176.2	114.3	155.8	-97.7	146	-172.7	170	0	111
1348	D	32.5	Very low	33.6	Very low	107 Å²	107	146.4 Å²	146.4	57%	0.572	80%	0.798	S	S	*	*			trans	-175	48.3	148.2	-101.3	-20.3	0	0	0	113.4
1349	L	37.9	Very low	33.6	Very low	171 Å²	171	149.5 Å²	149.5	90%	0.895	81%	0.808	S	S	*	*	S	Bend	trans	-138.3	40.5	171.1	-78.7	-178.4	0	0	0	113.3
1350	L	35.2	Very low	33.8	Very low	180 Å²	180	149.6 Å²	149.6	94%	0.942	81%	0.809	S	S	*	*	S	Bend	trans	-140.4	50.8	173.5	-75.5	179.5	0	0	0	112.7
1351	S	32.7	Very low	33.8	Very low	98 Å²	98	148.5 Å²	148.5	69%	0.685	81%	0.81	S	S	*	*			trans	-147.3	15.5	-178.3	55.2	0	0	0	0	116.2
1352	V	36	Very low	34	Very low	130 Å²	130	147 Å²	147	79%	0.788	81%	0.811	S	S	*	*	S	Bend	trans	-131.3	67.2	177.3	-165.8	0	0	0	0	112.5
1353	N	34.5	Very low	34.1	Very low	164 Å²	164	148.6 Å²	148.6	88%	0.877	82%	0.815	S	S	*	*			trans	172.5	89.4	139.2	-92.9	-12.7	0	0	0	110.6
1354	A	34.2	Very low	34.2	Very low	94 Å²	94	146.5 Å²	146.5	78%	0.777	81%	0.813	S	S	*	*			trans	-142.7	75.1	166.9	0	0	0	0	0	108.7
1355	N	35.1	Very low	34.4	Very low	173 Å²	173	147.8 Å²	147.8	93%	0.925	82%	0.822	S	S	*	*	S	Bend	trans	-177.8	54.9	167.3	-96	-28.7	0	0	0	112.3
1356	A	34.6	Very low	34.4	Very low	96 Å²	96	150.2 Å²	150.2	79%	0.793	85%	0.845	S	S	*	*			trans	-161.8	92.1	167.1	0	0	0	0	0	111.8
1357	Q	29.7	Very low	34.2	Very low	279 Å²	279	151.7 Å²	151.7	100%	1.304	85%	0.848	S	S	*	*			trans	67.7	0	-172.5	-62.1	-171.2	-44.7	0	0	115.8

Retrieved 1,357 of 1,357 residues in 730 ms (Link to these results)

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